A0A087Y9P3_POEFO Loading...

Neuronal acetylcholine receptor subunit alpha-7

AlphaFold DB , UniProt , Accession A0A087Y9P3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 510 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	55.2	Low	68.1	Low	194 Å²	194	115 Å²	115	96%	0.956	61%	0.606	S	S	*	*				0	43.6	0	-164.4	165	171.1	0	0	111.4
2	D	63.8	Low	68.1	Low	126 Å²	126	113.6 Å²	113.6	67%	0.674	60%	0.597	S	S	*	*			trans	-120.2	-36.8	-140.5	-32.5	-65.1	0	0	0	114.3	L4 N5 F6	D2-L4 PolarHBondContact O-N 3.12Å; D2-N5 PolarHBondContact O-N 3.35Å; D2-F6 WeakPolarHBondContact O-CB 3.43Å; D2-F6 PolarHBondContact O-N 3.45Å
3	L	64.1	Low	67.7	Low	141 Å²	141	109.9 Å²	109.9	74%	0.738	59%	0.587	S	S	*	*	H	α-helix	trans	-63.2	-40.2	-176.3	-163.3	74.4	0	0	0	112.3	F6 M7	L3-F6 PolarHBondContact O-N 3.43Å; L3-M7 WeakPolarHBondContact O-CB 3.44Å; L3-M7 VanDerWaalsContact O-CG 3.24Å; L3-M7 WeakPolarHBondContact O-CG 3.23Å; L3-M7 PolarHBondContact O-N 3.38Å
4	L	71.2	Confident	67.4	Low	133 Å²	133	109.3 Å²	109.3	70%	0.696	59%	0.589	S	S	*	*	H	α-helix	trans	-66.4	-43	179.2	-168.7	71.5	0	0	0	111.6	D2 M7 L8	D2-L4 PolarHBondContact O-N 3.12Å; L4-M7 PolarHBondContact O-N 3.27Å; L4-L8 WeakPolarHBondContact O-CB 3.42Å; L4-L8 PolarHBondContact O-N 3.2Å
5	N	69.5	Low	66.9	Low	95 Å²	95	109.7 Å²	109.7	51%	0.508	60%	0.601	S	S	.	*	H	α-helix	trans	-67.2	-38.4	177.3	-74.5	-10.9	0	0	0	111.6	D2 L8 L9	D2-N5 PolarHBondContact O-N 3.35Å; N5-L8 PolarHBondContact O-N 2.89Å; N5-L9 WeakPolarHBondContact O-CB 3.41Å; N5-L9 PolarHBondContact O-N 3.2Å
6	F	74	Confident	66.4	Low	133 Å²	133	109 Å²	109	58%	0.583	60%	0.601	S	S	*	*	H	α-helix	trans	-63.8	-45.5	174.1	-173.6	-97.4	0	0	0	111.7	D2 L3 L8 L9 V10	D2-F6 WeakPolarHBondContact O-CB 3.43Å; D2-F6 PolarHBondContact O-N 3.45Å; L3-F6 PolarHBondContact O-N 3.43Å; F6-L8 VanDerWaalsContact C-N 3.31Å; F6-L8 PolarHBondContact O-N 2.98Å; F6-L9 PolarHBondContact O-N 3.11Å; F6-V10 HydrophobicContact CD1-CG2 4.08Å; F6-V10 HydrophobicContact CE1-CG2 3.72Å; F6-V10 HydrophobicContact CZ-CG2 3.96Å; F6-V10 WeakPolarHBondContact O-CG2 3.28Å; F6-V10 PolarHBondContact O-N 3.1Å
7	M	71.6	Confident	66	Low	123 Å²	123	108 Å²	108	61%	0.606	60%	0.599	S	S	*	*	H	α-helix	trans	-64.2	-34.6	176.1	-68.8	-67.5	-76.4	0	0	112.4	L3 L4 G11	L3-M7 WeakPolarHBondContact O-CB 3.44Å; L3-M7 VanDerWaalsContact O-CG 3.24Å; L3-M7 WeakPolarHBondContact O-CG 3.23Å; L3-M7 PolarHBondContact O-N 3.38Å; L4-M7 PolarHBondContact O-N 3.27Å; M7-G11 PolarHBondContact O-N 3.09Å
8	L	72.2	Confident	65.7	Low	96 Å²	96	112.9 Å²	112.9	50%	0.503	61%	0.613	S	S	.	*	H	α-helix	trans	-65.5	-44.6	170.9	-105.1	159.2	0	0	0	112.1	L4 N5 F6 G11 I12	L4-L8 WeakPolarHBondContact O-CB 3.42Å; L4-L8 PolarHBondContact O-N 3.2Å; N5-L8 PolarHBondContact O-N 2.89Å; F6-L8 VanDerWaalsContact C-N 3.31Å; F6-L8 PolarHBondContact O-N 2.98Å; L8-G11 PolarHBondContact O-N 2.84Å; L8-I12 HydrophobicContact CD2-CD1 4.1Å; L8-I12 WeakPolarHBondContact O-CB 3.24Å; L8-I12 WeakPolarHBondContact O-CD1 3.33Å; L8-I12 VanDerWaalsContact O-CG1 3.23Å; L8-I12 WeakPolarHBondContact O-CG1 3.26Å; L8-I12 PolarHBondContact O-N 3.47Å
9	L	69.2	Low	65.3	Low	125 Å²	125	113.5 Å²	113.5	65%	0.654	62%	0.62	S	S	*	*	H	α-helix	trans	-63.4	-42.4	176.7	-112.5	160.6	0	0	0	112.2	N5 F6 S13	N5-L9 WeakPolarHBondContact O-CB 3.41Å; N5-L9 PolarHBondContact O-N 3.2Å; F6-L9 PolarHBondContact O-N 3.11Å; L9-S13 VanDerWaalsContact O-CB 3.24Å; L9-S13 WeakPolarHBondContact O-CB 3.02Å; L9-S13 PolarHBondContact O-N 3.43Å
10	V	70.6	Confident	64.9	Low	65 Å²	65	113 Å²	113	39%	0.394	63%	0.626	S	S	.	*	H	α-helix	trans	-66.2	-42.8	174.4	172.8	0	0	0	0	110.9	F6 S13 V14	F6-V10 HydrophobicContact CD1-CG2 4.08Å; F6-V10 HydrophobicContact CE1-CG2 3.72Å; F6-V10 HydrophobicContact CZ-CG2 3.96Å; F6-V10 WeakPolarHBondContact O-CG2 3.28Å; F6-V10 PolarHBondContact O-N 3.1Å; V10-S13 WeakPolarHBondContact O-CB 3.42Å; V10-S13 PolarHBondContact O-N 2.77Å; V10-V14 HydrophobicContact CG1-CG2 4.4Å; V10-V14 WeakPolarHBondContact O-CG2 3.46Å; V10-V14 PolarHBondContact O-N 3.01Å
11	G	68.1	Low	64.6	Low	34 Å²	34	115 Å²	115	35%	0.351	63%	0.631	S	S	.	*	H	α-helix	trans	-61.9	-45.5	175.8	0	0	0	0	0	113	M7 L8 S13 V14 C15	M7-G11 PolarHBondContact O-N 3.09Å; L8-G11 PolarHBondContact O-N 2.84Å; G11-S13 VanDerWaalsContact C-N 3.33Å; G11-S13 PolarHBondContact O-N 2.69Å; G11-V14 PolarHBondContact O-N 3.29Å; G11-C15 WeakPolarHBondContact O-CB 3.49Å; G11-C15 PolarHBondContact O-N 3.09Å; G11-C15 PolarHBondContact O-SG 3.48Å
12	I	67.2	Low	65	Low	98 Å²	98	114.4 Å²	114.4	50%	0.503	63%	0.625	S	S	.	*	H	α-helix	trans	-64.3	-39.7	175.3	-68.4	164	0	0	0	110.4	L8 C15 T16	L8-I12 HydrophobicContact CD2-CD1 4.1Å; L8-I12 WeakPolarHBondContact O-CB 3.24Å; L8-I12 WeakPolarHBondContact O-CD1 3.33Å; L8-I12 VanDerWaalsContact O-CG1 3.23Å; L8-I12 WeakPolarHBondContact O-CG1 3.26Å; L8-I12 PolarHBondContact O-N 3.47Å; I12-C15 PolarHBondContact O-N 2.89Å; I12-T16 HydrophobicContact CG2-CG2 4.45Å; I12-T16 WeakPolarHBondContact O-CB 3.39Å; I12-T16 WeakPolarHBondContact O-CG2 3.39Å; I12-T16 PolarHBondContact O-N 2.97Å; I12-T16 PolarHBondContact O-OG1 2.93Å
13	S	63.1	Low	65.4	Low	66 Å²	66	110.3 Å²	110.3	46%	0.462	61%	0.613	S	S	.	*	H	α-helix	trans	-60.9	-52.1	174.7	-175.2	0	0	0	0	111.2	L9 V10 G11 C15 T16 V17	L9-S13 VanDerWaalsContact O-CB 3.24Å; L9-S13 WeakPolarHBondContact O-CB 3.02Å; L9-S13 PolarHBondContact O-N 3.43Å; V10-S13 WeakPolarHBondContact O-CB 3.42Å; V10-S13 PolarHBondContact O-N 2.77Å; G11-S13 VanDerWaalsContact C-N 3.33Å; G11-S13 PolarHBondContact O-N 2.69Å; S13-C15 VanDerWaalsContact C-N 3.3Å; S13-C15 PolarHBondContact O-N 3.15Å; S13-T16 WeakPolarHBondContact CA-OG1 3.32Å; S13-T16 CarbonylContact O-C 3.54Å; S13-T16 PolarHBondContact O-N 3.42Å; S13-T16 PolarHBondContact O-OG1 2.91Å; S13-T16 VanDerWaalsContact O-OG1 3.1Å; S13-V17 WeakPolarHBondContact O-CG2 3.11Å; S13-V17 PolarHBondContact O-N 3.4Å
14	V	63.3	Low	66.2	Low	101 Å²	101	106.9 Å²	106.9	61%	0.612	60%	0.599	S	S	*	*	H	α-helix	trans	-60.9	-36.1	177.9	172.1	0	0	0	0	112.2	V10 G11	V10-V14 HydrophobicContact CG1-CG2 4.4Å; V10-V14 WeakPolarHBondContact O-CG2 3.46Å; V10-V14 PolarHBondContact O-N 3.01Å; G11-V14 PolarHBondContact O-N 3.29Å
15	C	60	Low	66.9	Low	115 Å²	115	101.9 Å²	101.9	78%	0.777	58%	0.575	S	S	*	*	H	α-helix	trans	-76.4	-18.8	174.9	-69.2	0	0	0	0	114.5	G11 I12 S13	G11-C15 WeakPolarHBondContact O-CB 3.49Å; G11-C15 PolarHBondContact O-N 3.09Å; G11-C15 PolarHBondContact O-SG 3.48Å; I12-C15 PolarHBondContact O-N 2.89Å; S13-C15 VanDerWaalsContact C-N 3.3Å; S13-C15 PolarHBondContact O-N 3.15Å
16	T	60	Low	67.7	Low	99 Å²	99	101 Å²	101	61%	0.607	57%	0.568	S	S	*	*	H	α-helix	trans	-99.1	-11.7	176.2	50.9	0	0	0	0	113.3	I12 S13 K18	I12-T16 HydrophobicContact CG2-CG2 4.45Å; I12-T16 WeakPolarHBondContact O-CB 3.39Å; I12-T16 WeakPolarHBondContact O-CG2 3.39Å; I12-T16 PolarHBondContact O-N 2.97Å; I12-T16 PolarHBondContact O-OG1 2.93Å; S13-T16 WeakPolarHBondContact CA-OG1 3.32Å; S13-T16 CarbonylContact O-C 3.54Å; S13-T16 PolarHBondContact O-N 3.42Å; S13-T16 PolarHBondContact O-OG1 2.91Å; S13-T16 VanDerWaalsContact O-OG1 3.1Å; T16-K18 VanDerWaalsContact C-N 3.26Å; T16-K18 PolarHBondContact O-N 3.42Å
17	V	58.8	Low	68.4	Low	92 Å²	92	104.2 Å²	104.2	56%	0.558	58%	0.576	S	S	*	*			trans	-62.9	91.6	157.8	174.7	0	0	0	0	108.3	S13 V19	S13-V17 WeakPolarHBondContact O-CG2 3.11Å; S13-V17 PolarHBondContact O-N 3.4Å; V17-V19 VanDerWaalsContact C-N 3.3Å; V17-V19 PolarHBondContact O-N 3.48Å
18	K	60.8	Low	69.3	Low	196 Å²	196	104 Å²	104	85%	0.852	57%	0.572	S	S	*	*			trans	-58.2	99.8	156.9	-72.7	-175.8	178.2	-179.3	0	107	T16 S20	T16-K18 VanDerWaalsContact C-N 3.26Å; T16-K18 PolarHBondContact O-N 3.42Å; K18-S20 PolarHBondContact O-N 2.93Å
19	V	58.3	Low	70.2	Confident	124 Å²	124	99.5 Å²	99.5	75%	0.752	55%	0.548	S	S	*	.			trans	-48.7	119.6	169	176.4	0	0	0	0	106.9	V17 Q21	V17-V19 VanDerWaalsContact C-N 3.3Å; V17-V19 PolarHBondContact O-N 3.48Å; V19-Q21 PolarHBondContact O-N 3Å
20	S	57.4	Low	71.3	Confident	104 Å²	104	96.7 Å²	96.7	73%	0.727	53%	0.53	S	S	*	.			trans	-58.3	110.5	-178.5	-170.9	0	0	0	0	108.2	K18 Q22	K18-S20 PolarHBondContact O-N 2.93Å; S20-Q22 PolarHBondContact O-N 3.13Å
21	Q	57.3	Low	72.2	Confident	156 Å²	156	97.2 Å²	97.2	73%	0.729	54%	0.536	S	S	*	.			trans	-61.1	128.3	169.8	-67.8	-170.2	3.1	0	0	106.4	V19	V19-Q21 PolarHBondContact O-N 3Å
22	Q	64.4	Low	73.4	Confident	181 Å²	181	99.2 Å²	99.2	85%	0.846	54%	0.538	S	S	*	.			trans	-73.9	-140	179.9	-63.4	178.7	-7.6	0	0	109	S20 P24	S20-Q22 PolarHBondContact O-N 3.13Å; Q22-P24 WeakPolarHBondContact O-CD 3.19Å
23	G	71.9	Confident	74.6	Confident	40 Å²	40	95.5 Å²	95.5	41%	0.412	52%	0.52	S	S	.	.	S	Bend	trans	-95.1	34.4	178.5	0	0	0	0	0	117.7	S25 Q26 R27	G23-S25 VanDerWaalsContact C-N 3.34Å; G23-S25 PolarHBondContact O-N 3.17Å; G23-Q26 PolarHBondContact O-N 3.05Å; G23-R27 PolarHBondContact O-N 3.42Å
24	P	82	Confident	76	Confident	69 Å²	69	95.3 Å²	95.3	45%	0.448	51%	0.512	S	S	.	.	H	α-helix	trans	-68.3	-34.2	-173.7	31.8	-33.6	0	0	0	111.8	Q22 R27 K28	Q22-P24 WeakPolarHBondContact O-CD 3.19Å; P24-R27 PolarHBondContact O-N 2.87Å; P24-K28 VanDerWaalsContact O-CB 3.25Å; P24-K28 WeakPolarHBondContact O-CB 3.4Å; P24-K28 PolarHBondContact O-N 3.2Å
25	S	84.6	Confident	77.4	Confident	28 Å²	28	95.7 Å²	95.7	20%	0.196	52%	0.515	C	S	.	.	H	α-helix	trans	-58.3	-50.5	175.2	-48.5	0	0	0	0	111.2	G23 K28 L29 Y94	G23-S25 VanDerWaalsContact C-N 3.34Å; G23-S25 PolarHBondContact O-N 3.17Å; S25-K28 PolarHBondContact O-N 3.02Å; S25-L29 WeakPolarHBondContact O-CB 3.42Å; S25-L29 PolarHBondContact O-N 2.85Å; S25-Y94 WeakPolarHBondContact O-CD1 3.43Å
26	Q	87.4	Confident	78.8	Confident	76 Å²	76	94 Å²	94	36%	0.355	52%	0.517	S	S	.	.	H	α-helix	trans	-66.5	-40.7	179.4	-166.9	-176.3	-2.7	0	0	111.9	G23 L29 Y30 V97 V100	G23-Q26 PolarHBondContact O-N 3.05Å; Q26-L29 PolarHBondContact O-N 3.39Å; Q26-Y30 HydrophobicContact CG-CD2 4.02Å; Q26-Y30 HydrophobicContact CG-CE2 3.67Å; Q26-Y30 WeakPolarHBondContact O-CD2 3.47Å; Q26-Y30 PolarHBondContact O-N 3.4Å; Q26-V97 HydrophobicContact CB-CG1 4.48Å; Q26-V97 HydrophobicContact CB-CG2 4.05Å; Q26-V97 HydrophobicContact CG-CG1 4.25Å; Q26-V100 HydrophobicContact CG-CG1 4.36Å
27	R	88.2	Confident	80.4	Confident	200 Å²	200	90.6 Å²	90.6	76%	0.755	49%	0.493	S	S	*	.	H	α-helix	trans	-62.9	-42.5	175.6	-174.7	-180	-66.5	161	0.5	112.2	G23 P24 S31	G23-R27 PolarHBondContact O-N 3.42Å; P24-R27 PolarHBondContact O-N 2.87Å; R27-S31 PolarHBondContact O-N 3.39Å; R27-S31 VanDerWaalsContact O-N 3.14Å
28	K	90.1	Very high	82	Confident	119 Å²	119	89.6 Å²	89.6	52%	0.517	49%	0.485	S	S	.	.	H	α-helix	trans	-64	-42.9	175.4	-175.1	-171.2	172.6	-163.9	0	110.8	P24 S25 S31 N32 Y94	P24-K28 VanDerWaalsContact O-CB 3.25Å; P24-K28 WeakPolarHBondContact O-CB 3.4Å; P24-K28 PolarHBondContact O-N 3.2Å; S25-K28 PolarHBondContact O-N 3.02Å; K28-S31 PolarHBondContact O-N 3.23Å; K28-N32 WeakPolarHBondContact O-CB 3.34Å; K28-N32 VanDerWaalsContact O-CG 3.26Å; K28-N32 PolarHBondContact O-N 3.3Å; K28-Y94 HydrophobicContact CB-CE1 4.29Å; K28-Y94 HydrophobicContact CD-CE1 4.04Å; K28-Y94 HydrophobicContact CG-CE1 4.1Å
29	L	91.9	Very high	83.5	Confident	1 Å²	1	82.6 Å²	82.6	1%	0.005	46%	0.459	C	S	.	.	H	α-helix	trans	-59.6	-50	176.7	-179.4	63.4	0	0	0	111.6	S25 Q26 S31 N32 L33 W89 Y94 V97 V100	S25-L29 WeakPolarHBondContact O-CB 3.42Å; S25-L29 PolarHBondContact O-N 2.85Å; Q26-L29 PolarHBondContact O-N 3.39Å; L29-S31 VanDerWaalsContact C-N 3.33Å; L29-S31 PolarHBondContact O-N 3.32Å; L29-N32 PolarHBondContact O-N 2.67Å; L29-N32 VanDerWaalsContact O-N 3.11Å; L29-L33 HydrophobicContact CD1-CD1 3.81Å; L29-L33 HydrophobicContact CD1-CD2 4.25Å; L29-L33 HydrophobicContact CD1-CG 3.79Å; L29-L33 HydrophobicContact CD2-CD1 4.43Å; L29-L33 HydrophobicContact CG-CD1 3.82Å; L29-L33 HydrophobicContact CG-CG 4.18Å; L29-L33 WeakPolarHBondContact O-CG 3.33Å; L29-L33 PolarHBondContact O-N 2.93Å; L29-W89 HydrophobicContact CD1-CB 3.71Å; L29-W89 HydrophobicContact CD1-CD2 3.88Å; L29-W89 HydrophobicContact CD1-CE3 4.38Å; L29-W89 HydrophobicContact CD1-CG 3.57Å; L29-W89 HydrophobicContact CD2-CD2 3.73Å; L29-W89 HydrophobicContact CD2-CE3 4.3Å; L29-W89 HydrophobicContact CD2-CG 4.04Å; L29-W89 HydrophobicContact CD2-CH2 4.49Å; L29-W89 HydrophobicContact CD2-CZ2 3.91Å; L29-W89 HydrophobicContact CG-CD2 4.39Å; L29-W89 HydrophobicContact CG-CG 4.47Å; L29-Y94 HydrophobicContact CB-CD1 3.76Å; L29-Y94 HydrophobicContact CB-CE1 3.83Å; L29-Y94 HydrophobicContact CB-CG 4.23Å; L29-Y94 HydrophobicContact CD1-CD1 4.38Å; L29-Y94 HydrophobicContact CD1-CD2 3.93Å; L29-Y94 HydrophobicContact CD1-CE1 4.21Å; L29-Y94 HydrophobicContact CD1-CE2 3.76Å; L29-Y94 HydrophobicContact CD1-CG 4.24Å; L29-V97 HydrophobicContact CD2-CB 4.45Å; L29-V97 HydrophobicContact CD2-CG1 3.65Å; L29-V100 HydrophobicContact CD2-CG1 3.68Å
30	Y	91.5	Very high	85.1	Confident	67 Å²	67	83.9 Å²	83.9	26%	0.263	46%	0.461	S	S	.	.	H	α-helix	trans	-56	-45.8	175.3	-80	-63.2	0	0	0	112.3	Q26 N32 M34 V100 R101 F102	Q26-Y30 HydrophobicContact CG-CD2 4.02Å; Q26-Y30 HydrophobicContact CG-CE2 3.67Å; Q26-Y30 WeakPolarHBondContact O-CD2 3.47Å; Q26-Y30 PolarHBondContact O-N 3.4Å; Y30-N32 VanDerWaalsContact C-N 3.27Å; Y30-N32 PolarHBondContact O-N 2.96Å; Y30-M34 WeakPolarHBondContact O-CB 3.28Å; Y30-M34 VanDerWaalsContact O-CG 3.25Å; Y30-M34 WeakPolarHBondContact O-CG 3.44Å; Y30-M34 PolarHBondContact O-N 2.81Å; Y30-M34 VanDerWaalsContact O-N 3.09Å; Y30-V100 HydrophobicContact CE1-CB 4.21Å; Y30-R101 WeakPolarHBondContact CE1-O 3.24Å; Y30-R101 PolarHBondContact OH-N 3.38Å; Y30-R101 PolarHBondContact OH-O 3.15Å; Y30-F102 HydrophobicContact CD1-CD1 4.24Å; Y30-F102 AromaticContact CD1-CE1 3.59Å; Y30-F102 HydrophobicContact CD1-CE1 3.59Å; Y30-F102 AromaticContact CD1-CZ 3.91Å; Y30-F102 HydrophobicContact CD1-CZ 3.91Å; Y30-F102 HydrophobicContact CE1-CD1 4.02Å; Y30-F102 AromaticContact CE1-CE1 3.73Å; Y30-F102 HydrophobicContact CE1-CE1 3.73Å; Y30-F102 HydrophobicContact CE1-CE2 4.45Å; Y30-F102 HydrophobicContact CE1-CG 4.49Å; Y30-F102 AromaticContact CE1-CZ 3.98Å; Y30-F102 HydrophobicContact CE1-CZ 3.98Å
31	S	90.5	Very high	86.7	Confident	75 Å²	75	82.6 Å²	82.6	52%	0.524	44%	0.443	S	S	.	.	H	α-helix	trans	-61.4	-37	178.1	-166.1	0	0	0	0	112.4	R27 K28 L29 T35	R27-S31 PolarHBondContact O-N 3.39Å; R27-S31 VanDerWaalsContact O-N 3.14Å; K28-S31 PolarHBondContact O-N 3.23Å; L29-S31 VanDerWaalsContact C-N 3.33Å; L29-S31 PolarHBondContact O-N 3.32Å; S31-T35 PolarHBondContact O-OG1 2.7Å
32	N	92.4	Very high	88.4	Confident	76 Å²	76	76.8 Å²	76.8	41%	0.406	42%	0.415	S	S	.	.	H	α-helix	trans	-77.4	-45.7	-178	-71.8	-5.5	0	0	0	111.9	K28 L29 Y30 M34 T35 Y94	K28-N32 WeakPolarHBondContact O-CB 3.34Å; K28-N32 VanDerWaalsContact O-CG 3.26Å; K28-N32 PolarHBondContact O-N 3.3Å; L29-N32 PolarHBondContact O-N 2.67Å; L29-N32 VanDerWaalsContact O-N 3.11Å; Y30-N32 VanDerWaalsContact C-N 3.27Å; Y30-N32 PolarHBondContact O-N 2.96Å; N32-M34 VanDerWaalsContact C-N 3.32Å; N32-M34 PolarHBondContact O-N 2.82Å; N32-T35 WeakPolarHBondContact O-CB 3.2Å; N32-T35 PolarHBondContact O-N 3.02Å; N32-Y94 PolarHBondContact ND2-OH 2.86Å
33	L	92.5	Very high	89.8	Confident	21 Å²	21	68.3 Å²	68.3	11%	0.11	38%	0.375	C	S	.	.	H	α-helix	trans	-63.6	-36.3	178	-67.5	179	0	0	0	112.4	L29 T35 L87 W89 F102	L29-L33 HydrophobicContact CD1-CD1 3.81Å; L29-L33 HydrophobicContact CD1-CD2 4.25Å; L29-L33 HydrophobicContact CD1-CG 3.79Å; L29-L33 HydrophobicContact CD2-CD1 4.43Å; L29-L33 HydrophobicContact CG-CD1 3.82Å; L29-L33 HydrophobicContact CG-CG 4.18Å; L29-L33 WeakPolarHBondContact O-CG 3.33Å; L29-L33 PolarHBondContact O-N 2.93Å; L33-T35 VanDerWaalsContact C-N 3.28Å; L33-T35 PolarHBondContact O-N 3.32Å; L33-L87 HydrophobicContact CB-CD2 4.35Å; L33-W89 HydrophobicContact CD1-CE3 3.87Å; L33-W89 HydrophobicContact CD1-CZ3 4.15Å; L33-F102 HydrophobicContact CB-CZ 4.45Å; L33-F102 HydrophobicContact CD1-CE2 4.47Å; L33-F102 HydrophobicContact CD1-CZ 4.01Å
34	M	92.8	Very high	90.8	Very high	61 Å²	61	67 Å²	67	30%	0.3	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-2.5	178.1	-62.7	-55.7	-56.6	0	0	113.9	Y30 N32 G36 F102 L106	Y30-M34 WeakPolarHBondContact O-CB 3.28Å; Y30-M34 VanDerWaalsContact O-CG 3.25Å; Y30-M34 WeakPolarHBondContact O-CG 3.44Å; Y30-M34 PolarHBondContact O-N 2.81Å; Y30-M34 VanDerWaalsContact O-N 3.09Å; N32-M34 VanDerWaalsContact C-N 3.32Å; N32-M34 PolarHBondContact O-N 2.82Å; M34-G36 PolarHBondContact O-N 3.02Å; M34-F102 HydrophobicContact CG-CE1 4.22Å; M34-F102 HydrophobicContact SD-CD1 4.15Å; M34-F102 HydrophobicContact SD-CE1 3.62Å; M34-L106 HydrophobicContact CE-CB 4.3Å; M34-L106 WeakPolarHBondContact CE-O 3.32Å
35	T	92.4	Very high	91.2	Very high	110 Å²	110	70.7 Å²	70.7	68%	0.675	37%	0.369	S	S	*	.	S	Bend	trans	-79.5	93.4	179.5	-66.4	0	0	0	0	110.2	S31 N32 L33	S31-T35 PolarHBondContact O-OG1 2.7Å; N32-T35 WeakPolarHBondContact O-CB 3.2Å; N32-T35 PolarHBondContact O-N 3.02Å; L33-T35 VanDerWaalsContact C-N 3.28Å; L33-T35 PolarHBondContact O-N 3.32Å
36	G	88.8	Confident	91.6	Very high	79 Å²	79	73.2 Å²	73.2	81%	0.814	38%	0.38	S	S	*	.	S	Bend	trans	96.7	0	177.7	0	0	0	0	0	115.2	M34	M34-G36 PolarHBondContact O-N 3.02Å
37	Y	94.3	Very high	91.7	Very high	27 Å²	27	76 Å²	76	11%	0.106	40%	0.398	C	S	.	.			trans	-68.2	135.2	174.7	-170.5	-79.2	0	0	0	111.3	P39 D84 Y86 L87 I107 W108	Y37-P39 HydrophobicContact CD1-CG 4.3Å; Y37-P39 HydrophobicContact CE1-CG 4.32Å; Y37-D84 WeakPolarHBondContact CE2-OD2 3.33Å; Y37-D84 PolarHBondContact OH-OD2 3.01Å; Y37-Y86 HydrophobicContact CE2-CD2 4.43Å; Y37-L87 HydrophobicContact CD2-CD2 3.81Å; Y37-L87 HydrophobicContact CD2-CG 4.3Å; Y37-L87 HydrophobicContact CE2-CD1 4.19Å; Y37-L87 HydrophobicContact CE2-CD2 3.71Å; Y37-L87 HydrophobicContact CE2-CG 3.72Å; Y37-I107 HydrophobicContact CE1-CB 4.04Å; Y37-I107 HydrophobicContact CE1-CG2 4.17Å; Y37-W108 PolarHBondContact OH-N 3.44Å
38	N	92.7	Very high	91.8	Very high	72 Å²	72	71.2 Å²	71.2	39%	0.385	40%	0.395	S	S	.	.			trans	-118.6	109.9	179	178.5	11.8	0	0	0	111	L40 E41	N38-L40 PolarHBondContact O-N 3.18Å; N38-L40 PolarHBondContact OD1-N 3.18Å; N38-E41 HydrophobicContact CB-CB 4.13Å; N38-E41 WeakPolarHBondContact O-CB 3.29Å; N38-E41 PolarHBondContact O-N 3.04Å
39	P	91.9	Very high	91.9	Very high	49 Å²	49	70.8 Å²	70.8	32%	0.318	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-12.8	-179	-23.8	35.1	0	0	0	115.8	Y37	Y37-P39 HydrophobicContact CD1-CG 4.3Å; Y37-P39 HydrophobicContact CE1-CG 4.32Å
40	L	91.3	Very high	92	Very high	150 Å²	150	72.8 Å²	72.8	79%	0.785	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-11.9	175.1	-56.4	178.7	0	0	0	112.8	N38	N38-L40 PolarHBondContact O-N 3.18Å; N38-L40 PolarHBondContact OD1-N 3.18Å
41	E	91.5	Very high	92.1	Very high	77 Å²	77	70.1 Å²	70.1	36%	0.36	40%	0.399	S	S	.	.	S	Bend	trans	-90.5	128.9	-178.8	-165.8	178.5	135.4	0	0	110.5	N38 Y86	N38-E41 HydrophobicContact CB-CB 4.13Å; N38-E41 WeakPolarHBondContact O-CB 3.29Å; N38-E41 PolarHBondContact O-N 3.04Å; E41-Y86 VanDerWaalsContact OE1-CE2 3.29Å; E41-Y86 WeakPolarHBondContact OE1-CE2 3.39Å; E41-Y86 VanDerWaalsContact OE1-CZ 3.29Å; E41-Y86 PolarHBondContact OE1-OH 2.96Å
42	R	93.7	Very high	92.4	Very high	35 Å²	35	69 Å²	69	13%	0.132	39%	0.389	C	S	.	.			trans	-72.2	121.4	177	177.2	-176.2	57	119.7	10.7	108.8	V44 D47 Q49 L51 W108 S177	R42-V44 VanDerWaalsContact C-N 3.32Å; R42-V44 HydrophobicContact CG-CG1 4.42Å; R42-V44 PolarHBondContact O-N 3.48Å; R42-D47 PolarHBondContact NH2-O 3.13Å; R42-Q49 PolarHBondContact NH1-O 2.82Å; R42-L51 HydrophobicContact CG-CB 4.35Å; R42-L51 HydrophobicContact CG-CD2 4.1Å; R42-W108 HydrophobicContact CG-CZ2 4.32Å; R42-S177 PolarHBondContact NH1-O 2.95Å
43	P	94.1	Very high	92.6	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.013	37%	0.369	C	S	.	.			trans	-81.5	68.8	-163.5	32.9	-38.8	0	0	0	113.8	L51 D84 Y86 W108	P43-L51 HydrophobicContact CG-CD2 4.27Å; P43-D84 HydrophobicContact CB-CB 4.07Å; P43-D84 WeakPolarHBondContact CB-OD2 3.47Å; P43-D84 HydrophobicContact CG-CB 4.17Å; P43-Y86 HydrophobicContact CB-CD2 4.25Å; P43-W108 VanDerWaalsContact CD-CD2 3.44Å; P43-W108 HydrophobicContact CG-CB 4.47Å; P43-W108 HydrophobicContact CG-CD2 4.22Å; P43-W108 HydrophobicContact CG-CE3 3.89Å; P43-W108 HydrophobicContact CG-CG 4.48Å
44	V	93.3	Very high	92.8	Very high	13 Å²	13	70.1 Å²	70.1	8%	0.079	39%	0.387	C	S	.	.			trans	-110.3	153	175.2	-67.2	0	0	0	0	111.5	R42 N46 L51	R42-V44 VanDerWaalsContact C-N 3.32Å; R42-V44 HydrophobicContact CG-CG1 4.42Å; R42-V44 PolarHBondContact O-N 3.48Å; V44-N46 VanDerWaalsContact C-N 3.29Å; V44-N46 WeakPolarHBondContact CG2-O 3.35Å; V44-N46 PolarHBondContact O-N 2.81Å; V44-L51 HydrophobicContact CG1-CB 3.96Å; V44-L51 HydrophobicContact CG1-CD1 4.29Å
45	F	89.4	Confident	93.1	Very high	147 Å²	147	67.3 Å²	67.3	65%	0.645	37%	0.372	S	S	*	.	S	Bend	trans	-72.6	-21.8	176.3	-178.2	-98.7	0	0	0	113.5	Y85	F45-Y85 HydrophobicContact CB-CG 4.46Å; F45-Y85 HydrophobicContact CD2-CD1 4.21Å; F45-Y85 HydrophobicContact CD2-CD2 4.26Å; F45-Y85 AromaticContact CD2-CE1 3.75Å; F45-Y85 HydrophobicContact CD2-CE1 3.75Å; F45-Y85 AromaticContact CD2-CE2 3.79Å; F45-Y85 HydrophobicContact CD2-CE2 3.79Å; F45-Y85 HydrophobicContact CD2-CG 4.46Å; F45-Y85 AromaticContact CD2-CZ 3.53Å; F45-Y85 HydrophobicContact CE2-CE1 4.31Å; F45-Y85 HydrophobicContact CE2-CE2 4.41Å; F45-Y85 AromaticContact CE2-CZ 3.91Å
46	N	92.8	Very high	93.3	Very high	81 Å²	81	62 Å²	62	43%	0.433	34%	0.34	S	S	.	.	S	Bend	trans	-149.3	129.6	-179	172.4	4	0	0	0	108.2	V44 S48 Q49	V44-N46 VanDerWaalsContact C-N 3.29Å; V44-N46 WeakPolarHBondContact CG2-O 3.35Å; V44-N46 PolarHBondContact O-N 2.81Å; N46-S48 PolarHBondContact ND2-OG 2.84Å; N46-S48 PolarHBondContact O-N 3.03Å; N46-S48 VanDerWaalsContact O-N 3.11Å; N46-S48 PolarHBondContact OD1-N 3.17Å; N46-S48 VanDerWaalsContact OD1-N 3.11Å; N46-S48 PolarHBondContact OD1-OG 3.43Å; N46-Q49 WeakPolarHBondContact O-CB 3.47Å; N46-Q49 PolarHBondContact O-N 3.4Å
47	D	89	Confident	93.6	Very high	135 Å²	135	58.3 Å²	58.3	72%	0.722	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-33.5	-179	-63.3	-62.4	0	0	0	113.6	R42 Q49	R42-D47 PolarHBondContact NH2-O 3.13Å; D47-Q49 PolarHBondContact O-N 3.42Å
48	S	90.6	Very high	93.7	Very high	99 Å²	99	57.3 Å²	57.3	69%	0.692	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-2.5	-179.1	80.5	0	0	0	0	114.6	N46	N46-S48 PolarHBondContact ND2-OG 2.84Å; N46-S48 PolarHBondContact O-N 3.03Å; N46-S48 VanDerWaalsContact O-N 3.11Å; N46-S48 PolarHBondContact OD1-N 3.17Å; N46-S48 VanDerWaalsContact OD1-N 3.11Å; N46-S48 PolarHBondContact OD1-OG 3.43Å
49	Q	92.9	Very high	93.8	Very high	110 Å²	110	54 Å²	54	51%	0.514	28%	0.281	S	S	.	.	S	Bend	trans	-95.2	135.8	176.9	-175.7	178.7	-14.3	0	0	110.2	R42 N46 D47	R42-Q49 PolarHBondContact NH1-O 2.82Å; N46-Q49 WeakPolarHBondContact O-CB 3.47Å; N46-Q49 PolarHBondContact O-N 3.4Å; D47-Q49 PolarHBondContact O-N 3.42Å
50	S	92.9	Very high	94	Very high	42 Å²	42	53 Å²	53	29%	0.294	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-73.3	142.9	170.3	56.1	0	0	0	0	111.4	W176	S50-W176 WeakPolarHBondContact CB-O 3.48Å
51	L	94.9	Very high	94.1	Very high	12 Å²	12	48.6 Å²	48.6	6%	0.063	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	118.9	172.5	-178	61.4	0	0	0	109.5	R42 P43 V44 V53 W108 S177 L178 D179	R42-L51 HydrophobicContact CG-CB 4.35Å; R42-L51 HydrophobicContact CG-CD2 4.1Å; P43-L51 HydrophobicContact CG-CD2 4.27Å; V44-L51 HydrophobicContact CG1-CB 3.96Å; V44-L51 HydrophobicContact CG1-CD1 4.29Å; L51-V53 HydrophobicContact CG-CG2 4.39Å; L51-W108 HydrophobicContact CD2-CE3 4.2Å; L51-W108 HydrophobicContact CD2-CH2 3.41Å; L51-W108 VanDerWaalsContact CD2-CH2 3.41Å; L51-W108 HydrophobicContact CD2-CZ2 4.19Å; L51-W108 HydrophobicContact CD2-CZ3 3.41Å; L51-W108 VanDerWaalsContact CD2-CZ3 3.41Å; L51-S177 PolarHBondContact N-O 3.26Å; L51-L178 WeakPolarHBondContact O-CA 3.37Å; L51-D179 PolarHBondContact O-N 2.87Å
52	T	95.8	Very high	94.4	Very high	51 Å²	51	44.9 Å²	44.9	31%	0.313	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	123.5	173.7	-47.2	0	0	0	0	110.4	Y54 D179 K181	T52-Y54 HydrophobicContact CG2-CE2 4.03Å; T52-D179 WeakPolarHBondContact CA-O 3.43Å; T52-K181 HydrophobicContact CG2-CB 4.48Å; T52-K181 HydrophobicContact CG2-CG 3.58Å
53	V	97.2	Very high	94.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	118.8	174.3	-179.5	0	0	0	0	108.4	L51 W82 P110 L178 D179 L180 K181	L51-V53 HydrophobicContact CG-CG2 4.39Å; V53-W82 HydrophobicContact CG2-CB 4.24Å; V53-P110 HydrophobicContact CG1-CG 4.15Å; V53-P110 HydrophobicContact CG2-CB 4.32Å; V53-L178 HydrophobicContact CB-CD2 4.19Å; V53-L178 HydrophobicContact CG2-CD1 4.22Å; V53-L178 HydrophobicContact CG2-CD2 3.93Å; V53-L178 HydrophobicContact CG2-CG 3.96Å; V53-D179 PolarHBondContact N-O 3.39Å; V53-L180 HydrophobicContact CB-CD2 4.16Å; V53-L180 HydrophobicContact CG1-CD2 4.2Å; V53-L180 CarbonylContact O-C 3.54Å; V53-L180 WeakPolarHBondContact O-CA 3.42Å; V53-K181 PolarHBondContact O-N 3.07Å
54	Y	97.6	Very high	94.3	Very high	121 Å²	121	51.6 Å²	51.6	48%	0.475	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	129.3	171.2	-61.8	-93.9	0	0	0	109.1	T52 L80 Y81 K181	T52-Y54 HydrophobicContact CG2-CE2 4.03Å; Y54-L80 WeakPolarHBondContact O-CA 3.37Å; Y54-Y81 PolarHBondContact N-O 2.85Å; Y54-Y81 PolarHBondContact O-N 2.8Å; Y54-K181 CarbonylContact C-O 3.49Å; Y54-K181 WeakPolarHBondContact CA-O 3.3Å; Y54-K181 HydrophobicContact CD1-CB 3.63Å; Y54-K181 HydrophobicContact CD1-CG 4.43Å; Y54-K181 HydrophobicContact CE1-CB 3.87Å; Y54-K181 HydrophobicContact CE1-CG 4.22Å; Y54-K181 HydrophobicContact CG-CB 4.3Å
55	F	97.4	Very high	94.2	Very high	1 Å²	1	51.4 Å²	51.4	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	123.9	-174.3	178.9	-103.4	0	0	0	110.9	L78 Q79 L80 I112 F168 L180 K181 V183 I220 F222	F55-L78 HydrophobicContact CE2-CB 4.35Å; F55-L78 HydrophobicContact CE2-CD1 4.31Å; F55-L78 HydrophobicContact CE2-CD2 4.05Å; F55-L78 HydrophobicContact CE2-CG 4.48Å; F55-L78 HydrophobicContact CZ-CD2 3.97Å; F55-Q79 WeakPolarHBondContact CA-O 3.38Å; F55-L80 HydrophobicContact CD2-CD2 4.42Å; F55-L80 HydrophobicContact CD2-CG 4.12Å; F55-I112 HydrophobicContact CD2-CG2 4.08Å; F55-I112 HydrophobicContact CE2-CG2 3.77Å; F55-I112 HydrophobicContact CZ-CG2 4.13Å; F55-F168 HydrophobicContact CD1-CB 4.49Å; F55-F168 HydrophobicContact CE1-CB 3.52Å; F55-F168 AromaticContact CE1-CD2 3.81Å; F55-F168 HydrophobicContact CE1-CD2 3.81Å; F55-F168 AromaticContact CE1-CG 3.73Å; F55-F168 HydrophobicContact CE1-CG 3.73Å; F55-F168 HydrophobicContact CZ-CB 3.6Å; F55-F168 AromaticContact CZ-CD1 3.85Å; F55-F168 HydrophobicContact CZ-CD1 3.85Å; F55-F168 AromaticContact CZ-CD2 3.77Å; F55-F168 HydrophobicContact CZ-CD2 3.77Å; F55-F168 HydrophobicContact CZ-CE1 4.44Å; F55-F168 HydrophobicContact CZ-CE2 4.37Å; F55-F168 AromaticContact CZ-CG 3.46Å; F55-F168 HydrophobicContact CZ-CG 3.46Å; F55-F168 VanDerWaalsContact CZ-CG 3.46Å; F55-L180 HydrophobicContact CB-CD2 3.95Å; F55-K181 PolarHBondContact N-O 3.34Å; F55-V183 PolarHBondContact O-N 3.43Å; F55-I220 HydrophobicContact CB-CD1 3.97Å; F55-I220 HydrophobicContact CD1-CB 4.15Å; F55-I220 HydrophobicContact CD1-CD1 3.83Å; F55-I220 HydrophobicContact CD1-CG2 4.2Å; F55-I220 HydrophobicContact CE1-CG2 4.49Å; F55-I220 HydrophobicContact CG-CD1 4.36Å; F55-F222 HydrophobicContact CD1-CE2 4.09Å; F55-F222 HydrophobicContact CE1-CD2 4.4Å; F55-F222 AromaticContact CE1-CE2 3.79Å; F55-F222 HydrophobicContact CE1-CE2 3.79Å
56	G	96.5	Very high	94.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	176.6	169.4	0	0	0	0	0	111.2	Q79	G56-Q79 PolarHBondContact N-O 3.05Å; G56-Q79 PolarHBondContact O-N 3.19Å
57	L	95.4	Very high	94	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	151.4	168.9	91.3	169.9	0	0	0	111.1	I76 L166 A185 D186 V201 F222	L57-I76 HydrophobicContact CB-CG2 3.72Å; L57-I76 HydrophobicContact CD1-CD1 3.93Å; L57-I76 HydrophobicContact CD1-CG1 4.22Å; L57-I76 HydrophobicContact CD1-CG2 3.85Å; L57-I76 HydrophobicContact CG-CG2 4.19Å; L57-L166 HydrophobicContact CD1-CD1 4.3Å; L57-A185 HydrophobicContact CD2-CB 3.46Å; L57-A185 VanDerWaalsContact CD2-CB 3.46Å; L57-D186 PolarHBondContact O-N 2.88Å; L57-V201 HydrophobicContact CD2-CG1 4.36Å; L57-F222 HydrophobicContact CD2-CB 4.19Å; L57-F222 HydrophobicContact CD2-CD1 3.47Å; L57-F222 VanDerWaalsContact CD2-CD1 3.47Å; L57-F222 HydrophobicContact CD2-CD2 3.75Å; L57-F222 HydrophobicContact CD2-CE1 3.62Å; L57-F222 HydrophobicContact CD2-CE2 3.87Å; L57-F222 HydrophobicContact CD2-CG 3.54Å; L57-F222 HydrophobicContact CD2-CZ 3.81Å
58	S	96.1	Very high	93.7	Very high	7 Å²	7	46 Å²	46	5%	0.049	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	116.3	161.4	-172.3	0	0	0	0	108.6	M60 I76 W77 D186	S58-M60 PolarHBondContact O-N 2.92Å; S58-I76 WeakPolarHBondContact O-CA 3.41Å; S58-W77 PolarHBondContact N-O 3.44Å; S58-W77 PolarHBondContact O-N 3.2Å; S58-D186 CarbonylContact C-O 3.59Å; S58-D186 VanDerWaalsContact CA-O 3.3Å; S58-D186 WeakPolarHBondContact CA-O 3.31Å
59	L	96.3	Very high	93.5	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	104.9	179.3	178.1	61	0	0	0	109.2	T74 I76 D186 Y190 L198 V201 V224	L59-T74 HydrophobicContact CD1-CG2 4.05Å; L59-I76 HydrophobicContact CD1-CD1 4.46Å; L59-I76 HydrophobicContact CD1-CG1 3.81Å; L59-D186 PolarHBondContact N-O 3.47Å; L59-Y190 HydrophobicContact CD2-CD2 4.47Å; L59-Y190 HydrophobicContact CD2-CE2 4.46Å; L59-Y190 HydrophobicContact CG-CD2 4.14Å; L59-Y190 HydrophobicContact CG-CE2 4.41Å; L59-L198 HydrophobicContact CD2-CD1 3.92Å; L59-L198 HydrophobicContact CD2-CD2 3.98Å; L59-V201 HydrophobicContact CD2-CG2 3.87Å; L59-V224 HydrophobicContact CD2-CG1 4.26Å; L59-V224 HydrophobicContact CD2-CG2 4.42Å
60	M	94.7	Very high	93.3	Very high	30 Å²	30	44.2 Å²	44.2	15%	0.148	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-39.8	-175.5	-59.2	-57.2	-61.5	0	0	112.3	S58 N75 W77 G189 I191	S58-M60 PolarHBondContact O-N 2.92Å; M60-N75 WeakPolarHBondContact CB-O 3.27Å; M60-N75 PolarHBondContact N-O 3.36Å; M60-W77 HydrophobicContact CE-CZ2 4.25Å; M60-W77 HydrophobicContact CG-CD2 4.12Å; M60-W77 HydrophobicContact CG-CG 3.96Å; M60-W77 HydrophobicContact SD-CD2 4.19Å; M60-W77 HydrophobicContact SD-CG 4.47Å; M60-G189 WeakPolarHBondContact CE-O 3.42Å; M60-I191 PolarHBondContact O-N 2.71Å
61	Q	95.3	Very high	93.4	Very high	56 Å²	56	43.5 Å²	43.5	26%	0.262	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	139.8	-179.7	-169	177.7	-15.3	0	0	111.7	M63 N75	Q61-M63 HydrophobicContact CB-SD 4.12Å; Q61-M63 HydrophobicContact CG-SD 3.94Å; Q61-N75 HydrophobicContact CB-CB 4.11Å; Q61-N75 PolarHBondContact N-O 3.48Å; Q61-N75 PolarHBondContact O-N 2.95Å
62	I	95.8	Very high	93.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	111	159.5	-65.8	167.8	0	0	0	106.2	V65 L72 T74 Y190 N193 L198 V224 M226	I62-V65 HydrophobicContact CG2-CG2 3.86Å; I62-L72 HydrophobicContact CG2-CD1 4.02Å; I62-T74 HydrophobicContact CG1-CG2 4.33Å; I62-Y190 HydrophobicContact CG1-CE2 4.27Å; I62-N193 PolarHBondContact O-ND2 2.68Å; I62-L198 HydrophobicContact CD1-CD1 4.35Å; I62-V224 HydrophobicContact CD1-CG1 4.2Å; I62-M226 HydrophobicContact CD1-CB 4.28Å; I62-M226 HydrophobicContact CD1-SD 4.03Å
63	M	93.2	Very high	93.4	Very high	83 Å²	83	41.4 Å²	41.4	41%	0.409	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	-48.2	-172.2	-66.3	-65.2	-57.4	0	0	111.5	Q61 T73 N75	Q61-M63 HydrophobicContact CB-SD 4.12Å; Q61-M63 HydrophobicContact CG-SD 3.94Å; M63-T73 HydrophobicContact CB-CG2 4.09Å; M63-T73 WeakPolarHBondContact CB-O 3.38Å; M63-T73 PolarHBondContact N-O 3.21Å; M63-N75 HydrophobicContact CG-CB 4.06Å; M63-N75 HydrophobicContact SD-CB 4.07Å
64	D	93.1	Very high	93.3	Very high	95 Å²	95	41.4 Å²	41.4	51%	0.508	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	151.2	-171.4	-170.3	20.1	0	0	0	110.3	T73	D64-T73 PolarHBondContact N-O 3.43Å; D64-T73 PolarHBondContact O-N 3.47Å
65	V	92.4	Very high	93.2	Very high	9 Å²	9	37.6 Å²	37.6	6%	0.055	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	96.5	-178.5	-175	0	0	0	0	108.1	I62 E67 L72 I152 W196 M226	I62-V65 HydrophobicContact CG2-CG2 3.86Å; V65-E67 HydrophobicContact CG1-CG 4.46Å; V65-E67 PolarHBondContact O-N 3.2Å; V65-L72 HydrophobicContact CG2-CD1 3.91Å; V65-I152 HydrophobicContact CG1-CD1 4.35Å; V65-W196 HydrophobicContact CB-CZ2 4.32Å; V65-W196 HydrophobicContact CG1-CZ2 3.98Å; V65-W196 HydrophobicContact CG2-CD2 4.46Å; V65-W196 HydrophobicContact CG2-CG 4.39Å; V65-M226 HydrophobicContact CB-CE 4.35Å; V65-M226 HydrophobicContact CG1-CE 3.61Å; V65-M226 HydrophobicContact CG2-CE 3.72Å; V65-M226 HydrophobicContact CG2-SD 4.18Å
66	D	90.8	Very high	93.2	Very high	51 Å²	51	37.5 Å²	37.5	27%	0.273	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	95.9	-179.7	-172.7	-28.9	0	0	0	109.6	K68 N69 Q70 V71	D66-K68 PolarHBondContact O-N 3.37Å; D66-K68 WeakPolarHBondContact OD1-CB 3.3Å; D66-K68 PolarHBondContact OD1-N 3.29Å; D66-N69 HydrophobicContact CB-CB 4.5Å; D66-N69 PolarHBondContact OD1-N 3.03Å; D66-N69 PolarHBondContact OD2-ND2 2.94Å; D66-Q70 WeakPolarHBondContact O-CA 3.48Å; D66-Q70 PolarHBondContact O-N 3.01Å; D66-V71 HydrophobicContact CB-CB 4.49Å; D66-V71 PolarHBondContact N-O 3.08Å; D66-V71 PolarHBondContact O-N 3.14Å; D66-V71 VanDerWaalsContact O-N 3.08Å
67	E	86.1	Confident	93.1	Very high	41 Å²	41	43 Å²	43	19%	0.192	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-17.5	-179.5	-51.3	99.7	146.6	0	0	113.4	V65 I152 R228 P284	V65-E67 HydrophobicContact CG1-CG 4.46Å; V65-E67 PolarHBondContact O-N 3.2Å; E67-I152 HydrophobicContact CB-CB 4.41Å; E67-I152 HydrophobicContact CB-CG1 4.42Å; E67-I152 HydrophobicContact CB-CG2 3.98Å; E67-I152 HydrophobicContact CG-CG1 4.38Å; E67-I152 HydrophobicContact CG-CG2 3.78Å; E67-R228 IonicContact OE1-CZ 2.65Å; E67-R228 IonicContact OE1-NH1 3.77Å; E67-R228 PolarHBondContact OE1-NH1 3.16Å; E67-R228 IonicContact OE1-NH2 3.1Å; E67-R228 PolarHBondContact OE1-NH2 2.76Å; E67-P284 HydrophobicContact CB-CG 4.07Å
68	K	82.1	Confident	93.1	Very high	157 Å²	157	43.1 Å²	43.1	68%	0.683	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-42.1	-179.8	179.5	-178.2	175.8	-179.9	0	111.6	D66 P284	D66-K68 PolarHBondContact O-N 3.37Å; D66-K68 WeakPolarHBondContact OD1-CB 3.3Å; D66-K68 PolarHBondContact OD1-N 3.29Å; K68-P284 HydrophobicContact CB-CB 4.19Å
69	N	86.5	Confident	93.1	Very high	109 Å²	109	44 Å²	44	58%	0.583	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94	-3.2	177	-63.1	-50.2	0	0	0	112.8	D66 V71	D66-N69 HydrophobicContact CB-CB 4.5Å; D66-N69 PolarHBondContact OD1-N 3.03Å; D66-N69 PolarHBondContact OD2-ND2 2.94Å; N69-V71 HydrophobicContact CB-CG2 4.37Å
70	Q	90.3	Very high	93.1	Very high	62 Å²	62	44.1 Å²	44.1	29%	0.29	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	45.3	179.8	-66.1	-172.7	-10.5	0	0	113.2	D66 T149 C150	D66-Q70 WeakPolarHBondContact O-CA 3.48Å; D66-Q70 PolarHBondContact O-N 3.01Å; Q70-T149 WeakPolarHBondContact O-CA 3.34Å; Q70-C150 CarbonylContact C-O 3.58Å; Q70-C150 WeakPolarHBondContact CB-O 3.38Å; Q70-C150 PolarHBondContact O-N 3.44Å
71	V	93.8	Very high	93.2	Very high	27 Å²	27	46.3 Å²	46.3	16%	0.164	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	122.8	-177.7	-179	0	0	0	0	111.7	D66 N69 A118 K147 S148	D66-V71 HydrophobicContact CB-CB 4.49Å; D66-V71 PolarHBondContact N-O 3.08Å; D66-V71 PolarHBondContact O-N 3.14Å; D66-V71 VanDerWaalsContact O-N 3.08Å; N69-V71 HydrophobicContact CB-CG2 4.37Å; V71-A118 HydrophobicContact CG1-CB 3.93Å; V71-A118 HydrophobicContact CG2-CB 3.82Å; V71-K147 HydrophobicContact CG1-CB 3.91Å; V71-K147 HydrophobicContact CG1-CG 4.42Å; V71-S148 WeakPolarHBondContact CA-O 3.46Å
72	L	95.5	Very high	93.3	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	126.7	166.8	167.5	66.2	0	0	0	109.4	I62 V65 T74 K147 S148 C150 C164 V224 M226	I62-L72 HydrophobicContact CG2-CD1 4.02Å; V65-L72 HydrophobicContact CG2-CD1 3.91Å; L72-T74 HydrophobicContact CD1-CG2 3.84Å; L72-T74 HydrophobicContact CD2-CG2 4Å; L72-T74 HydrophobicContact CG-CG2 3.84Å; L72-K147 WeakPolarHBondContact O-CA 3.5Å; L72-S148 PolarHBondContact N-O 3.05Å; L72-S148 PolarHBondContact O-N 3.39Å; L72-S148 PolarHBondContact O-OG 3.49Å; L72-C150 HydrophobicContact CB-CB 4.23Å; L72-C164 HydrophobicContact CB-CB 4.42Å; L72-C164 HydrophobicContact CD2-CB 3.37Å; L72-C164 HydrophobicContact CG-CB 4.49Å; L72-V224 HydrophobicContact CD2-CB 4.42Å; L72-M226 HydrophobicContact CD1-CE 4.45Å; L72-M226 HydrophobicContact CD1-SD 4.4Å
73	T	95.4	Very high	93.3	Very high	19 Å²	19	47.5 Å²	47.5	12%	0.117	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	124.6	173.3	-53.7	0	0	0	0	110.8	M63 D64 I145 F146 K147	M63-T73 HydrophobicContact CB-CG2 4.09Å; M63-T73 WeakPolarHBondContact CB-O 3.38Å; M63-T73 PolarHBondContact N-O 3.21Å; D64-T73 PolarHBondContact N-O 3.43Å; D64-T73 PolarHBondContact O-N 3.47Å; T73-I145 HydrophobicContact CG2-CG2 3.79Å; T73-F146 WeakPolarHBondContact CA-O 3.32Å; T73-K147 HydrophobicContact CG2-CG 4.07Å
74	T	95.6	Very high	93.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	144.6	-175	47.1	0	0	0	0	112.5	L59 I62 L72 I76 I145 F146	L59-T74 HydrophobicContact CD1-CG2 4.05Å; I62-T74 HydrophobicContact CG1-CG2 4.33Å; L72-T74 HydrophobicContact CD1-CG2 3.84Å; L72-T74 HydrophobicContact CD2-CG2 4Å; L72-T74 HydrophobicContact CG-CG2 3.84Å; T74-I76 WeakPolarHBondContact OG1-CD1 3.32Å; T74-I145 CarbonylContact O-C 3.53Å; T74-I145 WeakPolarHBondContact O-CA 3.47Å; T74-F146 PolarHBondContact N-O 3.23Å; T74-F146 PolarHBondContact O-N 3.47Å; T74-F146 PolarHBondContact OG1-O 3.47Å
75	N	95.3	Very high	93.4	Very high	41 Å²	41	44 Å²	44	22%	0.219	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	112	168.6	-179.3	0.6	0	0	0	107.9	M60 Q61 M63	M60-N75 WeakPolarHBondContact CB-O 3.27Å; M60-N75 PolarHBondContact N-O 3.36Å; Q61-N75 HydrophobicContact CB-CB 4.11Å; Q61-N75 PolarHBondContact N-O 3.48Å; Q61-N75 PolarHBondContact O-N 2.95Å; M63-N75 HydrophobicContact CG-CB 4.06Å; M63-N75 HydrophobicContact SD-CB 4.07Å
76	I	96.1	Very high	93.4	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.2	-172.9	-66.5	166.5	0	0	0	108.7	L57 S58 L59 T74 L78 G144 F146 L166	L57-I76 HydrophobicContact CB-CG2 3.72Å; L57-I76 HydrophobicContact CD1-CD1 3.93Å; L57-I76 HydrophobicContact CD1-CG1 4.22Å; L57-I76 HydrophobicContact CD1-CG2 3.85Å; L57-I76 HydrophobicContact CG-CG2 4.19Å; S58-I76 WeakPolarHBondContact O-CA 3.41Å; L59-I76 HydrophobicContact CD1-CD1 4.46Å; L59-I76 HydrophobicContact CD1-CG1 3.81Å; T74-I76 WeakPolarHBondContact OG1-CD1 3.32Å; I76-L78 HydrophobicContact CG2-CD2 3.95Å; I76-G144 PolarHBondContact N-O 2.86Å; I76-G144 PolarHBondContact O-N 3.44Å; I76-F146 HydrophobicContact CB-CD2 3.83Å; I76-F146 HydrophobicContact CB-CE2 4.05Å; I76-F146 HydrophobicContact CD1-CB 4.45Å; I76-F146 HydrophobicContact CD1-CD2 4.15Å; I76-F146 HydrophobicContact CG1-CD2 4.43Å; I76-F146 HydrophobicContact CG2-CE2 4.37Å; I76-L166 HydrophobicContact CD1-CD1 3.57Å
77	W	95.7	Very high	93.5	Very high	114 Å²	114	46 Å²	46	43%	0.432	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	118.1	165	-60.3	5.3	0	0	0	107.9	S58 M60 P143	S58-W77 PolarHBondContact N-O 3.44Å; S58-W77 PolarHBondContact O-N 3.2Å; M60-W77 HydrophobicContact CE-CZ2 4.25Å; M60-W77 HydrophobicContact CG-CD2 4.12Å; M60-W77 HydrophobicContact CG-CG 3.96Å; M60-W77 HydrophobicContact SD-CD2 4.19Å; M60-W77 HydrophobicContact SD-CG 4.47Å; W77-P143 VanDerWaalsContact CD1-CB 3.45Å; W77-P143 HydrophobicContact CG-CB 4.17Å
78	L	95.6	Very high	93.9	Very high	4 Å²	4	48 Å²	48	2%	0.021	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	148	173.9	-57.1	-176.5	0	0	0	109.1	F55 I76 L80 T125 L141 P142 F146 F168	F55-L78 HydrophobicContact CE2-CB 4.35Å; F55-L78 HydrophobicContact CE2-CD1 4.31Å; F55-L78 HydrophobicContact CE2-CD2 4.05Å; F55-L78 HydrophobicContact CE2-CG 4.48Å; F55-L78 HydrophobicContact CZ-CD2 3.97Å; I76-L78 HydrophobicContact CG2-CD2 3.95Å; L78-L80 HydrophobicContact CB-CD1 3.58Å; L78-L80 HydrophobicContact CD1-CD1 4.42Å; L78-T125 HydrophobicContact CD1-CG2 4.01Å; L78-L141 WeakPolarHBondContact O-CA 3.4Å; L78-P142 HydrophobicContact CB-CG 4.16Å; L78-P142 PolarHBondContact N-O 3.21Å; L78-F146 HydrophobicContact CD1-CZ 3.81Å; L78-F146 HydrophobicContact CD2-CE2 4.19Å; L78-F146 HydrophobicContact CD2-CZ 4.01Å; L78-F146 HydrophobicContact CG-CE2 4.24Å; L78-F146 HydrophobicContact CG-CZ 3.89Å; L78-F168 HydrophobicContact CD2-CE1 3.95Å; L78-F168 HydrophobicContact CD2-CZ 3.96Å
79	Q	96	Very high	94.4	Very high	24 Å²	24	41.6 Å²	41.6	11%	0.112	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	105.5	175.8	-61.9	-179.3	-4.6	0	0	108.4	F55 G56 Y81 L141	F55-Q79 WeakPolarHBondContact CA-O 3.38Å; G56-Q79 PolarHBondContact N-O 3.05Å; G56-Q79 PolarHBondContact O-N 3.19Å; Q79-Y81 HydrophobicContact CB-CE2 3.9Å; Q79-L141 HydrophobicContact CG-CD2 4.33Å
80	L	96.4	Very high	94.7	Very high	5 Å²	5	39.8 Å²	39.8	3%	0.026	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	124.9	-179.7	-58.4	94	0	0	0	110.4	Y54 F55 L78 W82 P110 I112 Y140 P142	Y54-L80 WeakPolarHBondContact O-CA 3.37Å; F55-L80 HydrophobicContact CD2-CD2 4.42Å; F55-L80 HydrophobicContact CD2-CG 4.12Å; L78-L80 HydrophobicContact CB-CD1 3.58Å; L78-L80 HydrophobicContact CD1-CD1 4.42Å; L80-W82 HydrophobicContact CB-CE3 4.33Å; L80-W82 HydrophobicContact CB-CZ3 4Å; L80-P110 HydrophobicContact CD2-CG 3.75Å; L80-I112 HydrophobicContact CD2-CB 4.19Å; L80-I112 HydrophobicContact CD2-CG1 3.74Å; L80-Y140 HydrophobicContact CD1-CD1 4.07Å; L80-Y140 PolarHBondContact N-O 3.02Å; L80-Y140 PolarHBondContact O-N 3.2Å; L80-P142 HydrophobicContact CD1-CG 4.24Å
81	Y	97.1	Very high	94.7	Very high	76 Å²	76	39.5 Å²	39.5	30%	0.298	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	128.8	175.3	-47.6	-87.1	0	0	0	110.7	Y54 Q79 C138 S139 L141	Y54-Y81 PolarHBondContact N-O 2.85Å; Y54-Y81 PolarHBondContact O-N 2.8Å; Q79-Y81 HydrophobicContact CB-CE2 3.9Å; Y81-C138 WeakPolarHBondContact CA-O 3.27Å; Y81-S139 WeakPolarHBondContact CD1-OG 3.32Å; Y81-L141 HydrophobicContact CE1-CD1 4.28Å
82	W	96.5	Very high	94.5	Very high	8 Å²	8	45.2 Å²	45.2	3%	0.03	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	172.9	174.2	67.6	100.3	0	0	0	109.6	V53 L80 W108 K109 P110 I130 C138 Y140	V53-W82 HydrophobicContact CG2-CB 4.24Å; L80-W82 HydrophobicContact CB-CE3 4.33Å; L80-W82 HydrophobicContact CB-CZ3 4Å; W82-W108 HydrophobicContact CG-CZ3 4.35Å; W82-W108 WeakPolarHBondContact CZ2-O 3.38Å; W82-W108 AromaticContact NE1-CE3 3.8Å; W82-W108 AromaticContact NE1-CZ3 3.96Å; W82-K109 HydrophobicContact CH2-CB 4.38Å; W82-K109 HydrophobicContact CZ2-CB 4.48Å; W82-P110 HydrophobicContact CE3-CG 4.3Å; W82-P110 HydrophobicContact CZ3-CG 4.33Å; W82-I130 HydrophobicContact CH2-CD1 4.01Å; W82-I130 HydrophobicContact CH2-CG1 4.37Å; W82-I130 HydrophobicContact CH2-CG2 4.07Å; W82-I130 HydrophobicContact CZ2-CD1 4.2Å; W82-I130 HydrophobicContact CZ2-CG2 4.29Å; W82-C138 HydrophobicContact CD2-CB 3.67Å; W82-C138 VanDerWaalsContact CE2-CB 3.44Å; W82-C138 HydrophobicContact CE3-CB 4.18Å; W82-C138 HydrophobicContact CG-CB 4.08Å; W82-C138 HydrophobicContact CH2-CB 4.28Å; W82-C138 HydrophobicContact CZ2-CB 3.78Å; W82-C138 HydrophobicContact CZ3-CB 4.46Å; W82-C138 PolarHBondContact N-O 2.9Å; W82-C138 PolarHBondContact O-N 2.88Å; W82-Y140 HydrophobicContact CH2-CG 4.47Å
83	N	95.9	Very high	94.2	Very high	72 Å²	72	50.1 Å²	50.1	39%	0.385	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.9	174.6	-166	89	0	0	0	109.7	Q88 S135 G136 A137	N83-Q88 PolarHBondContact ND2-NE2 3.42Å; N83-S135 PolarHBondContact OD1-O 3.19Å; N83-G136 CarbonylContact C-O 3.59Å; N83-G136 WeakPolarHBondContact CA-O 3.28Å; N83-A137 PolarHBondContact OD1-N 3.05Å
84	D	95.5	Very high	93.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128.3	173.1	-172	-49.3	0	0	0	109.1	Y37 P43 Y86 L87 Q88 G136	Y37-D84 WeakPolarHBondContact CE2-OD2 3.33Å; Y37-D84 PolarHBondContact OH-OD2 3.01Å; P43-D84 HydrophobicContact CB-CB 4.07Å; P43-D84 WeakPolarHBondContact CB-OD2 3.47Å; P43-D84 HydrophobicContact CG-CB 4.17Å; D84-Y86 WeakPolarHBondContact OD1-CA 3.45Å; D84-Y86 WeakPolarHBondContact OD1-CB 3.41Å; D84-Y86 PolarHBondContact OD1-N 2.82Å; D84-L87 HydrophobicContact CB-CB 4.16Å; D84-L87 HydrophobicContact CB-CD1 4.08Å; D84-L87 HydrophobicContact CB-CG 4.18Å; D84-L87 PolarHBondContact OD1-N 3.47Å; D84-L87 WeakPolarHBondContact OD2-CD1 3.32Å; D84-Q88 PolarHBondContact O-NE2 3.5Å; D84-G136 PolarHBondContact N-O 2.94Å; D84-G136 WeakPolarHBondContact O-CA 3.44Å
85	Y	92.6	Very high	93.3	Very high	105 Å²	105	54.8 Å²	54.8	41%	0.412	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	-32.9	178.3	176.9	-102.6	0	0	0	113.2	F45 Q88	F45-Y85 HydrophobicContact CB-CG 4.46Å; F45-Y85 HydrophobicContact CD2-CD1 4.21Å; F45-Y85 HydrophobicContact CD2-CD2 4.26Å; F45-Y85 AromaticContact CD2-CE1 3.75Å; F45-Y85 HydrophobicContact CD2-CE1 3.75Å; F45-Y85 AromaticContact CD2-CE2 3.79Å; F45-Y85 HydrophobicContact CD2-CE2 3.79Å; F45-Y85 HydrophobicContact CD2-CG 4.46Å; F45-Y85 AromaticContact CD2-CZ 3.53Å; F45-Y85 HydrophobicContact CE2-CE1 4.31Å; F45-Y85 HydrophobicContact CE2-CE2 4.41Å; F45-Y85 AromaticContact CE2-CZ 3.91Å; Y85-Q88 WeakPolarHBondContact O-CG 3.49Å
86	Y	92.8	Very high	92.8	Very high	103 Å²	103	56.7 Å²	56.7	40%	0.404	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-26.1	-175.7	-61.2	-58.5	0	0	0	112.9	Y37 E41 P43 D84 Q88	Y37-Y86 HydrophobicContact CE2-CD2 4.43Å; E41-Y86 VanDerWaalsContact OE1-CE2 3.29Å; E41-Y86 WeakPolarHBondContact OE1-CE2 3.39Å; E41-Y86 VanDerWaalsContact OE1-CZ 3.29Å; E41-Y86 PolarHBondContact OE1-OH 2.96Å; P43-Y86 HydrophobicContact CB-CD2 4.25Å; D84-Y86 WeakPolarHBondContact OD1-CA 3.45Å; D84-Y86 WeakPolarHBondContact OD1-CB 3.41Å; D84-Y86 PolarHBondContact OD1-N 2.82Å; Y86-Q88 VanDerWaalsContact C-N 3.26Å; Y86-Q88 PolarHBondContact O-N 2.95Å
87	L	93.4	Very high	92.4	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	30.5	-179.6	-58	176.7	0	0	0	114.4	L33 Y37 D84 W89 F102 I107 V132	L33-L87 HydrophobicContact CB-CD2 4.35Å; Y37-L87 HydrophobicContact CD2-CD2 3.81Å; Y37-L87 HydrophobicContact CD2-CG 4.3Å; Y37-L87 HydrophobicContact CE2-CD1 4.19Å; Y37-L87 HydrophobicContact CE2-CD2 3.71Å; Y37-L87 HydrophobicContact CE2-CG 3.72Å; D84-L87 HydrophobicContact CB-CB 4.16Å; D84-L87 HydrophobicContact CB-CD1 4.08Å; D84-L87 HydrophobicContact CB-CG 4.18Å; D84-L87 PolarHBondContact OD1-N 3.47Å; D84-L87 WeakPolarHBondContact OD2-CD1 3.32Å; L87-W89 WeakPolarHBondContact O-CZ3 3.47Å; L87-F102 HydrophobicContact CD1-CE2 4.44Å; L87-F102 HydrophobicContact CD2-CE2 4.3Å; L87-F102 HydrophobicContact CD2-CZ 4.19Å; L87-I107 HydrophobicContact CD1-CB 4.13Å; L87-I107 HydrophobicContact CD1-CD1 3.81Å; L87-I107 HydrophobicContact CD1-CG2 3.82Å; L87-I107 HydrophobicContact CD2-CG2 4.31Å; L87-V132 HydrophobicContact CB-CG1 3.99Å; L87-V132 HydrophobicContact CD1-CG1 4.4Å; L87-V132 HydrophobicContact CD1-CG2 4.26Å
88	Q	93.4	Very high	92.1	Very high	83 Å²	83	56 Å²	56	39%	0.388	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	140.4	-179.8	-61.6	-172.9	14.2	0	0	112.1	N83 D84 Y85 Y86	N83-Q88 PolarHBondContact ND2-NE2 3.42Å; D84-Q88 PolarHBondContact O-NE2 3.5Å; Y85-Q88 WeakPolarHBondContact O-CG 3.49Å; Y86-Q88 VanDerWaalsContact C-N 3.26Å; Y86-Q88 PolarHBondContact O-N 2.95Å
89	W	93.4	Very high	92	Very high	21 Å²	21	59.2 Å²	59.2	8%	0.08	32%	0.32	C	S	.	.			trans	-149.1	152.2	172.5	71.8	94.1	0	0	0	112.9	L29 L33 L87 P91 Y94 V97 T98 V100 V132 N133 S134	L29-W89 HydrophobicContact CD1-CB 3.71Å; L29-W89 HydrophobicContact CD1-CD2 3.88Å; L29-W89 HydrophobicContact CD1-CE3 4.38Å; L29-W89 HydrophobicContact CD1-CG 3.57Å; L29-W89 HydrophobicContact CD2-CD2 3.73Å; L29-W89 HydrophobicContact CD2-CE3 4.3Å; L29-W89 HydrophobicContact CD2-CG 4.04Å; L29-W89 HydrophobicContact CD2-CH2 4.49Å; L29-W89 HydrophobicContact CD2-CZ2 3.91Å; L29-W89 HydrophobicContact CG-CD2 4.39Å; L29-W89 HydrophobicContact CG-CG 4.47Å; L33-W89 HydrophobicContact CD1-CE3 3.87Å; L33-W89 HydrophobicContact CD1-CZ3 4.15Å; L87-W89 WeakPolarHBondContact O-CZ3 3.47Å; W89-P91 WeakPolarHBondContact O-CD 3.42Å; W89-Y94 HydrophobicContact CB-CD2 4.48Å; W89-Y94 HydrophobicContact CB-CE2 4.43Å; W89-Y94 AromaticContact CD1-CD2 3.87Å; W89-Y94 HydrophobicContact CG-CD2 4.44Å; W89-V97 PolarHBondContact NE1-O 3.34Å; W89-T98 VanDerWaalsContact CZ2-O 3.31Å; W89-T98 WeakPolarHBondContact CZ2-O 3.45Å; W89-V100 HydrophobicContact CH2-CB 4.45Å; W89-V100 HydrophobicContact CH2-CG1 4.2Å; W89-V100 HydrophobicContact CH2-CG2 3.74Å; W89-V100 HydrophobicContact CZ2-CG1 4.23Å; W89-V100 HydrophobicContact CZ3-CG2 4.06Å; W89-V132 HydrophobicContact CZ3-CG1 4.29Å; W89-N133 VanDerWaalsContact CH2-C 3.48Å; W89-S134 VanDerWaalsContact CH2-N 3.28Å; W89-S134 PolarHBondContact N-O 3.29Å
90	N	93	Very high	91.9	Very high	71 Å²	71	58.1 Å²	58.1	38%	0.38	32%	0.315	S	S	.	.			trans	-78	120.6	173.2	174.4	16.1	0	0	0	110.6	L92 D93	N90-L92 PolarHBondContact O-N 2.92Å; N90-L92 VanDerWaalsContact O-N 3.14Å; N90-L92 WeakPolarHBondContact OD1-CB 3.29Å; N90-L92 WeakPolarHBondContact OD1-CG 3.47Å; N90-L92 PolarHBondContact OD1-N 3.26Å; N90-L92 VanDerWaalsContact OD1-N 3.11Å; N90-D93 WeakPolarHBondContact CB-OD2 3.44Å; N90-D93 PolarHBondContact ND2-OD2 3.11Å; N90-D93 PolarHBondContact O-N 3.2Å
91	P	90.4	Very high	91.8	Very high	56 Å²	56	65.6 Å²	65.6	36%	0.364	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-20.3	178.5	-25.3	35.9	0	0	0	114.6	W89 D93 Y94	W89-P91 WeakPolarHBondContact O-CD 3.42Å; P91-D93 VanDerWaalsContact C-N 3.33Å; P91-Y94 CarbonylContact O-C 3.54Å; P91-Y94 PolarHBondContact O-N 3.43Å
92	L	89.8	Confident	91.7	Very high	148 Å²	148	62.1 Å²	62.1	78%	0.775	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-31.2	178.2	-58.6	174.3	0	0	0	112.5	N90 Y94	N90-L92 PolarHBondContact O-N 2.92Å; N90-L92 VanDerWaalsContact O-N 3.14Å; N90-L92 WeakPolarHBondContact OD1-CB 3.29Å; N90-L92 WeakPolarHBondContact OD1-CG 3.47Å; N90-L92 PolarHBondContact OD1-N 3.26Å; N90-L92 VanDerWaalsContact OD1-N 3.11Å; L92-Y94 VanDerWaalsContact C-N 3.32Å
93	D	89.1	Confident	91.6	Very high	103 Å²	103	63.4 Å²	63.4	55%	0.551	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-16.4	-179.4	-62.8	-46.6	0	0	0	112.8	N90 P91	N90-D93 WeakPolarHBondContact CB-OD2 3.44Å; N90-D93 PolarHBondContact ND2-OD2 3.11Å; N90-D93 PolarHBondContact O-N 3.2Å; P91-D93 VanDerWaalsContact C-N 3.33Å
94	Y	88.4	Confident	91.3	Very high	25 Å²	25	60.6 Å²	60.6	10%	0.098	32%	0.324	C	S	.	.	S	Bend	trans	-133.7	68.8	-176.8	-56.8	-84.3	0	0	0	110.4	S25 K28 L29 N32 W89 P91 L92 G96 V97	S25-Y94 WeakPolarHBondContact O-CD1 3.43Å; K28-Y94 HydrophobicContact CB-CE1 4.29Å; K28-Y94 HydrophobicContact CD-CE1 4.04Å; K28-Y94 HydrophobicContact CG-CE1 4.1Å; L29-Y94 HydrophobicContact CB-CD1 3.76Å; L29-Y94 HydrophobicContact CB-CE1 3.83Å; L29-Y94 HydrophobicContact CB-CG 4.23Å; L29-Y94 HydrophobicContact CD1-CD1 4.38Å; L29-Y94 HydrophobicContact CD1-CD2 3.93Å; L29-Y94 HydrophobicContact CD1-CE1 4.21Å; L29-Y94 HydrophobicContact CD1-CE2 3.76Å; L29-Y94 HydrophobicContact CD1-CG 4.24Å; N32-Y94 PolarHBondContact ND2-OH 2.86Å; W89-Y94 HydrophobicContact CB-CD2 4.48Å; W89-Y94 HydrophobicContact CB-CE2 4.43Å; W89-Y94 AromaticContact CD1-CD2 3.87Å; W89-Y94 HydrophobicContact CG-CD2 4.44Å; P91-Y94 CarbonylContact O-C 3.54Å; P91-Y94 PolarHBondContact O-N 3.43Å; L92-Y94 VanDerWaalsContact C-N 3.32Å; Y94-G96 PolarHBondContact O-N 3.23Å; Y94-V97 PolarHBondContact O-N 2.84Å
95	P	84.1	Confident	91.1	Very high	91 Å²	91	66.9 Å²	66.9	59%	0.591	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	126.9	-171.5	21.7	-33.8	0	0	0	111.9
96	G	84.3	Confident	91.1	Very high	82 Å²	82	65.2 Å²	65.2	85%	0.845	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	-3.3	-177.9	0	0	0	0	0	115.7	Y94	Y94-G96 PolarHBondContact O-N 3.23Å
97	V	88.1	Confident	91.2	Very high	16 Å²	16	60.5 Å²	60.5	10%	0.097	33%	0.333	C	S	.	.			trans	-108.6	87.2	-177.6	-168.2	0	0	0	0	111.1	Q26 L29 W89 Y94 V100	Q26-V97 HydrophobicContact CB-CG1 4.48Å; Q26-V97 HydrophobicContact CB-CG2 4.05Å; Q26-V97 HydrophobicContact CG-CG1 4.25Å; L29-V97 HydrophobicContact CD2-CB 4.45Å; L29-V97 HydrophobicContact CD2-CG1 3.65Å; W89-V97 PolarHBondContact NE1-O 3.34Å; Y94-V97 PolarHBondContact O-N 2.84Å; V97-V100 HydrophobicContact CG1-CG1 3.69Å
98	T	89.3	Confident	91.3	Very high	83 Å²	83	60.7 Å²	60.7	51%	0.509	33%	0.333	S	S	.	.	S	Bend	trans	-87.3	-39.5	176.5	49.8	0	0	0	0	113.2	W89 N133 S134	W89-T98 VanDerWaalsContact CZ2-O 3.31Å; W89-T98 WeakPolarHBondContact CZ2-O 3.45Å; T98-N133 PolarHBondContact O-OD1 3.48Å; T98-S134 PolarHBondContact O-N 2.95Å
99	N	92.7	Very high	91.3	Very high	72 Å²	72	59.9 Å²	59.9	39%	0.385	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	143.8	178.9	-61.2	-39.1	0	0	0	110.4	L131 V132 N133	N99-L131 HydrophobicContact CB-CD1 4Å; N99-V132 CarbonylContact C-O 3.55Å; N99-V132 VanDerWaalsContact CA-O 3.27Å; N99-V132 WeakPolarHBondContact CA-O 3.44Å; N99-N133 VanDerWaalsContact OD1-CA 3.32Å; N99-N133 WeakPolarHBondContact OD1-CA 3.23Å; N99-N133 WeakPolarHBondContact OD1-CB 3.06Å; N99-N133 PolarHBondContact OD1-OD1 3.42Å
100	V	93.4	Very high	91.4	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.006	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	168.3	169.8	-62.4	0	0	0	0	110.6	Q26 L29 Y30 W89 V97 F102 V132	Q26-V100 HydrophobicContact CG-CG1 4.36Å; L29-V100 HydrophobicContact CD2-CG1 3.68Å; Y30-V100 HydrophobicContact CE1-CB 4.21Å; W89-V100 HydrophobicContact CH2-CB 4.45Å; W89-V100 HydrophobicContact CH2-CG1 4.2Å; W89-V100 HydrophobicContact CH2-CG2 3.74Å; W89-V100 HydrophobicContact CZ2-CG1 4.23Å; W89-V100 HydrophobicContact CZ3-CG2 4.06Å; V97-V100 HydrophobicContact CG1-CG1 3.69Å; V100-F102 HydrophobicContact CG2-CD2 4.03Å; V100-F102 HydrophobicContact CG2-CE2 3.41Å; V100-F102 VanDerWaalsContact CG2-CE2 3.41Å; V100-F102 HydrophobicContact CG2-CZ 4.11Å; V100-V132 HydrophobicContact CG2-CB 4.21Å; V100-V132 PolarHBondContact N-O 3.01Å; V100-V132 PolarHBondContact O-N 3.24Å
101	R	94.4	Very high	91.3	Very high	161 Å²	161	57.8 Å²	57.8	61%	0.608	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.4	176.9	-67	-176.9	-176.7	90.2	-1	110.2	Y30 N129 I130 L131	Y30-R101 WeakPolarHBondContact CE1-O 3.24Å; Y30-R101 PolarHBondContact OH-N 3.38Å; Y30-R101 PolarHBondContact OH-O 3.15Å; R101-N129 HydrophobicContact CB-CB 4.17Å; R101-I130 CarbonylContact C-O 3.57Å; R101-I130 VanDerWaalsContact CA-O 3.31Å; R101-I130 WeakPolarHBondContact CA-O 3.38Å; R101-L131 HydrophobicContact CG-CD1 3.82Å
102	F	94.4	Very high	91.5	Very high	3 Å²	3	55.9 Å²	55.9	1%	0.013	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	141.1	174	-68.6	-86.2	0	0	0	109.6	Y30 L33 M34 L87 V100 I107 N129 I130 V132	Y30-F102 HydrophobicContact CD1-CD1 4.24Å; Y30-F102 AromaticContact CD1-CE1 3.59Å; Y30-F102 HydrophobicContact CD1-CE1 3.59Å; Y30-F102 AromaticContact CD1-CZ 3.91Å; Y30-F102 HydrophobicContact CD1-CZ 3.91Å; Y30-F102 HydrophobicContact CE1-CD1 4.02Å; Y30-F102 AromaticContact CE1-CE1 3.73Å; Y30-F102 HydrophobicContact CE1-CE1 3.73Å; Y30-F102 HydrophobicContact CE1-CE2 4.45Å; Y30-F102 HydrophobicContact CE1-CG 4.49Å; Y30-F102 AromaticContact CE1-CZ 3.98Å; Y30-F102 HydrophobicContact CE1-CZ 3.98Å; L33-F102 HydrophobicContact CB-CZ 4.45Å; L33-F102 HydrophobicContact CD1-CE2 4.47Å; L33-F102 HydrophobicContact CD1-CZ 4.01Å; M34-F102 HydrophobicContact CG-CE1 4.22Å; M34-F102 HydrophobicContact SD-CD1 4.15Å; M34-F102 HydrophobicContact SD-CE1 3.62Å; L87-F102 HydrophobicContact CD1-CE2 4.44Å; L87-F102 HydrophobicContact CD2-CE2 4.3Å; L87-F102 HydrophobicContact CD2-CZ 4.19Å; V100-F102 HydrophobicContact CG2-CD2 4.03Å; V100-F102 HydrophobicContact CG2-CE2 3.41Å; V100-F102 VanDerWaalsContact CG2-CE2 3.41Å; V100-F102 HydrophobicContact CG2-CZ 4.11Å; F102-I107 HydrophobicContact CB-CD1 3.95Å; F102-I107 HydrophobicContact CB-CG1 4.09Å; F102-I107 HydrophobicContact CB-CG2 4.04Å; F102-I107 HydrophobicContact CD1-CG2 3.88Å; F102-I107 HydrophobicContact CD2-CD1 4.24Å; F102-I107 HydrophobicContact CD2-CG2 4.22Å; F102-I107 HydrophobicContact CE1-CG2 4.35Å; F102-I107 HydrophobicContact CG-CD1 4.32Å; F102-I107 HydrophobicContact CG-CG2 3.81Å; F102-N129 CarbonylContact O-C 3.4Å; F102-N129 VanDerWaalsContact O-CA 3.24Å; F102-N129 WeakPolarHBondContact O-CA 3.44Å; F102-I130 PolarHBondContact N-O 2.92Å; F102-I130 PolarHBondContact O-N 3.27Å; F102-V132 HydrophobicContact CD2-CB 4.38Å; F102-V132 HydrophobicContact CD2-CG2 3.78Å; F102-V132 HydrophobicContact CE2-CB 4.41Å; F102-V132 HydrophobicContact CE2-CG2 4.21Å
103	P	94.4	Very high	91.7	Very high	35 Å²	35	50.8 Å²	50.8	23%	0.227	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	150.3	166.2	33.4	-35.7	0	0	0	109.7	H105 L106 N129	P103-H105 PolarHBondContact O-N 2.91Å; P103-L106 HydrophobicContact CG-CB 4.13Å; P103-L106 HydrophobicContact CG-CD1 3.64Å; P103-L106 HydrophobicContact CG-CG 3.8Å; P103-L106 PolarHBondContact O-N 3.28Å; P103-N129 VanDerWaalsContact CA-OD1 3.32Å; P103-N129 WeakPolarHBondContact CA-OD1 3.42Å
104	D	90.2	Very high	92	Very high	14 Å²	14	46 Å²	46	8%	0.075	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-7.9	-168.4	78.1	-48	0	0	0	116.1	K109 H127 I130 Y140	D104-K109 HydrophobicContact CB-CD 4.18Å; D104-K109 IonicContact OD2-NZ 2.68Å; D104-K109 PolarHBondContact OD2-NZ 2.97Å; D104-H127 IonicContact OD1-ND1 3.16Å; D104-H127 IonicContact OD2-CE1 2.61Å; D104-H127 IonicContact OD2-CG 2.76Å; D104-H127 IonicContact OD2-ND1 2.78Å; D104-H127 PolarHBondContact OD2-ND1 2.97Å; D104-I130 HydrophobicContact CB-CD1 4.32Å; D104-Y140 HydrophobicContact CB-CE2 4.36Å
105	H	90.9	Very high	92.2	Very high	131 Å²	131	47.1 Å²	47.1	61%	0.606	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-4.9	177	62.7	-93.7	0	0	0	113.9	P103	P103-H105 PolarHBondContact O-N 2.91Å
106	L	92.6	Very high	92.7	Very high	71 Å²	71	44.4 Å²	44.4	37%	0.372	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-13.7	177.8	-74.1	-174.6	0	0	0	114	M34 P103	M34-L106 HydrophobicContact CE-CB 4.3Å; M34-L106 WeakPolarHBondContact CE-O 3.32Å; P103-L106 HydrophobicContact CG-CB 4.13Å; P103-L106 HydrophobicContact CG-CD1 3.64Å; P103-L106 HydrophobicContact CG-CG 3.8Å; P103-L106 PolarHBondContact O-N 3.28Å
107	I	94.9	Very high	93.2	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.015	21%	0.206	C	C	.	.	S	Bend	trans	-131.7	161.2	176.2	63.9	169	0	0	0	110.7	Y37 L87 F102 I130 V132	Y37-I107 HydrophobicContact CE1-CB 4.04Å; Y37-I107 HydrophobicContact CE1-CG2 4.17Å; L87-I107 HydrophobicContact CD1-CB 4.13Å; L87-I107 HydrophobicContact CD1-CD1 3.81Å; L87-I107 HydrophobicContact CD1-CG2 3.82Å; L87-I107 HydrophobicContact CD2-CG2 4.31Å; F102-I107 HydrophobicContact CB-CD1 3.95Å; F102-I107 HydrophobicContact CB-CG1 4.09Å; F102-I107 HydrophobicContact CB-CG2 4.04Å; F102-I107 HydrophobicContact CD1-CG2 3.88Å; F102-I107 HydrophobicContact CD2-CD1 4.24Å; F102-I107 HydrophobicContact CD2-CG2 4.22Å; F102-I107 HydrophobicContact CE1-CG2 4.35Å; F102-I107 HydrophobicContact CG-CD1 4.32Å; F102-I107 HydrophobicContact CG-CG2 3.81Å; I107-I130 HydrophobicContact CD1-CB 4.04Å; I107-I130 HydrophobicContact CD1-CD1 3.73Å; I107-I130 HydrophobicContact CD1-CG1 4.48Å; I107-I130 HydrophobicContact CD1-CG2 3.94Å; I107-I130 HydrophobicContact CG1-CD1 3.67Å; I107-V132 HydrophobicContact CD1-CG2 4.03Å
108	W	95.3	Very high	93.3	Very high	5 Å²	5	42.7 Å²	42.7	2%	0.019	22%	0.217	C	C	.	.			trans	-63.2	140.2	176.2	-178.7	94.2	0	0	0	110.6	Y37 R42 P43 L51 W82 P110 Y173 L178	Y37-W108 PolarHBondContact OH-N 3.44Å; R42-W108 HydrophobicContact CG-CZ2 4.32Å; P43-W108 VanDerWaalsContact CD-CD2 3.44Å; P43-W108 HydrophobicContact CG-CB 4.47Å; P43-W108 HydrophobicContact CG-CD2 4.22Å; P43-W108 HydrophobicContact CG-CE3 3.89Å; P43-W108 HydrophobicContact CG-CG 4.48Å; L51-W108 HydrophobicContact CD2-CE3 4.2Å; L51-W108 HydrophobicContact CD2-CH2 3.41Å; L51-W108 VanDerWaalsContact CD2-CH2 3.41Å; L51-W108 HydrophobicContact CD2-CZ2 4.19Å; L51-W108 HydrophobicContact CD2-CZ3 3.41Å; L51-W108 VanDerWaalsContact CD2-CZ3 3.41Å; W82-W108 HydrophobicContact CG-CZ3 4.35Å; W82-W108 WeakPolarHBondContact CZ2-O 3.38Å; W82-W108 AromaticContact NE1-CE3 3.8Å; W82-W108 AromaticContact NE1-CZ3 3.96Å; W108-P110 HydrophobicContact CH2-CB 3.72Å; W108-P110 HydrophobicContact CH2-CG 4.41Å; W108-P110 HydrophobicContact CZ2-CB 4.48Å; W108-P110 HydrophobicContact CZ3-CB 4.15Å; W108-P110 HydrophobicContact CZ3-CG 4.36Å; W108-Y173 AromaticContact CZ2-CE2 3.81Å; W108-Y173 HydrophobicContact CZ2-CE2 3.81Å; W108-Y173 AromaticContact NE1-CZ 3.94Å; W108-Y173 PolarHBondContact NE1-OH 3.02Å; W108-Y173 VanDerWaalsContact NE1-OH 3.08Å; W108-L178 HydrophobicContact CH2-CD1 4.3Å
109	K	94.3	Very high	93.3	Very high	65 Å²	65	40 Å²	40	28%	0.283	20%	0.199	S	C	.	.			trans	-136.8	147.6	173.6	65.5	175.5	-179.2	171.9	0	110.5	W82 D104 I130	W82-K109 HydrophobicContact CH2-CB 4.38Å; W82-K109 HydrophobicContact CZ2-CB 4.48Å; D104-K109 HydrophobicContact CB-CD 4.18Å; D104-K109 IonicContact OD2-NZ 2.68Å; D104-K109 PolarHBondContact OD2-NZ 2.97Å; K109-I130 HydrophobicContact CB-CD1 4.41Å
110	P	94.8	Very high	92.9	Very high	10 Å²	10	45.6 Å²	45.6	7%	0.065	22%	0.223	C	C	.	.			trans	-71.7	145.8	174.5	31.2	-35.2	0	0	0	111.4	V53 L80 W82 W108 I112 L178	V53-P110 HydrophobicContact CG1-CG 4.15Å; V53-P110 HydrophobicContact CG2-CB 4.32Å; L80-P110 HydrophobicContact CD2-CG 3.75Å; W82-P110 HydrophobicContact CE3-CG 4.3Å; W82-P110 HydrophobicContact CZ3-CG 4.33Å; W108-P110 HydrophobicContact CH2-CB 3.72Å; W108-P110 HydrophobicContact CH2-CG 4.41Å; W108-P110 HydrophobicContact CZ2-CB 4.48Å; W108-P110 HydrophobicContact CZ3-CB 4.15Å; W108-P110 HydrophobicContact CZ3-CG 4.36Å; P110-I112 VanDerWaalsContact C-N 3.33Å; P110-I112 HydrophobicContact CB-CD1 4.06Å; P110-I112 HydrophobicContact CB-CG1 4.02Å; P110-I112 HydrophobicContact CG-CG1 4.28Å; P110-I112 PolarHBondContact O-N 3.5Å; P110-L178 HydrophobicContact CB-CD1 4.15Å
111	D	92.3	Very high	92.5	Very high	38 Å²	38	54.1 Å²	54.1	20%	0.203	26%	0.256	C	S	.	.			trans	-91.1	52.6	-175.9	65.5	-27.3	0	0	0	112.5	L113 S170 W171 T172 Y173	D111-L113 PolarHBondContact O-N 3.33Å; D111-S170 WeakPolarHBondContact OD1-CB 3.44Å; D111-S170 PolarHBondContact OD1-OG 2.93Å; D111-S170 PolarHBondContact OD2-OG 3.48Å; D111-W171 PolarHBondContact O-N 3.21Å; D111-W171 PolarHBondContact OD2-N 3.14Å; D111-T172 WeakPolarHBondContact OD2-CB 3.43Å; D111-T172 PolarHBondContact OD2-N 3.43Å; D111-T172 PolarHBondContact OD2-OG1 3.04Å; D111-Y173 WeakPolarHBondContact OD1-CD2 3.46Å
112	I	94	Very high	91.8	Very high	16 Å²	16	51.9 Å²	51.9	8%	0.082	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	111.6	-175.8	-49.1	-50.2	0	0	0	110.5	F55 L80 P110 F168 G169 L180	F55-I112 HydrophobicContact CD2-CG2 4.08Å; F55-I112 HydrophobicContact CE2-CG2 3.77Å; F55-I112 HydrophobicContact CZ-CG2 4.13Å; L80-I112 HydrophobicContact CD2-CB 4.19Å; L80-I112 HydrophobicContact CD2-CG1 3.74Å; P110-I112 VanDerWaalsContact C-N 3.33Å; P110-I112 HydrophobicContact CB-CD1 4.06Å; P110-I112 HydrophobicContact CB-CG1 4.02Å; P110-I112 HydrophobicContact CG-CG1 4.28Å; P110-I112 PolarHBondContact O-N 3.5Å; I112-F168 HydrophobicContact CG2-CB 4.08Å; I112-G169 WeakPolarHBondContact CA-O 3.16Å; I112-L180 HydrophobicContact CD1-CD1 4.27Å; I112-L180 HydrophobicContact CD1-CD2 3.87Å; I112-L180 HydrophobicContact CD1-CG 4.48Å; I112-L180 HydrophobicContact CG1-CD2 4.48Å
113	L	93.8	Very high	91.3	Very high	42 Å²	42	55.1 Å²	55.1	22%	0.22	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	157.3	-177.2	-62.9	-177.9	0	0	0	112.1	D111 D123 F168 G169 W171	D111-L113 PolarHBondContact O-N 3.33Å; L113-D123 HydrophobicContact CD2-CB 4.31Å; L113-F168 WeakPolarHBondContact O-CA 3.43Å; L113-G169 PolarHBondContact N-O 3.49Å; L113-G169 PolarHBondContact O-N 3.44Å; L113-G169 VanDerWaalsContact O-N 3.14Å; L113-W171 HydrophobicContact CD1-CB 4.07Å; L113-W171 HydrophobicContact CD1-CG 4.29Å
114	L	95.1	Very high	90.6	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.016	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	110.2	172.9	179.8	69.8	0	0	0	109.7	N116 S117 F146 L166 K167 F168	L114-N116 VanDerWaalsContact C-N 3.35Å; L114-N116 WeakPolarHBondContact CD1-OD1 3.47Å; L114-N116 PolarHBondContact O-N 2.94Å; L114-S117 PolarHBondContact O-N 3.24Å; L114-F146 HydrophobicContact CB-CD1 4.31Å; L114-F146 HydrophobicContact CD2-CB 4.23Å; L114-F146 HydrophobicContact CD2-CD1 4.11Å; L114-L166 HydrophobicContact CD1-CB 4.27Å; L114-L166 HydrophobicContact CD1-CD2 4.43Å; L114-K167 CarbonylContact C-O 3.57Å; L114-K167 WeakPolarHBondContact CA-O 3.44Å; L114-F168 HydrophobicContact CB-CD1 4.25Å; L114-F168 HydrophobicContact CB-CE1 3.98Å; L114-F168 HydrophobicContact CD1-CD1 4.42Å; L114-F168 HydrophobicContact CD1-CE1 4.11Å; L114-F168 HydrophobicContact CD1-CE2 4.28Å; L114-F168 HydrophobicContact CD1-CZ 4.05Å
115	Y	92.9	Very high	90.6	Very high	48 Å²	48	54.9 Å²	54.9	19%	0.188	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-32.7	-176.1	-72	11.2	0	0	0	112.7	K167 S170 W171 Y210	Y115-K167 HydrophobicContact CD2-CD 3.68Å; Y115-K167 HydrophobicContact CD2-CG 4.23Å; Y115-K167 HydrophobicContact CE2-CD 4.46Å; Y115-K167 HydrophobicContact CG-CD 4.26Å; Y115-K167 HydrophobicContact CG-CG 4.44Å; Y115-K167 PolarHBondContact N-O 3.14Å; Y115-S170 PolarHBondContact OH-O 3.37Å; Y115-W171 HydrophobicContact CD1-CE3 4.34Å; Y115-W171 HydrophobicContact CD1-CZ3 4.42Å; Y115-W171 HydrophobicContact CE1-CE3 4.25Å; Y115-Y210 WeakPolarHBondContact CE2-OH 3.29Å
116	N	94.5	Very high	90.5	Very high	33 Å²	33	54.7 Å²	54.7	18%	0.176	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	38.5	177.1	68.6	-58.1	0	0	0	112.5	L114 S148 T149 D165 K167	L114-N116 VanDerWaalsContact C-N 3.35Å; L114-N116 WeakPolarHBondContact CD1-OD1 3.47Å; L114-N116 PolarHBondContact O-N 2.94Å; N116-S148 CarbonylContact O-C 3.56Å; N116-S148 VanDerWaalsContact O-CA 3.32Å; N116-S148 WeakPolarHBondContact O-CA 3.4Å; N116-T149 PolarHBondContact ND2-O 2.98Å; N116-T149 VanDerWaalsContact ND2-O 3.1Å; N116-T149 PolarHBondContact O-N 3.05Å; N116-T149 PolarHBondContact O-OG1 3.47Å; N116-D165 PolarHBondContact ND2-O 2.94Å; N116-K167 PolarHBondContact OD1-N 3.4Å
117	S	94.4	Very high	90.4	Very high	22 Å²	22	57 Å²	57	15%	0.154	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-60.2	141.2	173.9	-175.8	0	0	0	0	111.9	L114 D119 K147	L114-S117 PolarHBondContact O-N 3.24Å; S117-D119 PolarHBondContact OG-N 3.5Å; S117-D119 PolarHBondContact OG-O 2.84Å; S117-K147 WeakPolarHBondContact CA-O 3.45Å
118	A	91.4	Very high	90.3	Very high	41 Å²	41	59 Å²	59	34%	0.339	29%	0.287	S	S	.	.			trans	-111.9	2.3	169.9	0	0	0	0	0	112.9	V71 K147 T149	V71-A118 HydrophobicContact CG1-CB 3.93Å; V71-A118 HydrophobicContact CG2-CB 3.82Å; A118-K147 HydrophobicContact CB-CB 4.14Å; A118-K147 PolarHBondContact N-O 3.03Å; A118-T149 HydrophobicContact CB-CG2 3.88Å
119	D	88.6	Confident	90.3	Very high	25 Å²	25	63.4 Å²	63.4	13%	0.134	31%	0.311	C	S	.	.	S	Bend	trans	-92.9	149.4	174.2	-155.3	-72.9	0	0	0	111.3	S117 R121 K147	S117-D119 PolarHBondContact OG-N 3.5Å; S117-D119 PolarHBondContact OG-O 2.84Å; D119-R121 PolarHBondContact O-N 3.04Å; D119-R121 PolarHBondContact OD1-N 3.31Å; D119-K147 HydrophobicContact CB-CB 4.23Å; D119-K147 HydrophobicContact CB-CD 4.16Å; D119-K147 HydrophobicContact CB-CG 4.43Å; D119-K147 WeakPolarHBondContact OD2-CD 3.25Å; D119-K147 VanDerWaalsContact OD2-CE 3.23Å; D119-K147 WeakPolarHBondContact OD2-CE 3.38Å; D119-K147 IonicContact OD2-NZ 3.86Å; D119-K147 PolarHBondContact OD2-NZ 2.93Å
120	E	84.4	Confident	90.4	Very high	190 Å²	190	60.3 Å²	60.3	89%	0.888	30%	0.298	S	S	*	.	S	Bend	trans	-59.5	-27	170.2	-60.5	178.4	169.4	0	0	111.8
121	R	85.1	Confident	90.5	Very high	181 Å²	181	62.6 Å²	62.6	68%	0.683	31%	0.309	S	S	*	.			trans	-97.8	100.3	173.9	-75	175	-75.5	-175	-6.5	111.2	D119 D123	D119-R121 PolarHBondContact O-N 3.04Å; D119-R121 PolarHBondContact OD1-N 3.31Å; R121-D123 VanDerWaalsContact C-N 3.33Å; R121-D123 PolarHBondContact O-N 3.15Å
122	F	80.4	Confident	90.6	Very high	114 Å²	114	60.8 Å²	60.8	50%	0.5	30%	0.3	S	S	.	.	S	Bend	trans	-62.2	-34	175.4	-78	-92.5	0	0	0	113.9
123	D	83.2	Confident	90.7	Very high	70 Å²	70	63 Å²	63	37%	0.374	31%	0.311	S	S	.	.			trans	-91	104.6	162.2	-171.6	-5.6	0	0	0	108.6	L113 R121 T125	L113-D123 HydrophobicContact CD2-CB 4.31Å; R121-D123 VanDerWaalsContact C-N 3.33Å; R121-D123 PolarHBondContact O-N 3.15Å; D123-T125 WeakPolarHBondContact OD1-CB 3.25Å; D123-T125 PolarHBondContact OD1-N 2.87Å; D123-T125 PolarHBondContact OD1-OG1 3.46Å
124	A	80.2	Confident	90.7	Very high	22 Å²	22	62 Å²	62	18%	0.182	31%	0.308	C	S	.	.			trans	-102	14	177.7	0	0	0	0	0	112.7	G144 I145 F146	A124-G144 VanDerWaalsContact O-CA 3.23Å; A124-G144 WeakPolarHBondContact O-CA 3.5Å; A124-I145 WeakPolarHBondContact CB-O 3.17Å; A124-I145 PolarHBondContact O-N 3.02Å; A124-F146 HydrophobicContact CB-CD1 4.32Å; A124-F146 HydrophobicContact CB-CE1 4.44Å
125	T	89.3	Confident	90.7	Very high	23 Å²	23	64.7 Å²	64.7	14%	0.141	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-85	148.4	179.7	68.6	0	0	0	0	112.4	L78 D123 P142 F146	L78-T125 HydrophobicContact CD1-CG2 4.01Å; D123-T125 WeakPolarHBondContact OD1-CB 3.25Å; D123-T125 PolarHBondContact OD1-N 2.87Å; D123-T125 PolarHBondContact OD1-OG1 3.46Å; T125-P142 HydrophobicContact CG2-CB 4.39Å; T125-P142 HydrophobicContact CG2-CG 4.25Å; T125-F146 HydrophobicContact CG2-CZ 3.87Å
126	F	90.2	Very high	90.7	Very high	126 Å²	126	62.4 Å²	62.4	55%	0.553	32%	0.318	S	S	*	.			trans	-90.5	121.8	166.3	-67.2	-84.9	0	0	0	109.3	T128 P143 I145	F126-T128 PolarHBondContact O-N 3.19Å; F126-T128 VanDerWaalsContact O-N 3.12Å; F126-P143 HydrophobicContact CB-CG 4.16Å; F126-P143 HydrophobicContact CD2-CG 4.44Å; F126-P143 WeakPolarHBondContact CD2-O 3.16Å; F126-P143 PolarHBondContact N-O 3.44Å; F126-I145 HydrophobicContact CE2-CG1 4.46Å
127	H	89.3	Confident	90.8	Very high	120 Å²	120	62.3 Å²	62.3	56%	0.556	32%	0.322	S	S	*	.			trans	-57.7	112.4	178.5	-54.9	-76.1	0	0	0	111.7	D104	D104-H127 IonicContact OD1-ND1 3.16Å; D104-H127 IonicContact OD2-CE1 2.61Å; D104-H127 IonicContact OD2-CG 2.76Å; D104-H127 IonicContact OD2-ND1 2.78Å; D104-H127 PolarHBondContact OD2-ND1 2.97Å
128	T	93.3	Very high	90.9	Very high	46 Å²	46	61.3 Å²	61.3	28%	0.282	32%	0.315	S	S	.	.			trans	-112.3	169.7	173.9	60.8	0	0	0	0	111.3	F126 Y140 L141	F126-T128 PolarHBondContact O-N 3.19Å; F126-T128 VanDerWaalsContact O-N 3.12Å; T128-Y140 WeakPolarHBondContact OG1-CE2 3.47Å; T128-L141 PolarHBondContact OG1-O 3.4Å
129	N	95.2	Very high	91.1	Very high	96 Å²	96	60.9 Å²	60.9	51%	0.513	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	125.4	174.8	-64.6	-60	0	0	0	110.5	R101 F102 P103	R101-N129 HydrophobicContact CB-CB 4.17Å; F102-N129 CarbonylContact O-C 3.4Å; F102-N129 VanDerWaalsContact O-CA 3.24Å; F102-N129 WeakPolarHBondContact O-CA 3.44Å; P103-N129 VanDerWaalsContact CA-OD1 3.32Å; P103-N129 WeakPolarHBondContact CA-OD1 3.42Å
130	I	95.9	Very high	91.5	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	130.8	170.7	-56.6	164.6	0	0	0	108.5	W82 R101 F102 D104 I107 K109 V132 C138 Y140	W82-I130 HydrophobicContact CH2-CD1 4.01Å; W82-I130 HydrophobicContact CH2-CG1 4.37Å; W82-I130 HydrophobicContact CH2-CG2 4.07Å; W82-I130 HydrophobicContact CZ2-CD1 4.2Å; W82-I130 HydrophobicContact CZ2-CG2 4.29Å; R101-I130 CarbonylContact C-O 3.57Å; R101-I130 VanDerWaalsContact CA-O 3.31Å; R101-I130 WeakPolarHBondContact CA-O 3.38Å; F102-I130 PolarHBondContact N-O 2.92Å; F102-I130 PolarHBondContact O-N 3.27Å; D104-I130 HydrophobicContact CB-CD1 4.32Å; I107-I130 HydrophobicContact CD1-CB 4.04Å; I107-I130 HydrophobicContact CD1-CD1 3.73Å; I107-I130 HydrophobicContact CD1-CG1 4.48Å; I107-I130 HydrophobicContact CD1-CG2 3.94Å; I107-I130 HydrophobicContact CG1-CD1 3.67Å; K109-I130 HydrophobicContact CB-CD1 4.41Å; I130-V132 HydrophobicContact CG2-CG2 4.14Å; I130-C138 HydrophobicContact CG2-CB 4.22Å; I130-Y140 HydrophobicContact CB-CD2 4.43Å; I130-Y140 HydrophobicContact CD1-CD2 4.5Å; I130-Y140 HydrophobicContact CG1-CD2 3.47Å; I130-Y140 VanDerWaalsContact CG1-CD2 3.47Å; I130-Y140 HydrophobicContact CG1-CE2 4.08Å; I130-Y140 HydrophobicContact CG1-CG 3.82Å
131	L	96.2	Very high	92	Very high	59 Å²	59	54.5 Å²	54.5	31%	0.309	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	128.9	172.6	-174.8	73.5	0	0	0	108.7	N99 R101 C138 S139	N99-L131 HydrophobicContact CB-CD1 4Å; R101-L131 HydrophobicContact CG-CD1 3.82Å; L131-C138 CarbonylContact O-C 3.4Å; L131-C138 WeakPolarHBondContact O-CA 3.32Å; L131-S139 PolarHBondContact N-O 3.46Å; L131-S139 PolarHBondContact O-N 3.32Å
132	V	96.2	Very high	92.5	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.9	177.9	-172.4	0	0	0	0	109.3	L87 W89 N99 V100 F102 I107 I130 A137	L87-V132 HydrophobicContact CB-CG1 3.99Å; L87-V132 HydrophobicContact CD1-CG1 4.4Å; L87-V132 HydrophobicContact CD1-CG2 4.26Å; W89-V132 HydrophobicContact CZ3-CG1 4.29Å; N99-V132 CarbonylContact C-O 3.55Å; N99-V132 VanDerWaalsContact CA-O 3.27Å; N99-V132 WeakPolarHBondContact CA-O 3.44Å; V100-V132 HydrophobicContact CG2-CB 4.21Å; V100-V132 PolarHBondContact N-O 3.01Å; V100-V132 PolarHBondContact O-N 3.24Å; F102-V132 HydrophobicContact CD2-CB 4.38Å; F102-V132 HydrophobicContact CD2-CG2 3.78Å; F102-V132 HydrophobicContact CE2-CB 4.41Å; F102-V132 HydrophobicContact CE2-CG2 4.21Å; I107-V132 HydrophobicContact CD1-CG2 4.03Å; I130-V132 HydrophobicContact CG2-CG2 4.14Å; V132-A137 WeakPolarHBondContact CA-O 3.23Å
133	N	95.7	Very high	93.2	Very high	61 Å²	61	42.1 Å²	42.1	33%	0.326	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	151.7	174.8	-175.3	-1.7	0	0	0	110.1	W89 T98 N99 S135 G136 A137	W89-N133 VanDerWaalsContact CH2-C 3.48Å; T98-N133 PolarHBondContact O-OD1 3.48Å; N99-N133 VanDerWaalsContact OD1-CA 3.32Å; N99-N133 WeakPolarHBondContact OD1-CA 3.23Å; N99-N133 WeakPolarHBondContact OD1-CB 3.06Å; N99-N133 PolarHBondContact OD1-OD1 3.42Å; N133-S135 PolarHBondContact O-N 3.45Å; N133-G136 PolarHBondContact O-N 2.93Å; N133-A137 HydrophobicContact CB-CB 4.41Å; N133-A137 PolarHBondContact N-O 2.88Å
134	S	93.9	Very high	93.8	Very high	23 Å²	23	38.9 Å²	38.9	16%	0.161	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-42.9	-28.3	174.8	54.3	0	0	0	0	116.7	W89 T98 G136	W89-S134 VanDerWaalsContact CH2-N 3.28Å; W89-S134 PolarHBondContact N-O 3.29Å; T98-S134 PolarHBondContact O-N 2.95Å; S134-G136 PolarHBondContact O-N 3.29Å
135	S	94.1	Very high	94.5	Very high	59 Å²	59	41.4 Å²	41.4	41%	0.413	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	-0.9	174.7	67.5	0	0	0	0	115.2	N83 N133 A137	N83-S135 PolarHBondContact OD1-O 3.19Å; N133-S135 PolarHBondContact O-N 3.45Å; S135-A137 VanDerWaalsContact C-N 3.3Å; S135-A137 WeakPolarHBondContact OG-CB 3.42Å; S135-A137 PolarHBondContact OG-N 2.85Å
136	G	93.3	Very high	94.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	82.5	2.9	-170.5	0	0	0	0	0	114.2	N83 D84 N133 S134 C138	N83-G136 CarbonylContact C-O 3.59Å; N83-G136 WeakPolarHBondContact CA-O 3.28Å; D84-G136 PolarHBondContact N-O 2.94Å; D84-G136 WeakPolarHBondContact O-CA 3.44Å; N133-G136 PolarHBondContact O-N 2.93Å; S134-G136 PolarHBondContact O-N 3.29Å; G136-C138 PolarHBondContact O-N 3.45Å
137	A	96.6	Very high	95	Very high	31 Å²	31	38.2 Å²	38.2	26%	0.256	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	116.1	179.6	0	0	0	0	0	110.3	N83 V132 N133 S135	N83-A137 PolarHBondContact OD1-N 3.05Å; V132-A137 WeakPolarHBondContact CA-O 3.23Å; N133-A137 HydrophobicContact CB-CB 4.41Å; N133-A137 PolarHBondContact N-O 2.88Å; S135-A137 VanDerWaalsContact C-N 3.3Å; S135-A137 WeakPolarHBondContact OG-CB 3.42Å; S135-A137 PolarHBondContact OG-N 2.85Å
138	C	96.8	Very high	95.3	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.007	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	140.5	178.3	-65.6	0	0	0	0	110.4	Y81 W82 I130 L131 G136	Y81-C138 WeakPolarHBondContact CA-O 3.27Å; W82-C138 HydrophobicContact CD2-CB 3.67Å; W82-C138 VanDerWaalsContact CE2-CB 3.44Å; W82-C138 HydrophobicContact CE3-CB 4.18Å; W82-C138 HydrophobicContact CG-CB 4.08Å; W82-C138 HydrophobicContact CH2-CB 4.28Å; W82-C138 HydrophobicContact CZ2-CB 3.78Å; W82-C138 HydrophobicContact CZ3-CB 4.46Å; W82-C138 PolarHBondContact N-O 2.9Å; W82-C138 PolarHBondContact O-N 2.88Å; I130-C138 HydrophobicContact CG2-CB 4.22Å; L131-C138 CarbonylContact O-C 3.4Å; L131-C138 WeakPolarHBondContact O-CA 3.32Å; G136-C138 PolarHBondContact O-N 3.45Å
139	S	96.4	Very high	95.4	Very high	31 Å²	31	34 Å²	34	22%	0.217	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	115.6	176	-56.4	0	0	0	0	109.2	Y81 L131	Y81-S139 WeakPolarHBondContact CD1-OG 3.32Å; L131-S139 PolarHBondContact N-O 3.46Å; L131-S139 PolarHBondContact O-N 3.32Å
140	Y	96	Very high	95.3	Very high	11 Å²	11	29.7 Å²	29.7	4%	0.043	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	119.5	178.9	-175.3	-136.7	0	0	0	109.5	L80 W82 D104 T128 I130 P142	L80-Y140 HydrophobicContact CD1-CD1 4.07Å; L80-Y140 PolarHBondContact N-O 3.02Å; L80-Y140 PolarHBondContact O-N 3.2Å; W82-Y140 HydrophobicContact CH2-CG 4.47Å; D104-Y140 HydrophobicContact CB-CE2 4.36Å; T128-Y140 WeakPolarHBondContact OG1-CE2 3.47Å; I130-Y140 HydrophobicContact CB-CD2 4.43Å; I130-Y140 HydrophobicContact CD1-CD2 4.5Å; I130-Y140 HydrophobicContact CG1-CD2 3.47Å; I130-Y140 VanDerWaalsContact CG1-CD2 3.47Å; I130-Y140 HydrophobicContact CG1-CE2 4.08Å; I130-Y140 HydrophobicContact CG1-CG 3.82Å; Y140-P142 HydrophobicContact CD1-CG 4Å; Y140-P142 HydrophobicContact CE1-CB 4.1Å; Y140-P142 HydrophobicContact CE1-CG 3.59Å; Y140-P142 HydrophobicContact CE2-CB 4.08Å; Y140-P142 HydrophobicContact CE2-CG 4.29Å; Y140-P142 HydrophobicContact CG-CG 4.49Å
141	L	94.9	Very high	95	Very high	71 Å²	71	35.7 Å²	35.7	37%	0.372	20%	0.195	S	C	.	.			trans	-125.1	77.3	-179.7	-72.4	84.9	0	0	0	109.7	L78 Q79 Y81 T128	L78-L141 WeakPolarHBondContact O-CA 3.4Å; Q79-L141 HydrophobicContact CG-CD2 4.33Å; Y81-L141 HydrophobicContact CE1-CD1 4.28Å; T128-L141 PolarHBondContact OG1-O 3.4Å
142	P	95.6	Very high	94.7	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.006	18%	0.183	C	C	.	.			trans	-81.5	132.7	174.5	33.5	-34.1	0	0	0	111	L78 L80 T125 Y140	L78-P142 HydrophobicContact CB-CG 4.16Å; L78-P142 PolarHBondContact N-O 3.21Å; L80-P142 HydrophobicContact CD1-CG 4.24Å; T125-P142 HydrophobicContact CG2-CB 4.39Å; T125-P142 HydrophobicContact CG2-CG 4.25Å; Y140-P142 HydrophobicContact CD1-CG 4Å; Y140-P142 HydrophobicContact CE1-CB 4.1Å; Y140-P142 HydrophobicContact CE1-CG 3.59Å; Y140-P142 HydrophobicContact CE2-CB 4.08Å; Y140-P142 HydrophobicContact CE2-CG 4.29Å; Y140-P142 HydrophobicContact CG-CG 4.49Å
143	P	95.6	Very high	94.3	Very high	34 Å²	34	34.6 Å²	34.6	22%	0.221	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	150.3	163.5	32.7	-30.7	0	0	0	109.7	W77 F126	W77-P143 VanDerWaalsContact CD1-CB 3.45Å; W77-P143 HydrophobicContact CG-CB 4.17Å; F126-P143 HydrophobicContact CB-CG 4.16Å; F126-P143 HydrophobicContact CD2-CG 4.44Å; F126-P143 WeakPolarHBondContact CD2-O 3.16Å; F126-P143 PolarHBondContact N-O 3.44Å
144	G	94.1	Very high	93.9	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	155.6	175.9	0	0	0	0	0	112.4	I76 A124	I76-G144 PolarHBondContact N-O 2.86Å; I76-G144 PolarHBondContact O-N 3.44Å; A124-G144 VanDerWaalsContact O-CA 3.23Å; A124-G144 WeakPolarHBondContact O-CA 3.5Å
145	I	95	Very high	93.5	Very high	75 Å²	75	36.6 Å²	36.6	39%	0.385	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	96.4	175.2	-59.1	175.4	0	0	0	107.4	T73 T74 A124 F126	T73-I145 HydrophobicContact CG2-CG2 3.79Å; T74-I145 CarbonylContact O-C 3.53Å; T74-I145 WeakPolarHBondContact O-CA 3.47Å; A124-I145 WeakPolarHBondContact CB-O 3.17Å; A124-I145 PolarHBondContact O-N 3.02Å; F126-I145 HydrophobicContact CE2-CG1 4.46Å
146	F	95.3	Very high	93.2	Very high	8 Å²	8	38.1 Å²	38.1	4%	0.035	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	126.9	-174	-65.1	-90.9	0	0	0	110.3	T73 T74 I76 L78 L114 A124 T125 F168	T73-F146 WeakPolarHBondContact CA-O 3.32Å; T74-F146 PolarHBondContact N-O 3.23Å; T74-F146 PolarHBondContact O-N 3.47Å; T74-F146 PolarHBondContact OG1-O 3.47Å; I76-F146 HydrophobicContact CB-CD2 3.83Å; I76-F146 HydrophobicContact CB-CE2 4.05Å; I76-F146 HydrophobicContact CD1-CB 4.45Å; I76-F146 HydrophobicContact CD1-CD2 4.15Å; I76-F146 HydrophobicContact CG1-CD2 4.43Å; I76-F146 HydrophobicContact CG2-CE2 4.37Å; L78-F146 HydrophobicContact CD1-CZ 3.81Å; L78-F146 HydrophobicContact CD2-CE2 4.19Å; L78-F146 HydrophobicContact CD2-CZ 4.01Å; L78-F146 HydrophobicContact CG-CE2 4.24Å; L78-F146 HydrophobicContact CG-CZ 3.89Å; L114-F146 HydrophobicContact CB-CD1 4.31Å; L114-F146 HydrophobicContact CD2-CB 4.23Å; L114-F146 HydrophobicContact CD2-CD1 4.11Å; A124-F146 HydrophobicContact CB-CD1 4.32Å; A124-F146 HydrophobicContact CB-CE1 4.44Å; T125-F146 HydrophobicContact CG2-CZ 3.87Å; F146-F168 HydrophobicContact CD1-CE1 4.13Å; F146-F168 HydrophobicContact CD1-CZ 4.33Å; F146-F168 AromaticContact CE1-CE1 3.85Å; F146-F168 HydrophobicContact CE1-CE1 3.85Å; F146-F168 HydrophobicContact CE1-CZ 4.37Å; F146-F168 HydrophobicContact CZ-CE1 4.34Å
147	K	95.6	Very high	92.8	Very high	75 Å²	75	38.9 Å²	38.9	33%	0.326	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.8	165.1	-60.2	-176.4	-171.8	147.3	0	108.5	V71 L72 T73 S117 A118 D119	V71-K147 HydrophobicContact CG1-CB 3.91Å; V71-K147 HydrophobicContact CG1-CG 4.42Å; L72-K147 WeakPolarHBondContact O-CA 3.5Å; T73-K147 HydrophobicContact CG2-CG 4.07Å; S117-K147 WeakPolarHBondContact CA-O 3.45Å; A118-K147 HydrophobicContact CB-CB 4.14Å; A118-K147 PolarHBondContact N-O 3.03Å; D119-K147 HydrophobicContact CB-CB 4.23Å; D119-K147 HydrophobicContact CB-CD 4.16Å; D119-K147 HydrophobicContact CB-CG 4.43Å; D119-K147 WeakPolarHBondContact OD2-CD 3.25Å; D119-K147 VanDerWaalsContact OD2-CE 3.23Å; D119-K147 WeakPolarHBondContact OD2-CE 3.38Å; D119-K147 IonicContact OD2-NZ 3.86Å; D119-K147 PolarHBondContact OD2-NZ 2.93Å
148	S	95.7	Very high	92.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	141.9	179.6	56	0	0	0	0	110.9	V71 L72 N116 C150 L166	V71-S148 WeakPolarHBondContact CA-O 3.46Å; L72-S148 PolarHBondContact N-O 3.05Å; L72-S148 PolarHBondContact O-N 3.39Å; L72-S148 PolarHBondContact O-OG 3.49Å; N116-S148 CarbonylContact O-C 3.56Å; N116-S148 VanDerWaalsContact O-CA 3.32Å; N116-S148 WeakPolarHBondContact O-CA 3.4Å; S148-C150 PolarHBondContact O-N 3.37Å; S148-L166 VanDerWaalsContact CB-CD2 3.44Å; S148-L166 VanDerWaalsContact OG-CD2 3.27Å; S148-L166 WeakPolarHBondContact OG-CD2 3.38Å
149	T	94.6	Very high	91.7	Very high	76 Å²	76	38.9 Å²	38.9	47%	0.466	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	128.3	166.6	53.4	0	0	0	0	109.6	Q70 N116 A118	Q70-T149 WeakPolarHBondContact O-CA 3.34Å; N116-T149 PolarHBondContact ND2-O 2.98Å; N116-T149 VanDerWaalsContact ND2-O 3.1Å; N116-T149 PolarHBondContact O-N 3.05Å; N116-T149 PolarHBondContact O-OG1 3.47Å; A118-T149 HydrophobicContact CB-CG2 3.88Å
150	C	93.8	Very high	91.3	Very high	7 Å²	7	37.5 Å²	37.5	5%	0.047	17%	0.174	C	C	.	.			trans	-139.4	122.8	-179.8	176.5	0	0	0	0	110.3	Q70 L72 S148 I152 C164	Q70-C150 CarbonylContact C-O 3.58Å; Q70-C150 WeakPolarHBondContact CB-O 3.38Å; Q70-C150 PolarHBondContact O-N 3.44Å; L72-C150 HydrophobicContact CB-CB 4.23Å; S148-C150 PolarHBondContact O-N 3.37Å; C150-I152 PolarHBondContact O-N 3.38Å; C150-C164 HydrophobicContact CB-CB 3.67Å; C150-C164 WeakPolarHBondContact CB-SG 3.43Å; C150-C164 WeakPolarHBondContact SG-CA 3.13Å; C150-C164 WeakPolarHBondContact SG-CB 3.38Å; C150-C164 CovalentContact SG-SG 2.03Å; C150-C164 PolarHBondContact SG-SG 3.42Å
151	Y	90	Very high	91.1	Very high	125 Å²	125	38.8 Å²	38.8	49%	0.49	18%	0.183	S	C	.	.			trans	-72.3	118.3	174.3	179.8	-90.4	0	0	0	110.1	D153	Y151-D153 HydrophobicContact CE1-CB 4.25Å
152	I	89.3	Confident	91	Very high	10 Å²	10	35.7 Å²	35.7	5%	0.051	17%	0.167	C	C	.	.			trans	-99.8	125.6	-179.7	-58.3	-58.6	0	0	0	109.9	V65 E67 C150 V154 Q162	V65-I152 HydrophobicContact CG1-CD1 4.35Å; E67-I152 HydrophobicContact CB-CB 4.41Å; E67-I152 HydrophobicContact CB-CG1 4.42Å; E67-I152 HydrophobicContact CB-CG2 3.98Å; E67-I152 HydrophobicContact CG-CG1 4.38Å; E67-I152 HydrophobicContact CG-CG2 3.78Å; C150-I152 PolarHBondContact O-N 3.38Å; I152-V154 HydrophobicContact CG2-CG1 4.21Å; I152-Q162 HydrophobicContact CD1-CB 4.3Å; I152-Q162 HydrophobicContact CD1-CG 4.15Å; I152-Q162 HydrophobicContact CG2-CG 4.34Å
153	D	87.6	Confident	91	Very high	26 Å²	26	43 Å²	43	14%	0.139	19%	0.194	C	C	.	.			trans	-100.4	106.8	-179.9	-175.4	-5.5	0	0	0	110.8	Y151 R155 W156 Q162	Y151-D153 HydrophobicContact CE1-CB 4.25Å; D153-R155 WeakPolarHBondContact OD1-CB 3.24Å; D153-R155 VanDerWaalsContact OD1-CG 3.27Å; D153-R155 WeakPolarHBondContact OD1-CG 3.46Å; D153-R155 IonicContact OD1-CZ 3.86Å; D153-R155 PolarHBondContact OD1-N 3.39Å; D153-R155 IonicContact OD1-NE 3.02Å; D153-R155 PolarHBondContact OD1-NE 2.85Å; D153-R155 IonicContact OD1-NH2 2.7Å; D153-R155 IonicContact OD2-CZ 3.79Å; D153-R155 VanDerWaalsContact OD2-CZ 3.28Å; D153-R155 IonicContact OD2-NE 2.82Å; D153-R155 PolarHBondContact OD2-NE 3.34Å; D153-R155 VanDerWaalsContact OD2-NE 3.1Å; D153-R155 IonicContact OD2-NH2 2.67Å; D153-R155 PolarHBondContact OD2-NH2 2.93Å; D153-W156 WeakPolarHBondContact OD2-CZ3 3.25Å; D153-Q162 PolarHBondContact O-NE2 2.75Å
154	V	87.1	Confident	91	Very high	5 Å²	5	41.4 Å²	41.4	3%	0.03	18%	0.184	C	C	.	.			trans	-89.7	1.6	-173.9	-63.5	0	0	0	0	114.3	I152 W156 F157 P284 S289 P291	I152-V154 HydrophobicContact CG2-CG1 4.21Å; V154-W156 VanDerWaalsContact C-N 3.3Å; V154-W156 PolarHBondContact O-N 2.87Å; V154-F157 VanDerWaalsContact O-CB 3.31Å; V154-F157 WeakPolarHBondContact O-CB 3.25Å; V154-F157 PolarHBondContact O-N 2.85Å; V154-F157 VanDerWaalsContact O-N 3.15Å; V154-P284 HydrophobicContact CG1-CG 3.97Å; V154-S289 WeakPolarHBondContact CG2-OG 3.06Å; V154-P291 HydrophobicContact CB-CG 4.26Å; V154-P291 HydrophobicContact CG2-CG 3.94Å
155	R	86.5	Confident	91.1	Very high	121 Å²	121	45.1 Å²	45.1	46%	0.457	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-45.4	-175.8	-79	-178.2	-73.6	-173	-0.5	114.1	D153 L292	D153-R155 WeakPolarHBondContact OD1-CB 3.24Å; D153-R155 VanDerWaalsContact OD1-CG 3.27Å; D153-R155 WeakPolarHBondContact OD1-CG 3.46Å; D153-R155 IonicContact OD1-CZ 3.86Å; D153-R155 PolarHBondContact OD1-N 3.39Å; D153-R155 IonicContact OD1-NE 3.02Å; D153-R155 PolarHBondContact OD1-NE 2.85Å; D153-R155 IonicContact OD1-NH2 2.7Å; D153-R155 IonicContact OD2-CZ 3.79Å; D153-R155 VanDerWaalsContact OD2-CZ 3.28Å; D153-R155 IonicContact OD2-NE 2.82Å; D153-R155 PolarHBondContact OD2-NE 3.34Å; D153-R155 VanDerWaalsContact OD2-NE 3.1Å; D153-R155 IonicContact OD2-NH2 2.67Å; D153-R155 PolarHBondContact OD2-NH2 2.93Å; R155-L292 VanDerWaalsContact O-CB 3.28Å; R155-L292 WeakPolarHBondContact O-CB 3.49Å; R155-L292 PolarHBondContact O-N 3.08Å
156	W	86.9	Confident	91.2	Very high	92 Å²	92	41.6 Å²	41.6	35%	0.348	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	11.4	-174.4	-59.5	-74.2	0	0	0	114.1	D153 V154 F159	D153-W156 WeakPolarHBondContact OD2-CZ3 3.25Å; V154-W156 VanDerWaalsContact C-N 3.3Å; V154-W156 PolarHBondContact O-N 2.87Å; W156-F159 CarbonylContact O-C 3.6Å; W156-F159 WeakPolarHBondContact O-CA 3.31Å; W156-F159 WeakPolarHBondContact O-CB 3.49Å; W156-F159 PolarHBondContact O-N 3.03Å
157	F	85	Confident	91.2	Very high	15 Å²	15	42.4 Å²	42.4	7%	0.066	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	134.3	-179.6	177.2	-85.1	0	0	0	111.8	V154 Y233 I293	V154-F157 VanDerWaalsContact O-CB 3.31Å; V154-F157 WeakPolarHBondContact O-CB 3.25Å; V154-F157 PolarHBondContact O-N 2.85Å; V154-F157 VanDerWaalsContact O-N 3.15Å; F157-Y233 HydrophobicContact CE1-CD1 4.29Å; F157-Y233 HydrophobicContact CE2-CE1 4.33Å; F157-Y233 AromaticContact CZ-CD1 3.77Å; F157-Y233 HydrophobicContact CZ-CD1 3.77Å; F157-Y233 AromaticContact CZ-CE1 3.63Å; F157-Y233 HydrophobicContact CZ-CE1 3.63Å; F157-Y233 HydrophobicContact CZ-CG 4.38Å; F157-I293 HydrophobicContact CD1-CG2 3.84Å; F157-I293 HydrophobicContact CE1-CG2 4.41Å
158	P	85.4	Confident	91.2	Very high	7 Å²	7	38.9 Å²	38.9	5%	0.045	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	cis	-92	12.3	4.4	38.4	-38.5	0	0	0	114.6	D160 T230 Y233	P158-D160 VanDerWaalsContact C-OD1 3.27Å; P158-D160 PolarHBondContact O-N 2.83Å; P158-T230 WeakPolarHBondContact O-CG2 3.43Å; P158-Y233 HydrophobicContact CB-CD2 3.95Å; P158-Y233 HydrophobicContact CB-CG 3.93Å; P158-Y233 HydrophobicContact CG-CG 4.5Å
159	F	85.5	Confident	91.2	Very high	26 Å²	26	38.9 Å²	38.9	11%	0.114	17%	0.174	C	C	.	.	S	Bend	trans	-90.6	28.7	-178.2	-53.7	-77.2	0	0	0	112.4	W156 T230 A497 N499 F500 A503	W156-F159 CarbonylContact O-C 3.6Å; W156-F159 WeakPolarHBondContact O-CA 3.31Å; W156-F159 WeakPolarHBondContact O-CB 3.49Å; W156-F159 PolarHBondContact O-N 3.03Å; F159-T230 HydrophobicContact CD1-CG2 3.78Å; F159-T230 HydrophobicContact CE1-CG2 4.09Å; F159-A497 HydrophobicContact CD2-CB 4.36Å; F159-N499 PolarHBondContact O-ND2 3.4Å; F159-N499 VanDerWaalsContact O-ND2 3.15Å; F159-F500 HydrophobicContact CD1-CD2 4.33Å; F159-F500 HydrophobicContact CD2-CD2 4.37Å; F159-F500 AromaticContact CE1-CD2 3.81Å; F159-F500 HydrophobicContact CE1-CD2 3.81Å; F159-F500 HydrophobicContact CE1-CE2 4.29Å; F159-F500 AromaticContact CE2-CD2 3.84Å; F159-F500 HydrophobicContact CE2-CD2 3.84Å; F159-F500 HydrophobicContact CE2-CE2 4.25Å; F159-F500 AromaticContact CZ-CD2 3.55Å; F159-F500 HydrophobicContact CZ-CD2 3.55Å; F159-F500 AromaticContact CZ-CE2 3.77Å; F159-F500 HydrophobicContact CZ-CE2 3.77Å; F159-A503 HydrophobicContact CD1-CB 3.77Å; F159-A503 HydrophobicContact CE1-CB 4.35Å
160	D	88	Confident	91.1	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	15%	0.152	C	C	.	.			trans	-83.2	150	-170.4	56.6	-62.1	0	0	0	114.2	P158 Q162 R228	P158-D160 VanDerWaalsContact C-OD1 3.27Å; P158-D160 PolarHBondContact O-N 2.83Å; D160-Q162 PolarHBondContact OD2-NE2 3.35Å; D160-R228 PolarHBondContact O-N 2.94Å; D160-R228 IonicContact OD1-CZ 2.67Å; D160-R228 IonicContact OD1-NE 2.68Å; D160-R228 PolarHBondContact OD1-NE 2.74Å; D160-R228 IonicContact OD1-NH2 2.99Å; D160-R228 IonicContact OD2-CZ 3.28Å; D160-R228 IonicContact OD2-NE 3.15Å; D160-R228 PolarHBondContact OD2-NE 3.28Å; D160-R228 IonicContact OD2-NH2 3.89Å; D160-R228 PolarHBondContact OD2-NH2 3.44Å; D160-R228 VanDerWaalsContact OD2-NH2 3.13Å
161	V	91.2	Very high	91	Very high	39 Å²	39	42.6 Å²	42.6	24%	0.236	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	108	174.3	177.6	0	0	0	0	107.7	V225 M226 R227	V161-V225 HydrophobicContact CG1-CG1 3.99Å; V161-M226 CarbonylContact C-O 3.58Å; V161-M226 WeakPolarHBondContact CA-O 3.36Å; V161-R227 HydrophobicContact CG2-CB 4.18Å; V161-R227 HydrophobicContact CG2-CG 4.03Å
162	Q	93.4	Very high	91	Very high	5 Å²	5	40.9 Å²	40.9	2%	0.023	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	152.4	-176.8	-54.8	-57.1	-19.9	0	0	111	I152 D153 D160 W196 M226	I152-Q162 HydrophobicContact CD1-CB 4.3Å; I152-Q162 HydrophobicContact CD1-CG 4.15Å; I152-Q162 HydrophobicContact CG2-CG 4.34Å; D153-Q162 PolarHBondContact O-NE2 2.75Å; D160-Q162 PolarHBondContact OD2-NE2 3.35Å; Q162-W196 HydrophobicContact CB-CZ3 4.37Å; Q162-W196 HydrophobicContact CG-CH2 3.68Å; Q162-W196 HydrophobicContact CG-CZ3 3.81Å; Q162-M226 HydrophobicContact CB-CE 3.93Å; Q162-M226 HydrophobicContact CB-CG 4.14Å; Q162-M226 HydrophobicContact CG-CE 4.43Å; Q162-M226 PolarHBondContact N-O 2.81Å; Q162-M226 PolarHBondContact O-N 2.92Å
163	R	95.1	Very high	91.2	Very high	154 Å²	154	42.9 Å²	42.9	58%	0.581	19%	0.189	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.6	105.3	178.8	-68.6	-168.3	171.1	82.1	0.3	109.3	T223 V224 V225	R163-T223 HydrophobicContact CB-CG2 3.89Å; R163-T223 HydrophobicContact CG-CG2 4.4Å; R163-V224 WeakPolarHBondContact CA-O 3.09Å; R163-V225 HydrophobicContact CG-CG1 4.26Å; R163-V225 HydrophobicContact CG-CG2 4.18Å
164	C	96.4	Very high	91.3	Very high	1 Å²	1	42 Å²	42	1%	0.007	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	115.3	-178.3	-63.6	0	0	0	0	110.7	L72 C150 T223 V224	L72-C164 HydrophobicContact CB-CB 4.42Å; L72-C164 HydrophobicContact CD2-CB 3.37Å; L72-C164 HydrophobicContact CG-CB 4.49Å; C150-C164 HydrophobicContact CB-CB 3.67Å; C150-C164 WeakPolarHBondContact CB-SG 3.43Å; C150-C164 WeakPolarHBondContact SG-CA 3.13Å; C150-C164 WeakPolarHBondContact SG-CB 3.38Å; C150-C164 CovalentContact SG-SG 2.03Å; C150-C164 PolarHBondContact SG-SG 3.42Å; C164-T223 CarbonylContact O-C 3.51Å; C164-T223 WeakPolarHBondContact O-CA 3.45Å; C164-V224 PolarHBondContact N-O 3.27Å; C164-V224 PolarHBondContact O-N 3.03Å
165	D	96.3	Very high	91.5	Very high	80 Å²	80	42.7 Å²	42.7	43%	0.428	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	128.4	177.1	-76.7	-24.2	0	0	0	111.2	N116 T221 T223	N116-D165 PolarHBondContact ND2-O 2.94Å; D165-T221 HydrophobicContact CB-CG2 3.67Å; D165-T223 VanDerWaalsContact OD1-CB 3.29Å; D165-T223 WeakPolarHBondContact OD1-CB 3.49Å; D165-T223 WeakPolarHBondContact OD1-CG2 3.47Å; D165-T223 PolarHBondContact OD1-OG1 3.31Å
166	L	96	Very high	91.7	Very high	0 Å²	0	45 Å²	45	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	101.5	170.8	-60.2	176.6	0	0	0	108.4	L57 I76 L114 S148 F168 T221 F222 V224	L57-L166 HydrophobicContact CD1-CD1 4.3Å; I76-L166 HydrophobicContact CD1-CD1 3.57Å; L114-L166 HydrophobicContact CD1-CB 4.27Å; L114-L166 HydrophobicContact CD1-CD2 4.43Å; S148-L166 VanDerWaalsContact CB-CD2 3.44Å; S148-L166 VanDerWaalsContact OG-CD2 3.27Å; S148-L166 WeakPolarHBondContact OG-CD2 3.38Å; L166-F168 HydrophobicContact CB-CD2 4.39Å; L166-F168 HydrophobicContact CB-CE2 3.79Å; L166-T221 WeakPolarHBondContact O-CA 3.49Å; L166-F222 PolarHBondContact N-O 3.41Å; L166-F222 PolarHBondContact O-N 3.38Å; L166-V224 HydrophobicContact CD1-CG2 3.77Å; L166-V224 HydrophobicContact CG-CG2 4.31Å
167	K	95.7	Very high	92	Very high	26 Å²	26	42 Å²	42	11%	0.113	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	108	-175.5	-172.4	-176	-179.3	-177.3	0	111.7	L114 Y115 N116 Y210 D219	L114-K167 CarbonylContact C-O 3.57Å; L114-K167 WeakPolarHBondContact CA-O 3.44Å; Y115-K167 HydrophobicContact CD2-CD 3.68Å; Y115-K167 HydrophobicContact CD2-CG 4.23Å; Y115-K167 HydrophobicContact CE2-CD 4.46Å; Y115-K167 HydrophobicContact CG-CD 4.26Å; Y115-K167 HydrophobicContact CG-CG 4.44Å; Y115-K167 PolarHBondContact N-O 3.14Å; N116-K167 PolarHBondContact OD1-N 3.4Å; K167-Y210 PolarHBondContact NZ-OH 2.95Å; K167-D219 WeakPolarHBondContact CE-OD1 3.44Å; K167-D219 VanDerWaalsContact CE-OD2 3.28Å; K167-D219 WeakPolarHBondContact CE-OD2 3.3Å; K167-D219 VanDerWaalsContact NZ-CG 3.31Å; K167-D219 IonicContact NZ-OD1 2.72Å; K167-D219 PolarHBondContact NZ-OD1 3.38Å; K167-D219 IonicContact NZ-OD2 3.66Å
168	F	96	Very high	92.4	Very high	1 Å²	1	41.3 Å²	41.3	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	145.1	175.9	-65	-84.4	0	0	0	112.4	F55 L78 I112 L113 L114 F146 L166 D219 I220 F222	F55-F168 HydrophobicContact CD1-CB 4.49Å; F55-F168 HydrophobicContact CE1-CB 3.52Å; F55-F168 AromaticContact CE1-CD2 3.81Å; F55-F168 HydrophobicContact CE1-CD2 3.81Å; F55-F168 AromaticContact CE1-CG 3.73Å; F55-F168 HydrophobicContact CE1-CG 3.73Å; F55-F168 HydrophobicContact CZ-CB 3.6Å; F55-F168 AromaticContact CZ-CD1 3.85Å; F55-F168 HydrophobicContact CZ-CD1 3.85Å; F55-F168 AromaticContact CZ-CD2 3.77Å; F55-F168 HydrophobicContact CZ-CD2 3.77Å; F55-F168 HydrophobicContact CZ-CE1 4.44Å; F55-F168 HydrophobicContact CZ-CE2 4.37Å; F55-F168 AromaticContact CZ-CG 3.46Å; F55-F168 HydrophobicContact CZ-CG 3.46Å; F55-F168 VanDerWaalsContact CZ-CG 3.46Å; L78-F168 HydrophobicContact CD2-CE1 3.95Å; L78-F168 HydrophobicContact CD2-CZ 3.96Å; I112-F168 HydrophobicContact CG2-CB 4.08Å; L113-F168 WeakPolarHBondContact O-CA 3.43Å; L114-F168 HydrophobicContact CB-CD1 4.25Å; L114-F168 HydrophobicContact CB-CE1 3.98Å; L114-F168 HydrophobicContact CD1-CD1 4.42Å; L114-F168 HydrophobicContact CD1-CE1 4.11Å; L114-F168 HydrophobicContact CD1-CE2 4.28Å; L114-F168 HydrophobicContact CD1-CZ 4.05Å; F146-F168 HydrophobicContact CD1-CE1 4.13Å; F146-F168 HydrophobicContact CD1-CZ 4.33Å; F146-F168 AromaticContact CE1-CE1 3.85Å; F146-F168 HydrophobicContact CE1-CE1 3.85Å; F146-F168 HydrophobicContact CE1-CZ 4.37Å; F146-F168 HydrophobicContact CZ-CE1 4.34Å; L166-F168 HydrophobicContact CB-CD2 4.39Å; L166-F168 HydrophobicContact CB-CE2 3.79Å; F168-D219 WeakPolarHBondContact O-CA 3.46Å; F168-I220 PolarHBondContact N-O 2.88Å; F168-I220 PolarHBondContact O-N 2.65Å; F168-F222 HydrophobicContact CD2-CD2 4.44Å
169	G	94.8	Very high	92.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	168.2	173.9	0	0	0	0	0	112.1	I112 L113	I112-G169 WeakPolarHBondContact CA-O 3.16Å; L113-G169 PolarHBondContact N-O 3.49Å; L113-G169 PolarHBondContact O-N 3.44Å; L113-G169 VanDerWaalsContact O-N 3.14Å
170	S	94.2	Very high	93.4	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.014	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	140.2	169.3	172	0	0	0	0	110	D111 Y115 Y173	D111-S170 WeakPolarHBondContact OD1-CB 3.44Å; D111-S170 PolarHBondContact OD1-OG 2.93Å; D111-S170 PolarHBondContact OD2-OG 3.48Å; Y115-S170 PolarHBondContact OH-O 3.37Å; S170-Y173 WeakPolarHBondContact OG-CB 3.43Å; S170-Y173 PolarHBondContact OG-N 3.16Å
171	W	90.3	Very high	93.7	Very high	158 Å²	158	44.6 Å²	44.6	60%	0.598	21%	0.208	S	C	*	.	S	Bend	trans	-84.5	-36.2	178.9	-167.5	-102.2	0	0	0	113.1	D111 L113 Y115	D111-W171 PolarHBondContact O-N 3.21Å; D111-W171 PolarHBondContact OD2-N 3.14Å; L113-W171 HydrophobicContact CD1-CB 4.07Å; L113-W171 HydrophobicContact CD1-CG 4.29Å; Y115-W171 HydrophobicContact CD1-CE3 4.34Å; Y115-W171 HydrophobicContact CD1-CZ3 4.42Å; Y115-W171 HydrophobicContact CE1-CE3 4.25Å
172	T	90.8	Very high	94	Very high	90 Å²	90	46.1 Å²	46.1	55%	0.552	21%	0.213	S	C	*	.	S	Bend	trans	-110.7	-25.4	-172	60.9	0	0	0	0	114.4	D111	D111-T172 WeakPolarHBondContact OD2-CB 3.43Å; D111-T172 PolarHBondContact OD2-N 3.43Å; D111-T172 PolarHBondContact OD2-OG1 3.04Å
173	Y	92.1	Very high	94.1	Very high	51 Å²	51	48.1 Å²	48.1	20%	0.2	23%	0.226	C	C	.	.			trans	-96.9	111.8	-177	-63.1	-73.7	0	0	0	112.1	W108 D111 S170 S177 L178	W108-Y173 AromaticContact CZ2-CE2 3.81Å; W108-Y173 HydrophobicContact CZ2-CE2 3.81Å; W108-Y173 AromaticContact NE1-CZ 3.94Å; W108-Y173 PolarHBondContact NE1-OH 3.02Å; W108-Y173 VanDerWaalsContact NE1-OH 3.08Å; D111-Y173 WeakPolarHBondContact OD1-CD2 3.46Å; S170-Y173 WeakPolarHBondContact OG-CB 3.43Å; S170-Y173 PolarHBondContact OG-N 3.16Å; Y173-S177 WeakPolarHBondContact CB-OG 3.24Å; Y173-L178 HydrophobicContact CD2-CD1 3.84Å; Y173-L178 HydrophobicContact CG-CB 4.3Å; Y173-L178 HydrophobicContact CG-CD1 4.14Å
174	G	91.3	Very high	94	Very high	9 Å²	9	48.8 Å²	48.8	9%	0.093	24%	0.235	C	C	.	.			trans	-69	160.9	167.6	0	0	0	0	0	112.6	W176 S177 L178	G174-W176 PolarHBondContact O-N 3.15Å; G174-S177 PolarHBondContact O-N 3.28Å; G174-S177 PolarHBondContact O-OG 2.95Å; G174-L178 PolarHBondContact O-N 3.23Å
175	G	90.4	Very high	93.9	Very high	18 Å²	18	50.1 Å²	50.1	19%	0.186	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.4	-168.1	0	0	0	0	0	116.8	S177 L178 P216	G175-S177 VanDerWaalsContact C-N 3.27Å; G175-L178 WeakPolarHBondContact CA-O 3.45Å; G175-P216 WeakPolarHBondContact CA-O 3.42Å; G175-P216 PolarHBondContact N-O 3.22Å
176	W	91.4	Very high	93.7	Very high	171 Å²	171	48.7 Å²	48.7	65%	0.648	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-22.4	171	-57.8	-15.7	0	0	0	112.7	S50 G174 E215	S50-W176 WeakPolarHBondContact CB-O 3.48Å; G174-W176 PolarHBondContact O-N 3.15Å; W176-E215 HydrophobicContact CD2-CG 3.86Å; W176-E215 HydrophobicContact CE3-CG 3.62Å; W176-E215 HydrophobicContact CH2-CG 4.04Å; W176-E215 HydrophobicContact CZ2-CG 4.27Å; W176-E215 HydrophobicContact CZ3-CG 3.72Å
177	S	92.4	Very high	93.6	Very high	29 Å²	29	52 Å²	52	20%	0.203	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-31.7	-177.6	67.5	0	0	0	0	113.6	R42 L51 Y173 G174 G175	R42-S177 PolarHBondContact NH1-O 2.95Å; L51-S177 PolarHBondContact N-O 3.26Å; Y173-S177 WeakPolarHBondContact CB-OG 3.24Å; G174-S177 PolarHBondContact O-N 3.28Å; G174-S177 PolarHBondContact O-OG 2.95Å; G175-S177 VanDerWaalsContact C-N 3.27Å
178	L	94.3	Very high	93.4	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	122.8	179.8	-167.2	162.9	0	0	0	110.2	L51 V53 W108 P110 Y173 G174 G175 L180	L51-L178 WeakPolarHBondContact O-CA 3.37Å; V53-L178 HydrophobicContact CB-CD2 4.19Å; V53-L178 HydrophobicContact CG2-CD1 4.22Å; V53-L178 HydrophobicContact CG2-CD2 3.93Å; V53-L178 HydrophobicContact CG2-CG 3.96Å; W108-L178 HydrophobicContact CH2-CD1 4.3Å; P110-L178 HydrophobicContact CB-CD1 4.15Å; Y173-L178 HydrophobicContact CD2-CD1 3.84Å; Y173-L178 HydrophobicContact CG-CB 4.3Å; Y173-L178 HydrophobicContact CG-CD1 4.14Å; G174-L178 PolarHBondContact O-N 3.23Å; G175-L178 WeakPolarHBondContact CA-O 3.45Å; L178-L180 HydrophobicContact CD2-CD2 4.18Å; L178-L180 HydrophobicContact CD2-CG 3.81Å
179	D	94.8	Very high	93.1	Very high	29 Å²	29	58.2 Å²	58.2	16%	0.155	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	109.3	179.2	173.6	23.9	0	0	0	110.3	L51 T52 V53 K181 R205	L51-D179 PolarHBondContact O-N 2.87Å; T52-D179 WeakPolarHBondContact CA-O 3.43Å; V53-D179 PolarHBondContact N-O 3.39Å; D179-K181 IonicContact OD1-NZ 2.75Å; D179-K181 PolarHBondContact OD1-NZ 3.34Å; D179-K181 WeakPolarHBondContact OD2-CE 3.42Å; D179-K181 IonicContact OD2-NZ 2.74Å; D179-K181 PolarHBondContact OD2-NZ 2.93Å; D179-R205 IonicContact OD1-CZ 3.81Å; D179-R205 IonicContact OD1-NE 3.83Å; D179-R205 IonicContact OD1-NH2 3.35Å; D179-R205 PolarHBondContact OD1-NH2 2.98Å
180	L	95.7	Very high	93.1	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	126.7	177	-79.1	166.7	0	0	0	111.2	V53 F55 I112 L178 R205 P218 I220	V53-L180 HydrophobicContact CB-CD2 4.16Å; V53-L180 HydrophobicContact CG1-CD2 4.2Å; V53-L180 CarbonylContact O-C 3.54Å; V53-L180 WeakPolarHBondContact O-CA 3.42Å; F55-L180 HydrophobicContact CB-CD2 3.95Å; I112-L180 HydrophobicContact CD1-CD1 4.27Å; I112-L180 HydrophobicContact CD1-CD2 3.87Å; I112-L180 HydrophobicContact CD1-CG 4.48Å; I112-L180 HydrophobicContact CG1-CD2 4.48Å; L178-L180 HydrophobicContact CD2-CD2 4.18Å; L178-L180 HydrophobicContact CD2-CG 3.81Å; L180-R205 WeakPolarHBondContact O-CD 3.43Å; L180-R205 PolarHBondContact O-NE 3.47Å; L180-P218 HydrophobicContact CB-CB 4.38Å; L180-I220 HydrophobicContact CB-CD1 3.94Å; L180-I220 HydrophobicContact CB-CG1 4.49Å
181	K	95.7	Very high	93.1	Very high	72 Å²	72	65.1 Å²	65.1	31%	0.313	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.3	170	-64.4	-57.3	-179.3	-136.1	0	110.1	T52 V53 Y54 F55 D179	T52-K181 HydrophobicContact CG2-CB 4.48Å; T52-K181 HydrophobicContact CG2-CG 3.58Å; V53-K181 PolarHBondContact O-N 3.07Å; Y54-K181 CarbonylContact C-O 3.49Å; Y54-K181 WeakPolarHBondContact CA-O 3.3Å; Y54-K181 HydrophobicContact CD1-CB 3.63Å; Y54-K181 HydrophobicContact CD1-CG 4.43Å; Y54-K181 HydrophobicContact CE1-CB 3.87Å; Y54-K181 HydrophobicContact CE1-CG 4.22Å; Y54-K181 HydrophobicContact CG-CB 4.3Å; F55-K181 PolarHBondContact N-O 3.34Å; D179-K181 IonicContact OD1-NZ 2.75Å; D179-K181 PolarHBondContact OD1-NZ 3.34Å; D179-K181 WeakPolarHBondContact OD2-CE 3.42Å; D179-K181 IonicContact OD2-NZ 2.74Å; D179-K181 PolarHBondContact OD2-NZ 2.93Å
182	M	95.9	Very high	93.1	Very high	71 Å²	71	61.1 Å²	61.1	35%	0.35	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	132	-179.5	-171.5	-179.6	84.2	0	0	110.9	R204 R205 I220 F222	M182-R204 PolarHBondContact SD-N 3.5Å; M182-R204 VanDerWaalsContact SD-N 3.38Å; M182-R205 HydrophobicContact CB-CB 4.49Å; M182-I220 HydrophobicContact CB-CD1 3.97Å; M182-I220 HydrophobicContact CB-CG1 4.35Å; M182-I220 HydrophobicContact CB-CG2 4.4Å; M182-I220 HydrophobicContact CG-CG2 3.89Å; M182-I220 HydrophobicContact SD-CG2 4.11Å; M182-F222 HydrophobicContact CG-CE1 4.43Å; M182-F222 HydrophobicContact CG-CZ 4.09Å
183	V	95.6	Very high	93.1	Very high	48 Å²	48	58.3 Å²	58.3	29%	0.291	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-100.1	146.1	161.4	-175.7	0	0	0	0	107.3	F55	F55-V183 PolarHBondContact O-N 3.43Å
184	E	94.3	Very high	92.8	Very high	168 Å²	168	59.4 Å²	59.4	79%	0.785	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-63.1	151.5	177.8	-64.9	-178.3	168.2	0	0	111.5
185	A	93.4	Very high	92.7	Very high	28 Å²	28	62.2 Å²	62.2	23%	0.231	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-72.5	128.1	-177.3	0	0	0	0	0	111.5	L57 V201 F222	L57-A185 HydrophobicContact CD2-CB 3.46Å; L57-A185 VanDerWaalsContact CD2-CB 3.46Å; A185-V201 HydrophobicContact CB-CB 3.97Å; A185-V201 HydrophobicContact CB-CG1 3.93Å; A185-V201 WeakPolarHBondContact CB-O 3.37Å; A185-F222 HydrophobicContact CB-CD1 4.09Å; A185-F222 HydrophobicContact CB-CE1 4.02Å
186	D	93.5	Very high	92.8	Very high	50 Å²	50	61.5 Å²	61.5	27%	0.267	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-86	130.9	173	-171.1	1.2	0	0	0	110.4	L57 S58 L59 T188	L57-D186 PolarHBondContact O-N 2.88Å; S58-D186 CarbonylContact C-O 3.59Å; S58-D186 VanDerWaalsContact CA-O 3.3Å; S58-D186 WeakPolarHBondContact CA-O 3.31Å; L59-D186 PolarHBondContact N-O 3.47Å; D186-T188 WeakPolarHBondContact OD1-CB 3.37Å; D186-T188 WeakPolarHBondContact OD1-CG2 3.46Å; D186-T188 PolarHBondContact OD1-N 3.06Å; D186-T188 PolarHBondContact OD1-OG1 3.5Å; D186-T188 PolarHBondContact OD2-OG1 3.03Å
187	V	92.8	Very high	92.8	Very high	69 Å²	69	54.3 Å²	54.3	42%	0.418	32%	0.323	S	S	.	.			trans	-127.2	7.5	176.4	-62.8	0	0	0	0	111.9	G189 Y190 L198 V201	V187-G189 PolarHBondContact O-N 3.38Å; V187-Y190 VanDerWaalsContact O-CB 3.22Å; V187-Y190 WeakPolarHBondContact O-CB 3.32Å; V187-Y190 PolarHBondContact O-N 2.99Å; V187-Y190 VanDerWaalsContact O-N 3.11Å; V187-L198 HydrophobicContact CG1-CD2 4.09Å; V187-V201 HydrophobicContact CG1-CG2 4.1Å
188	T	91.5	Very high	92.9	Very high	129 Å²	129	54.7 Å²	54.7	79%	0.791	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-25.7	-178.4	60.2	0	0	0	0	113.1	D186	D186-T188 WeakPolarHBondContact OD1-CB 3.37Å; D186-T188 WeakPolarHBondContact OD1-CG2 3.46Å; D186-T188 PolarHBondContact OD1-N 3.06Å; D186-T188 PolarHBondContact OD1-OG1 3.5Å; D186-T188 PolarHBondContact OD2-OG1 3.03Å
189	G	90.1	Very high	92.8	Very high	29 Å²	29	58.2 Å²	58.2	30%	0.299	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	6.1	173.9	0	0	0	0	0	115.2	M60 V187 I191	M60-G189 WeakPolarHBondContact CE-O 3.42Å; V187-G189 PolarHBondContact O-N 3.38Å; G189-I191 PolarHBondContact O-N 3.41Å
190	Y	94.9	Very high	92.8	Very high	46 Å²	46	61.6 Å²	61.6	18%	0.18	36%	0.359	C	S	.	.			trans	-69.7	125.6	-171.6	178.2	-108.7	0	0	0	113.2	L59 I62 V187 A192 L198	L59-Y190 HydrophobicContact CD2-CD2 4.47Å; L59-Y190 HydrophobicContact CD2-CE2 4.46Å; L59-Y190 HydrophobicContact CG-CD2 4.14Å; L59-Y190 HydrophobicContact CG-CE2 4.41Å; I62-Y190 HydrophobicContact CG1-CE2 4.27Å; V187-Y190 VanDerWaalsContact O-CB 3.22Å; V187-Y190 WeakPolarHBondContact O-CB 3.32Å; V187-Y190 PolarHBondContact O-N 2.99Å; V187-Y190 VanDerWaalsContact O-N 3.11Å; Y190-A192 HydrophobicContact CE1-CB 4.33Å; Y190-L198 HydrophobicContact CD1-CB 4.27Å; Y190-L198 HydrophobicContact CD1-CD2 3.84Å; Y190-L198 HydrophobicContact CD2-CD2 3.91Å; Y190-L198 HydrophobicContact CE1-CB 3.58Å; Y190-L198 HydrophobicContact CE1-CD2 3.93Å; Y190-L198 HydrophobicContact CE1-CG 4.42Å; Y190-L198 HydrophobicContact CE2-CB 4.41Å; Y190-L198 HydrophobicContact CE2-CD2 4.01Å; Y190-L198 HydrophobicContact CG-CD2 3.83Å
191	I	93.8	Very high	92.8	Very high	102 Å²	102	62.3 Å²	62.3	52%	0.523	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-90.7	114.9	171.5	-57	176.9	0	0	0	108.4	M60 G189	M60-I191 PolarHBondContact O-N 2.71Å; G189-I191 PolarHBondContact O-N 3.41Å
192	A	90.1	Very high	92.8	Very high	73 Å²	73	60.9 Å²	60.9	60%	0.603	36%	0.361	S	S	*	.			trans	-60.5	134.5	180	0	0	0	0	0	112.5	Y190	Y190-A192 HydrophobicContact CE1-CB 4.33Å
193	N	90.1	Very high	92.8	Very high	32 Å²	32	58.6 Å²	58.6	17%	0.171	36%	0.356	C	S	.	.			trans	-85.2	145.7	175.7	-175.5	-48.3	0	0	0	110.2	I62 E195 W196	I62-N193 PolarHBondContact O-ND2 2.68Å; N193-E195 VanDerWaalsContact C-N 3.33Å; N193-E195 PolarHBondContact OD1-N 2.96Å; N193-W196 HydrophobicContact CB-CB 4.35Å; N193-W196 PolarHBondContact OD1-N 3.29Å
194	G	87.4	Confident	92.8	Very high	74 Å²	74	64 Å²	64	76%	0.763	37%	0.371	S	S	*	.	S	Bend	trans	-74.9	-17.2	-179.1	0	0	0	0	0	115	R229	G194-R229 WeakPolarHBondContact O-CD 3.5Å
195	E	88.6	Confident	92.9	Very high	68 Å²	68	59.8 Å²	59.8	32%	0.318	35%	0.348	S	S	.	.	S	Bend	trans	-106.7	-36	176	-170.7	-171.6	163.1	0	0	112.4	N193 R228 R229 Y233	N193-E195 VanDerWaalsContact C-N 3.33Å; N193-E195 PolarHBondContact OD1-N 2.96Å; E195-R228 HydrophobicContact CG-CG 4.45Å; E195-R228 IonicContact OE1-CZ 3.81Å; E195-R228 IonicContact OE1-NH1 2.91Å; E195-R228 PolarHBondContact OE1-NH1 3.17Å; E195-R229 VanDerWaalsContact O-CB 3.27Å; E195-R229 WeakPolarHBondContact O-CB 3.5Å; E195-R229 WeakPolarHBondContact O-CG 3.26Å; E195-R229 PolarHBondContact O-N 2.92Å; E195-Y233 PolarHBondContact OE1-OH 2.9Å
196	W	91.9	Very high	92.9	Very high	3 Å²	3	61 Å²	61	1%	0.011	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123.1	-172.4	-67.8	93.6	0	0	0	112.8	V65 Q162 N193 M226 R228	V65-W196 HydrophobicContact CB-CZ2 4.32Å; V65-W196 HydrophobicContact CG1-CZ2 3.98Å; V65-W196 HydrophobicContact CG2-CD2 4.46Å; V65-W196 HydrophobicContact CG2-CG 4.39Å; Q162-W196 HydrophobicContact CB-CZ3 4.37Å; Q162-W196 HydrophobicContact CG-CH2 3.68Å; Q162-W196 HydrophobicContact CG-CZ3 3.81Å; N193-W196 HydrophobicContact CB-CB 4.35Å; N193-W196 PolarHBondContact OD1-N 3.29Å; W196-M226 HydrophobicContact CD2-CE 4.27Å; W196-M226 HydrophobicContact CD2-CG 4.43Å; W196-M226 HydrophobicContact CD2-SD 4.2Å; W196-M226 HydrophobicContact CE3-CB 4.1Å; W196-M226 HydrophobicContact CE3-CE 4.1Å; W196-M226 HydrophobicContact CE3-CG 3.67Å; W196-M226 HydrophobicContact CE3-SD 4.02Å; W196-M226 HydrophobicContact CH2-CE 4.23Å; W196-M226 HydrophobicContact CZ2-CE 4.39Å; W196-M226 HydrophobicContact CZ3-CE 4.09Å; W196-M226 HydrophobicContact CZ3-CG 4Å; W196-R228 HydrophobicContact CE3-CB 4.28Å; W196-R228 HydrophobicContact CH2-CB 4.22Å; W196-R228 VanDerWaalsContact CZ2-CZ 3.41Å; W196-R228 HydrophobicContact CZ3-CB 3.96Å
197	D	92	Very high	92.9	Very high	19 Å²	19	63.7 Å²	63.7	10%	0.102	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	121.8	166.7	-92.4	-3.7	0	0	0	110.5	M226 R227 R229 K506	D197-M226 CarbonylContact O-C 3.6Å; D197-M226 VanDerWaalsContact O-CA 3.27Å; D197-M226 WeakPolarHBondContact O-CA 3.47Å; D197-R227 HydrophobicContact CB-CB 4.39Å; D197-R227 PolarHBondContact N-O 3.03Å; D197-R227 PolarHBondContact O-N 3.32Å; D197-R229 IonicContact OD1-CZ 2.73Å; D197-R229 IonicContact OD1-NE 2.99Å; D197-R229 PolarHBondContact OD1-NE 3.29Å; D197-R229 IonicContact OD1-NH2 3.95Å; D197-R229 PolarHBondContact OD1-NH2 3.43Å; D197-R229 IonicContact OD2-NH2 3.93Å; D197-K506 IonicContact OD2-NZ 2.69Å; D197-K506 PolarHBondContact OD2-NZ 3.42Å
198	L	94	Very high	92.8	Very high	37 Å²	37	66.8 Å²	66.8	19%	0.194	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	129.6	165	-176.1	65.1	0	0	0	109.7	L59 I62 V187 Y190 V201 V224	L59-L198 HydrophobicContact CD2-CD1 3.92Å; L59-L198 HydrophobicContact CD2-CD2 3.98Å; I62-L198 HydrophobicContact CD1-CD1 4.35Å; V187-L198 HydrophobicContact CG1-CD2 4.09Å; Y190-L198 HydrophobicContact CD1-CB 4.27Å; Y190-L198 HydrophobicContact CD1-CD2 3.84Å; Y190-L198 HydrophobicContact CD2-CD2 3.91Å; Y190-L198 HydrophobicContact CE1-CB 3.58Å; Y190-L198 HydrophobicContact CE1-CD2 3.93Å; Y190-L198 HydrophobicContact CE1-CG 4.42Å; Y190-L198 HydrophobicContact CE2-CB 4.41Å; Y190-L198 HydrophobicContact CE2-CD2 4.01Å; Y190-L198 HydrophobicContact CG-CD2 3.83Å; L198-V201 HydrophobicContact CD1-CG2 3.82Å; L198-V201 HydrophobicContact CD2-CG2 4.33Å; L198-V224 HydrophobicContact CD1-CG1 3.94Å
199	V	92.6	Very high	92.9	Very high	74 Å²	74	67.4 Å²	67.4	45%	0.448	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-54.7	178.2	-175.5	0	0	0	0	110.5	V225 R227	V199-V225 HydrophobicContact CB-CB 4.4Å; V199-V225 HydrophobicContact CB-CG1 4.12Å; V199-V225 WeakPolarHBondContact CB-O 3.27Å; V199-V225 PolarHBondContact N-O 3.32Å; V199-R227 HydrophobicContact CG2-CB 3.97Å
200	E	94.1	Very high	92.8	Very high	100 Å²	100	70.2 Å²	70.2	47%	0.467	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	160.6	-178.6	56.5	175.1	-175	0	0	110.9	P202 V225	E200-P202 VanDerWaalsContact C-CD 3.49Å; E200-P202 HydrophobicContact CG-CG 4.39Å; E200-V225 HydrophobicContact CG-CB 3.63Å; E200-V225 HydrophobicContact CG-CG1 4.22Å; E200-V225 HydrophobicContact CG-CG2 3.66Å; E200-V225 PolarHBondContact N-O 3.3Å; E200-V225 PolarHBondContact O-N 3.39Å
201	V	96.1	Very high	92.5	Very high	16 Å²	16	78.3 Å²	78.3	10%	0.097	40%	0.399	C	S	.	.			trans	-130.2	66.7	172.1	-168.4	0	0	0	0	110.7	L57 L59 A185 V187 L198 G203 F222 T223 V224	L57-V201 HydrophobicContact CD2-CG1 4.36Å; L59-V201 HydrophobicContact CD2-CG2 3.87Å; A185-V201 HydrophobicContact CB-CB 3.97Å; A185-V201 HydrophobicContact CB-CG1 3.93Å; A185-V201 WeakPolarHBondContact CB-O 3.37Å; V187-V201 HydrophobicContact CG1-CG2 4.1Å; L198-V201 HydrophobicContact CD1-CG2 3.82Å; L198-V201 HydrophobicContact CD2-CG2 4.33Å; V201-G203 PolarHBondContact O-N 3.23Å; V201-F222 HydrophobicContact CG1-CB 4.18Å; V201-F222 HydrophobicContact CG1-CD1 4.43Å; V201-T223 WeakPolarHBondContact CA-O 3.42Å; V201-V224 HydrophobicContact CG1-CG2 4.31Å
202	P	96.8	Very high	92.2	Very high	42 Å²	42	78.2 Å²	78.2	27%	0.273	41%	0.407	S	S	.	.			trans	-62.9	127.6	176.7	24.6	-35	0	0	0	112.1	E200 T223 V225	E200-P202 VanDerWaalsContact C-CD 3.49Å; E200-P202 HydrophobicContact CG-CG 4.39Å; P202-T223 VanDerWaalsContact CD-O 3.29Å; P202-T223 WeakPolarHBondContact CD-O 3.38Å; P202-T223 PolarHBondContact O-N 3.37Å; P202-V225 HydrophobicContact CG-CG2 4.39Å
203	G	95.8	Very high	92	Very high	24 Å²	24	76.2 Å²	76.2	25%	0.247	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	148.2	170.5	0	0	0	0	0	112.7	V201 T221 F222	V201-G203 PolarHBondContact O-N 3.23Å; G203-T221 CarbonylContact C-O 3.6Å; G203-T221 WeakPolarHBondContact CA-O 3.28Å; G203-F222 VanDerWaalsContact CA-CD1 3.41Å
204	R	96.1	Very high	91.8	Very high	161 Å²	161	81.6 Å²	81.6	61%	0.608	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.9	127.2	171.9	-63.2	-178.6	-177.8	164.7	3.4	110.5	M182 I220 T221	M182-R204 PolarHBondContact SD-N 3.5Å; M182-R204 VanDerWaalsContact SD-N 3.38Å; R204-I220 WeakPolarHBondContact O-CA 3.31Å; R204-T221 PolarHBondContact N-O 3.24Å; R204-T221 PolarHBondContact O-N 3.38Å
205	R	95.4	Very high	92	Very high	80 Å²	80	81.1 Å²	81.1	30%	0.302	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	125.1	167.4	-177.1	-174.5	178.9	-80.8	5.3	109.5	D179 L180 M182 E207 D219 I220	D179-R205 IonicContact OD1-CZ 3.81Å; D179-R205 IonicContact OD1-NE 3.83Å; D179-R205 IonicContact OD1-NH2 3.35Å; D179-R205 PolarHBondContact OD1-NH2 2.98Å; L180-R205 WeakPolarHBondContact O-CD 3.43Å; L180-R205 PolarHBondContact O-NE 3.47Å; M182-R205 HydrophobicContact CB-CB 4.49Å; R205-E207 IonicContact CZ-OE1 3.74Å; R205-E207 IonicContact NH1-OE1 3.84Å; R205-E207 PolarHBondContact NH1-OE1 2.9Å; R205-E207 IonicContact NH2-OE1 2.77Å; R205-E207 PolarHBondContact NH2-OE1 2.79Å; R205-D219 CarbonylContact C-O 3.57Å; R205-D219 WeakPolarHBondContact CA-O 3.28Å; R205-I220 HydrophobicContact CB-CG1 4.27Å; R205-I220 HydrophobicContact CG-CG1 4.27Å
206	N	94.3	Very high	92.2	Very high	53 Å²	53	78.8 Å²	78.8	28%	0.283	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	165.2	171.5	-39.6	-75	0	0	0	110	D219 T221	N206-D219 WeakPolarHBondContact CB-OD2 3.11Å; N206-D219 PolarHBondContact N-O 3.32Å; N206-D219 PolarHBondContact ND2-OD2 2.82Å; N206-D219 PolarHBondContact O-N 3Å; N206-T221 PolarHBondContact ND2-OG1 3.41Å
207	E	93.1	Very high	92.3	Very high	106 Å²	106	80.5 Å²	80.5	50%	0.495	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.4	163.8	-71.5	173.9	179.8	0	0	107.2	R205 P218	R205-E207 IonicContact CZ-OE1 3.74Å; R205-E207 IonicContact NH1-OE1 3.84Å; R205-E207 PolarHBondContact NH1-OE1 2.9Å; R205-E207 IonicContact NH2-OE1 2.77Å; R205-E207 PolarHBondContact NH2-OE1 2.79Å; E207-P218 HydrophobicContact CG-CB 4.39Å
208	R	90.4	Very high	92.4	Very high	135 Å²	135	79.8 Å²	79.8	51%	0.509	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	134.8	177.8	-64.6	-167.7	-176	-144.3	-1.3	110.8	Y210 Y217 D219	R208-Y210 HydrophobicContact CB-CE2 4.22Å; R208-Y217 PolarHBondContact N-O 2.99Å; R208-Y217 PolarHBondContact O-N 3.39Å; R208-D219 IonicContact NE-OD1 3.7Å
209	F	92.8	Very high	92.5	Very high	142 Å²	142	78 Å²	78	62%	0.623	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	136.9	162.3	-62.6	-92.5	0	0	0	107.9	D214 P216	F209-D214 WeakPolarHBondContact CD1-O 3.4Å; F209-D214 WeakPolarHBondContact CE1-O 3.26Å; F209-P216 HydrophobicContact CD1-CB 4.35Å; F209-P216 HydrophobicContact CE1-CB 3.82Å; F209-P216 HydrophobicContact CE1-CG 4.18Å; F209-P216 HydrophobicContact CE2-CB 4.14Å; F209-P216 HydrophobicContact CZ-CB 3.71Å; F209-P216 HydrophobicContact CZ-CG 4.19Å
210	Y	88.6	Confident	92.7	Very high	88 Å²	88	74.5 Å²	74.5	35%	0.345	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	147.1	178.8	-76.8	-82.8	0	0	0	109.1	Y115 K167 R208 C212 C213 Y217	Y115-Y210 WeakPolarHBondContact CE2-OH 3.29Å; K167-Y210 PolarHBondContact NZ-OH 2.95Å; R208-Y210 HydrophobicContact CB-CE2 4.22Å; Y210-C212 PolarHBondContact O-N 3Å; Y210-C213 PolarHBondContact O-N 3.27Å; Y210-Y217 AromaticContact CD2-CD2 3.97Å; Y210-Y217 HydrophobicContact CD2-CD2 3.97Å; Y210-Y217 HydrophobicContact CD2-CG 4.03Å; Y210-Y217 HydrophobicContact CE2-CG 4.22Å
211	E	89.2	Confident	92.8	Very high	215 Å²	215	70.5 Å²	70.5	100%	1.005	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-8.6	-175.1	-60.3	-177.3	166.3	0	0	114.8
212	C	87.1	Confident	92.9	Very high	100 Å²	100	69.7 Å²	69.7	68%	0.676	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-25.2	174.4	64.8	0	0	0	0	114.9	Y210	Y210-C212 PolarHBondContact O-N 3Å
213	C	84.9	Confident	92.9	Very high	32 Å²	32	68.3 Å²	68.3	22%	0.216	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	131.1	-146.3	-51.7	0	0	0	0	111.2	Y210 E215 Y217	Y210-C213 PolarHBondContact O-N 3.27Å; C213-E215 VanDerWaalsContact C-N 3.27Å; C213-E215 PolarHBondContact O-N 2.89Å; C213-Y217 HydrophobicContact CB-CE2 3.99Å
214	D	87.6	Confident	92.9	Very high	144 Å²	144	67.2 Å²	67.2	77%	0.77	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	-15.9	179.2	-71.6	-45.1	0	0	0	112.4	F209	F209-D214 WeakPolarHBondContact CD1-O 3.4Å; F209-D214 WeakPolarHBondContact CE1-O 3.26Å
215	E	90.3	Very high	92.9	Very high	65 Å²	65	59.7 Å²	59.7	30%	0.304	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	139.3	178.8	-60.7	83.6	173.8	0	0	112.8	W176 C213 Y217	W176-E215 HydrophobicContact CD2-CG 3.86Å; W176-E215 HydrophobicContact CE3-CG 3.62Å; W176-E215 HydrophobicContact CH2-CG 4.04Å; W176-E215 HydrophobicContact CZ2-CG 4.27Å; W176-E215 HydrophobicContact CZ3-CG 3.72Å; C213-E215 VanDerWaalsContact C-N 3.27Å; C213-E215 PolarHBondContact O-N 2.89Å; E215-Y217 WeakPolarHBondContact O-CD2 3.42Å; E215-Y217 PolarHBondContact O-N 2.96Å
216	P	93.6	Very high	92.8	Very high	19 Å²	19	55.9 Å²	55.9	12%	0.123	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	129.1	168	29.2	-31.1	0	0	0	109.9	G175 F209 P218	G175-P216 WeakPolarHBondContact CA-O 3.42Å; G175-P216 PolarHBondContact N-O 3.22Å; F209-P216 HydrophobicContact CD1-CB 4.35Å; F209-P216 HydrophobicContact CE1-CB 3.82Å; F209-P216 HydrophobicContact CE1-CG 4.18Å; F209-P216 HydrophobicContact CE2-CB 4.14Å; F209-P216 HydrophobicContact CZ-CB 3.71Å; F209-P216 HydrophobicContact CZ-CG 4.19Å; P216-P218 WeakPolarHBondContact O-CD 3.33Å
217	Y	93.7	Very high	92.7	Very high	39 Å²	39	55.3 Å²	55.3	15%	0.153	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	115.8	169.3	-79.3	-103.8	0	0	0	109.1	R208 Y210 C213 E215	R208-Y217 PolarHBondContact N-O 2.99Å; R208-Y217 PolarHBondContact O-N 3.39Å; Y210-Y217 AromaticContact CD2-CD2 3.97Å; Y210-Y217 HydrophobicContact CD2-CD2 3.97Å; Y210-Y217 HydrophobicContact CD2-CG 4.03Å; Y210-Y217 HydrophobicContact CE2-CG 4.22Å; C213-Y217 HydrophobicContact CB-CE2 3.99Å; E215-Y217 WeakPolarHBondContact O-CD2 3.42Å; E215-Y217 PolarHBondContact O-N 2.96Å
218	P	94.7	Very high	92.5	Very high	4 Å²	4	50.5 Å²	50.5	3%	0.026	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	136.6	174	31.5	-32.7	0	0	0	109.8	L180 E207 P216	L180-P218 HydrophobicContact CB-CB 4.38Å; E207-P218 HydrophobicContact CG-CB 4.39Å; P216-P218 WeakPolarHBondContact O-CD 3.33Å
219	D	95.4	Very high	92.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	154.4	175.8	69.3	-125.7	0	0	0	111.4	K167 F168 R205 N206 R208	K167-D219 WeakPolarHBondContact CE-OD1 3.44Å; K167-D219 VanDerWaalsContact CE-OD2 3.28Å; K167-D219 WeakPolarHBondContact CE-OD2 3.3Å; K167-D219 VanDerWaalsContact NZ-CG 3.31Å; K167-D219 IonicContact NZ-OD1 2.72Å; K167-D219 PolarHBondContact NZ-OD1 3.38Å; K167-D219 IonicContact NZ-OD2 3.66Å; F168-D219 WeakPolarHBondContact O-CA 3.46Å; R205-D219 CarbonylContact C-O 3.57Å; R205-D219 WeakPolarHBondContact CA-O 3.28Å; N206-D219 WeakPolarHBondContact CB-OD2 3.11Å; N206-D219 PolarHBondContact N-O 3.32Å; N206-D219 PolarHBondContact ND2-OD2 2.82Å; N206-D219 PolarHBondContact O-N 3Å; R208-D219 IonicContact NE-OD1 3.7Å
220	I	96.7	Very high	92.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	114.7	177.4	-64.3	168.5	0	0	0	107.8	F55 F168 L180 M182 R204 R205 F222	F55-I220 HydrophobicContact CB-CD1 3.97Å; F55-I220 HydrophobicContact CD1-CB 4.15Å; F55-I220 HydrophobicContact CD1-CD1 3.83Å; F55-I220 HydrophobicContact CD1-CG2 4.2Å; F55-I220 HydrophobicContact CE1-CG2 4.49Å; F55-I220 HydrophobicContact CG-CD1 4.36Å; F168-I220 PolarHBondContact N-O 2.88Å; F168-I220 PolarHBondContact O-N 2.65Å; L180-I220 HydrophobicContact CB-CD1 3.94Å; L180-I220 HydrophobicContact CB-CG1 4.49Å; M182-I220 HydrophobicContact CB-CD1 3.97Å; M182-I220 HydrophobicContact CB-CG1 4.35Å; M182-I220 HydrophobicContact CB-CG2 4.4Å; M182-I220 HydrophobicContact CG-CG2 3.89Å; M182-I220 HydrophobicContact SD-CG2 4.11Å; R204-I220 WeakPolarHBondContact O-CA 3.31Å; R205-I220 HydrophobicContact CB-CG1 4.27Å; R205-I220 HydrophobicContact CG-CG1 4.27Å; I220-F222 HydrophobicContact CG2-CD2 3.9Å; I220-F222 HydrophobicContact CG2-CE2 3.41Å; I220-F222 VanDerWaalsContact CG2-CE2 3.41Å; I220-F222 HydrophobicContact CG2-CZ 3.85Å
221	T	97	Very high	91.9	Very high	15 Å²	15	41.5 Å²	41.5	9%	0.092	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	124.5	174.4	-56.2	0	0	0	0	109.5	D165 L166 G203 R204 N206	D165-T221 HydrophobicContact CB-CG2 3.67Å; L166-T221 WeakPolarHBondContact O-CA 3.49Å; G203-T221 CarbonylContact C-O 3.6Å; G203-T221 WeakPolarHBondContact CA-O 3.28Å; R204-T221 PolarHBondContact N-O 3.24Å; R204-T221 PolarHBondContact O-N 3.38Å; N206-T221 PolarHBondContact ND2-OG1 3.41Å
222	F	97.3	Very high	91.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118	167.1	-71	-81.6	0	0	0	109.4	F55 L57 L166 F168 M182 A185 V201 G203 I220	F55-F222 HydrophobicContact CD1-CE2 4.09Å; F55-F222 HydrophobicContact CE1-CD2 4.4Å; F55-F222 AromaticContact CE1-CE2 3.79Å; F55-F222 HydrophobicContact CE1-CE2 3.79Å; L57-F222 HydrophobicContact CD2-CB 4.19Å; L57-F222 HydrophobicContact CD2-CD1 3.47Å; L57-F222 VanDerWaalsContact CD2-CD1 3.47Å; L57-F222 HydrophobicContact CD2-CD2 3.75Å; L57-F222 HydrophobicContact CD2-CE1 3.62Å; L57-F222 HydrophobicContact CD2-CE2 3.87Å; L57-F222 HydrophobicContact CD2-CG 3.54Å; L57-F222 HydrophobicContact CD2-CZ 3.81Å; L166-F222 PolarHBondContact N-O 3.41Å; L166-F222 PolarHBondContact O-N 3.38Å; F168-F222 HydrophobicContact CD2-CD2 4.44Å; M182-F222 HydrophobicContact CG-CE1 4.43Å; M182-F222 HydrophobicContact CG-CZ 4.09Å; A185-F222 HydrophobicContact CB-CD1 4.09Å; A185-F222 HydrophobicContact CB-CE1 4.02Å; V201-F222 HydrophobicContact CG1-CB 4.18Å; V201-F222 HydrophobicContact CG1-CD1 4.43Å; G203-F222 VanDerWaalsContact CA-CD1 3.41Å; I220-F222 HydrophobicContact CG2-CD2 3.9Å; I220-F222 HydrophobicContact CG2-CE2 3.41Å; I220-F222 VanDerWaalsContact CG2-CE2 3.41Å; I220-F222 HydrophobicContact CG2-CZ 3.85Å
223	T	96.8	Very high	91.6	Very high	13 Å²	13	35.7 Å²	35.7	8%	0.08	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	110.7	176.4	-50.2	0	0	0	0	109	R163 C164 D165 V201 P202 V225	R163-T223 HydrophobicContact CB-CG2 3.89Å; R163-T223 HydrophobicContact CG-CG2 4.4Å; C164-T223 CarbonylContact O-C 3.51Å; C164-T223 WeakPolarHBondContact O-CA 3.45Å; D165-T223 VanDerWaalsContact OD1-CB 3.29Å; D165-T223 WeakPolarHBondContact OD1-CB 3.49Å; D165-T223 WeakPolarHBondContact OD1-CG2 3.47Å; D165-T223 PolarHBondContact OD1-OG1 3.31Å; V201-T223 WeakPolarHBondContact CA-O 3.42Å; P202-T223 VanDerWaalsContact CD-O 3.29Å; P202-T223 WeakPolarHBondContact CD-O 3.38Å; P202-T223 PolarHBondContact O-N 3.37Å; T223-V225 HydrophobicContact CG2-CG2 4.06Å; T223-V225 PolarHBondContact O-N 3.13Å
224	V	96.4	Very high	91.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	113.9	169.4	-178.4	0	0	0	0	108.1	L59 I62 L72 R163 C164 L166 L198 V201	L59-V224 HydrophobicContact CD2-CG1 4.26Å; L59-V224 HydrophobicContact CD2-CG2 4.42Å; I62-V224 HydrophobicContact CD1-CG1 4.2Å; L72-V224 HydrophobicContact CD2-CB 4.42Å; R163-V224 WeakPolarHBondContact CA-O 3.09Å; C164-V224 PolarHBondContact N-O 3.27Å; C164-V224 PolarHBondContact O-N 3.03Å; L166-V224 HydrophobicContact CD1-CG2 3.77Å; L166-V224 HydrophobicContact CG-CG2 4.31Å; L198-V224 HydrophobicContact CD1-CG1 3.94Å; V201-V224 HydrophobicContact CG1-CG2 4.31Å
225	V	95.3	Very high	91.3	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.018	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	117.6	177	-173.3	0	0	0	0	108.7	V161 R163 V199 E200 P202 T223	V161-V225 HydrophobicContact CG1-CG1 3.99Å; R163-V225 HydrophobicContact CG-CG1 4.26Å; R163-V225 HydrophobicContact CG-CG2 4.18Å; V199-V225 HydrophobicContact CB-CB 4.4Å; V199-V225 HydrophobicContact CB-CG1 4.12Å; V199-V225 WeakPolarHBondContact CB-O 3.27Å; V199-V225 PolarHBondContact N-O 3.32Å; E200-V225 HydrophobicContact CG-CB 3.63Å; E200-V225 HydrophobicContact CG-CG1 4.22Å; E200-V225 HydrophobicContact CG-CG2 3.66Å; E200-V225 PolarHBondContact N-O 3.3Å; E200-V225 PolarHBondContact O-N 3.39Å; P202-V225 HydrophobicContact CG-CG2 4.39Å; T223-V225 HydrophobicContact CG2-CG2 4.06Å; T223-V225 PolarHBondContact O-N 3.13Å
226	M	93.3	Very high	91	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	149.9	-174.6	64.4	-172.6	-168.5	0	0	112	I62 V65 L72 V161 Q162 W196 D197	I62-M226 HydrophobicContact CD1-CB 4.28Å; I62-M226 HydrophobicContact CD1-SD 4.03Å; V65-M226 HydrophobicContact CB-CE 4.35Å; V65-M226 HydrophobicContact CG1-CE 3.61Å; V65-M226 HydrophobicContact CG2-CE 3.72Å; V65-M226 HydrophobicContact CG2-SD 4.18Å; L72-M226 HydrophobicContact CD1-CE 4.45Å; L72-M226 HydrophobicContact CD1-SD 4.4Å; V161-M226 CarbonylContact C-O 3.58Å; V161-M226 WeakPolarHBondContact CA-O 3.36Å; Q162-M226 HydrophobicContact CB-CE 3.93Å; Q162-M226 HydrophobicContact CB-CG 4.14Å; Q162-M226 HydrophobicContact CG-CE 4.43Å; Q162-M226 PolarHBondContact N-O 2.81Å; Q162-M226 PolarHBondContact O-N 2.92Å; W196-M226 HydrophobicContact CD2-CE 4.27Å; W196-M226 HydrophobicContact CD2-CG 4.43Å; W196-M226 HydrophobicContact CD2-SD 4.2Å; W196-M226 HydrophobicContact CE3-CB 4.1Å; W196-M226 HydrophobicContact CE3-CE 4.1Å; W196-M226 HydrophobicContact CE3-CG 3.67Å; W196-M226 HydrophobicContact CE3-SD 4.02Å; W196-M226 HydrophobicContact CH2-CE 4.23Å; W196-M226 HydrophobicContact CZ2-CE 4.39Å; W196-M226 HydrophobicContact CZ3-CE 4.09Å; W196-M226 HydrophobicContact CZ3-CG 4Å; D197-M226 CarbonylContact O-C 3.6Å; D197-M226 VanDerWaalsContact O-CA 3.27Å; D197-M226 WeakPolarHBondContact O-CA 3.47Å
227	R	91.9	Very high	90.5	Very high	41 Å²	41	32.9 Å²	32.9	16%	0.155	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	136.8	-176.3	179.4	-174	-63.9	-173.9	-3.2	109.5	V161 D197 V199 E502	V161-R227 HydrophobicContact CG2-CB 4.18Å; V161-R227 HydrophobicContact CG2-CG 4.03Å; D197-R227 HydrophobicContact CB-CB 4.39Å; D197-R227 PolarHBondContact N-O 3.03Å; D197-R227 PolarHBondContact O-N 3.32Å; V199-R227 HydrophobicContact CG2-CB 3.97Å; R227-E502 IonicContact CZ-OE1 2.64Å; R227-E502 IonicContact NH1-OE1 3.16Å; R227-E502 PolarHBondContact NH1-OE1 2.89Å; R227-E502 IonicContact NH2-OE1 3.93Å; R227-E502 PolarHBondContact NH2-OE1 2.92Å; R227-E502 IonicContact NH2-OE2 2.7Å
228	R	90.5	Very high	89.9	Confident	5 Å²	5	33.6 Å²	33.6	2%	0.019	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	142.1	177.3	-162.2	-177.8	-57.6	-96.5	3.2	111.4	E67 D160 E195 W196 Y233	E67-R228 IonicContact OE1-CZ 2.65Å; E67-R228 IonicContact OE1-NH1 3.77Å; E67-R228 PolarHBondContact OE1-NH1 3.16Å; E67-R228 IonicContact OE1-NH2 3.1Å; E67-R228 PolarHBondContact OE1-NH2 2.76Å; D160-R228 PolarHBondContact O-N 2.94Å; D160-R228 IonicContact OD1-CZ 2.67Å; D160-R228 IonicContact OD1-NE 2.68Å; D160-R228 PolarHBondContact OD1-NE 2.74Å; D160-R228 IonicContact OD1-NH2 2.99Å; D160-R228 IonicContact OD2-CZ 3.28Å; D160-R228 IonicContact OD2-NE 3.15Å; D160-R228 PolarHBondContact OD2-NE 3.28Å; D160-R228 IonicContact OD2-NH2 3.89Å; D160-R228 PolarHBondContact OD2-NH2 3.44Å; D160-R228 VanDerWaalsContact OD2-NH2 3.13Å; E195-R228 HydrophobicContact CG-CG 4.45Å; E195-R228 IonicContact OE1-CZ 3.81Å; E195-R228 IonicContact OE1-NH1 2.91Å; E195-R228 PolarHBondContact OE1-NH1 3.17Å; W196-R228 HydrophobicContact CE3-CB 4.28Å; W196-R228 HydrophobicContact CH2-CB 4.22Å; W196-R228 VanDerWaalsContact CZ2-CZ 3.41Å; W196-R228 HydrophobicContact CZ3-CB 3.96Å; R228-Y233 HydrophobicContact CG-CE2 4.26Å
229	R	89.3	Confident	89.5	Confident	99 Å²	99	36.6 Å²	36.6	37%	0.374	18%	0.179	S	C	.	.			trans	-80.5	121.1	170	-70.5	169.7	163.4	-88.2	-7	109.2	G194 E195 D197	G194-R229 WeakPolarHBondContact O-CD 3.5Å; E195-R229 VanDerWaalsContact O-CB 3.27Å; E195-R229 WeakPolarHBondContact O-CB 3.5Å; E195-R229 WeakPolarHBondContact O-CG 3.26Å; E195-R229 PolarHBondContact O-N 2.92Å; D197-R229 IonicContact OD1-CZ 2.73Å; D197-R229 IonicContact OD1-NE 2.99Å; D197-R229 PolarHBondContact OD1-NE 3.29Å; D197-R229 IonicContact OD1-NH2 3.95Å; D197-R229 PolarHBondContact OD1-NH2 3.43Å; D197-R229 IonicContact OD2-NH2 3.93Å
230	T	86.1	Confident	89	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.031	19%	0.19	C	C	.	.			trans	-94.3	-21.4	-160.6	73.6	0	0	0	0	113.5	P158 F159 Y232 Y233 G234 A503 D507	P158-T230 WeakPolarHBondContact O-CG2 3.43Å; F159-T230 HydrophobicContact CD1-CG2 3.78Å; F159-T230 HydrophobicContact CE1-CG2 4.09Å; T230-Y232 PolarHBondContact O-N 2.96Å; T230-Y233 PolarHBondContact O-N 3.32Å; T230-Y233 VanDerWaalsContact O-N 3.11Å; T230-G234 PolarHBondContact O-N 3.22Å; T230-A503 HydrophobicContact CG2-CB 4.06Å; T230-D507 WeakPolarHBondContact CA-OD2 3.24Å; T230-D507 WeakPolarHBondContact CB-OD2 3.47Å; T230-D507 PolarHBondContact N-OD2 3.4Å; T230-D507 PolarHBondContact OG1-OD2 2.86Å
231	L	83.9	Confident	88.3	Confident	73 Å²	73	38.3 Å²	38.3	38%	0.382	19%	0.19	S	C	.	.	H	α-helix	trans	-54.2	-41.5	-172.1	-173.6	149.7	0	0	0	114.3	G234 L235 D507	L231-G234 PolarHBondContact O-N 2.96Å; L231-L235 HydrophobicContact CD2-CD1 3.69Å; L231-L235 HydrophobicContact CD2-CG 4.39Å; L231-L235 HydrophobicContact CG-CD1 4.37Å; L231-L235 WeakPolarHBondContact O-CG 3.36Å; L231-L235 PolarHBondContact O-N 3.26Å; L231-D507 PolarHBondContact N-OD2 3.33Å
232	Y	85.9	Confident	87.7	Confident	153 Å²	153	40.8 Å²	40.8	60%	0.6	21%	0.205	S	C	*	.	H	α-helix	trans	-60.9	-48.2	178	177.6	-89.9	0	0	0	111.8	T230 L235 N236	T230-Y232 PolarHBondContact O-N 2.96Å; Y232-L235 PolarHBondContact O-N 3.02Å; Y232-N236 VanDerWaalsContact CD2-ND2 3.34Å; Y232-N236 WeakPolarHBondContact CD2-ND2 3.46Å; Y232-N236 WeakPolarHBondContact CE2-ND2 3.27Å; Y232-N236 VanDerWaalsContact CZ-ND2 3.31Å; Y232-N236 WeakPolarHBondContact O-CB 3.38Å; Y232-N236 PolarHBondContact O-N 3.5Å; Y232-N236 PolarHBondContact O-ND2 3.13Å; Y232-N236 VanDerWaalsContact O-ND2 3.17Å
233	Y	84	Confident	87.2	Confident	39 Å²	39	45.5 Å²	45.5	15%	0.153	23%	0.23	C	C	.	.	H	α-helix	trans	-70.9	-35.1	179.1	-57.9	-80.9	0	0	0	111.7	F157 P158 E195 R228 T230 L237 L238	F157-Y233 HydrophobicContact CE1-CD1 4.29Å; F157-Y233 HydrophobicContact CE2-CE1 4.33Å; F157-Y233 AromaticContact CZ-CD1 3.77Å; F157-Y233 HydrophobicContact CZ-CD1 3.77Å; F157-Y233 AromaticContact CZ-CE1 3.63Å; F157-Y233 HydrophobicContact CZ-CE1 3.63Å; F157-Y233 HydrophobicContact CZ-CG 4.38Å; P158-Y233 HydrophobicContact CB-CD2 3.95Å; P158-Y233 HydrophobicContact CB-CG 3.93Å; P158-Y233 HydrophobicContact CG-CG 4.5Å; E195-Y233 PolarHBondContact OE1-OH 2.9Å; R228-Y233 HydrophobicContact CG-CE2 4.26Å; T230-Y233 PolarHBondContact O-N 3.32Å; T230-Y233 VanDerWaalsContact O-N 3.11Å; Y233-L237 HydrophobicContact CD1-CD1 4.01Å; Y233-L237 WeakPolarHBondContact O-CA 3.4Å; Y233-L237 WeakPolarHBondContact O-CB 3.46Å; Y233-L237 PolarHBondContact O-N 2.89Å; Y233-L238 PolarHBondContact O-N 2.65Å
234	G	81.9	Confident	86.7	Confident	21 Å²	21	45.6 Å²	45.6	22%	0.216	23%	0.23	C	C	.	.	I	π-helix	trans	-58.9	-49.7	172.5	0	0	0	0	0	112.4	T230 L231 L238 V239	T230-G234 PolarHBondContact O-N 3.22Å; L231-G234 PolarHBondContact O-N 2.96Å; G234-L238 VanDerWaalsContact O-CB 3.31Å; G234-L238 WeakPolarHBondContact O-CB 3.46Å; G234-L238 PolarHBondContact O-N 3.1Å; G234-V239 PolarHBondContact O-N 3.17Å
235	L	83.7	Confident	86.1	Confident	92 Å²	92	46.1 Å²	46.1	48%	0.482	23%	0.234	S	C	.	.	I	π-helix	trans	-70.5	-42.1	179.5	-67.3	179.2	0	0	0	112.8	L231 Y232 V239	L231-L235 HydrophobicContact CD2-CD1 3.69Å; L231-L235 HydrophobicContact CD2-CG 4.39Å; L231-L235 HydrophobicContact CG-CD1 4.37Å; L231-L235 WeakPolarHBondContact O-CG 3.36Å; L231-L235 PolarHBondContact O-N 3.26Å; Y232-L235 PolarHBondContact O-N 3.02Å; L235-V239 HydrophobicContact CD2-CG2 4.37Å; L235-V239 WeakPolarHBondContact O-CB 3.31Å
236	N	83.9	Confident	85.7	Confident	75 Å²	75	49.7 Å²	49.7	40%	0.401	26%	0.255	S	S	.	.	I	π-helix	trans	-89	-24.3	-172.3	-65.6	-40.5	0	0	0	114.6	Y232 P240 F275	Y232-N236 VanDerWaalsContact CD2-ND2 3.34Å; Y232-N236 WeakPolarHBondContact CD2-ND2 3.46Å; Y232-N236 WeakPolarHBondContact CE2-ND2 3.27Å; Y232-N236 VanDerWaalsContact CZ-ND2 3.31Å; Y232-N236 WeakPolarHBondContact O-CB 3.38Å; Y232-N236 PolarHBondContact O-N 3.5Å; Y232-N236 PolarHBondContact O-ND2 3.13Å; Y232-N236 VanDerWaalsContact O-ND2 3.17Å; N236-P240 WeakPolarHBondContact O-CG 3.48Å; N236-F275 WeakPolarHBondContact O-CZ 3.38Å
237	L	82.9	Confident	85.4	Confident	14 Å²	14	53.2 Å²	53.2	7%	0.073	27%	0.274	C	S	.	.	I	π-helix	trans	-106.3	-47.3	179.9	-51.1	-174.3	0	0	0	112.8	Y233 C241 F275 V279 I282	Y233-L237 HydrophobicContact CD1-CD1 4.01Å; Y233-L237 WeakPolarHBondContact O-CA 3.4Å; Y233-L237 WeakPolarHBondContact O-CB 3.46Å; Y233-L237 PolarHBondContact O-N 2.89Å; L237-C241 PolarHBondContact O-N 3.42Å; L237-F275 WeakPolarHBondContact O-CE1 3.45Å; L237-V279 HydrophobicContact CD2-CG2 4.19Å; L237-I282 HydrophobicContact CD1-CD1 3.83Å; L237-I282 HydrophobicContact CD2-CD1 3.83Å; L237-I282 HydrophobicContact CG-CD1 4.45Å
238	L	81.6	Confident	85.1	Confident	54 Å²	54	51.6 Å²	51.6	28%	0.283	27%	0.269	S	S	.	.	I	π-helix	trans	-78.2	-42.3	-172.4	-167.7	153.5	0	0	0	112.1	Y233 G234 C241 V242 L494	Y233-L238 PolarHBondContact O-N 2.65Å; G234-L238 VanDerWaalsContact O-CB 3.31Å; G234-L238 WeakPolarHBondContact O-CB 3.46Å; G234-L238 PolarHBondContact O-N 3.1Å; L238-C241 WeakPolarHBondContact O-CB 3.37Å; L238-C241 PolarHBondContact O-N 2.91Å; L238-V242 HydrophobicContact CD2-CG2 3.76Å; L238-V242 WeakPolarHBondContact O-CG2 3.42Å; L238-V242 PolarHBondContact O-N 3.23Å; L238-L494 HydrophobicContact CD1-CD2 4.25Å
239	V	84.5	Confident	85	Confident	67 Å²	67	53.1 Å²	53.1	41%	0.406	28%	0.278	S	S	.	.	H	α-helix	trans	-61.2	-48	-179.7	179.7	0	0	0	0	112.7	G234 L235 C241 V242 L243	G234-V239 PolarHBondContact O-N 3.17Å; L235-V239 HydrophobicContact CD2-CG2 4.37Å; L235-V239 WeakPolarHBondContact O-CB 3.31Å; V239-C241 VanDerWaalsContact C-N 3.29Å; V239-C241 PolarHBondContact O-N 2.95Å; V239-V242 PolarHBondContact O-N 3.17Å; V239-L243 HydrophobicContact CG1-CD1 4.08Å; V239-L243 HydrophobicContact CG1-CG 4.48Å; V239-L243 WeakPolarHBondContact O-CG 3.36Å; V239-L243 PolarHBondContact O-N 3.41Å
240	P	86	Confident	84.9	Confident	36 Å²	36	52.2 Å²	52.2	23%	0.234	28%	0.28	C	S	.	.	H	α-helix	trans	-62.9	-35.2	175.8	-23.1	35.3	0	0	0	112.7	N236 L243 I244 F275	N236-P240 WeakPolarHBondContact O-CG 3.48Å; P240-L243 PolarHBondContact O-N 3.26Å; P240-I244 WeakPolarHBondContact O-CB 3.31Å; P240-I244 VanDerWaalsContact O-CG1 3.27Å; P240-I244 WeakPolarHBondContact O-CG1 3.49Å; P240-I244 PolarHBondContact O-N 2.88Å; P240-F275 HydrophobicContact CB-CE1 4.14Å; P240-F275 HydrophobicContact CB-CE2 3.8Å; P240-F275 HydrophobicContact CB-CZ 3.56Å; P240-F275 HydrophobicContact CG-CE2 4.06Å; P240-F275 HydrophobicContact CG-CZ 3.8Å
241	C	82.8	Confident	85	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-46.4	175.8	-168.7	0	0	0	0	112.4	L237 L238 V239 L243 I244 S245 Y296 F297	L237-C241 PolarHBondContact O-N 3.42Å; L238-C241 WeakPolarHBondContact O-CB 3.37Å; L238-C241 PolarHBondContact O-N 2.91Å; V239-C241 VanDerWaalsContact C-N 3.29Å; V239-C241 PolarHBondContact O-N 2.95Å; C241-L243 VanDerWaalsContact C-N 3.34Å; C241-L243 PolarHBondContact O-N 2.91Å; C241-I244 PolarHBondContact O-N 3.04Å; C241-S245 VanDerWaalsContact O-CB 3.32Å; C241-S245 WeakPolarHBondContact O-CB 3.46Å; C241-S245 PolarHBondContact O-N 3.12Å; C241-S245 PolarHBondContact O-OG 2.91Å; C241-Y296 HydrophobicContact CB-CE1 4.16Å; C241-Y296 WeakPolarHBondContact SG-CE1 3.01Å; C241-F297 HydrophobicContact CB-CD1 4.41Å; C241-F297 HydrophobicContact CB-CE1 3.5Å; C241-F297 VanDerWaalsContact CB-CE1 3.5Å; C241-F297 HydrophobicContact CB-CZ 4.02Å; C241-F297 WeakPolarHBondContact SG-CE1 3.24Å
242	V	83.6	Confident	85.2	Confident	67 Å²	67	48.9 Å²	48.9	41%	0.406	26%	0.262	S	S	.	.	H	α-helix	trans	-62.3	-43.7	177.1	172.3	0	0	0	0	110.3	L238 V239 S245 T246	L238-V242 HydrophobicContact CD2-CG2 3.76Å; L238-V242 WeakPolarHBondContact O-CG2 3.42Å; L238-V242 PolarHBondContact O-N 3.23Å; V239-V242 PolarHBondContact O-N 3.17Å; V242-S245 PolarHBondContact O-N 3.41Å; V242-T246 WeakPolarHBondContact O-CG2 3.4Å; V242-T246 PolarHBondContact O-N 3.48Å; V242-T246 PolarHBondContact O-OG1 2.74Å
243	L	87.3	Confident	85.2	Confident	99 Å²	99	47.2 Å²	47.2	52%	0.518	26%	0.263	S	S	.	.	H	α-helix	trans	-59.3	-52.2	175.9	-69.7	171	0	0	0	111.8	V239 P240 C241 S245 T246 L247	V239-L243 HydrophobicContact CG1-CD1 4.08Å; V239-L243 HydrophobicContact CG1-CG 4.48Å; V239-L243 WeakPolarHBondContact O-CG 3.36Å; V239-L243 PolarHBondContact O-N 3.41Å; P240-L243 PolarHBondContact O-N 3.26Å; C241-L243 VanDerWaalsContact C-N 3.34Å; C241-L243 PolarHBondContact O-N 2.91Å; L243-S245 VanDerWaalsContact C-N 3.27Å; L243-S245 PolarHBondContact O-N 3.31Å; L243-T246 PolarHBondContact O-N 2.82Å; L243-T246 VanDerWaalsContact O-N 3.13Å; L243-T246 PolarHBondContact O-OG1 3.15Å; L243-L247 WeakPolarHBondContact O-CG 3.37Å; L243-L247 PolarHBondContact O-N 2.87Å
244	I	85.8	Confident	85.4	Confident	15 Å²	15	47.8 Å²	47.8	8%	0.077	27%	0.268	C	S	.	.	H	α-helix	trans	-58.4	-40.1	177.3	-68	166.8	0	0	0	111.2	P240 C241 L247 A248 V268 L272 F275	P240-I244 WeakPolarHBondContact O-CB 3.31Å; P240-I244 VanDerWaalsContact O-CG1 3.27Å; P240-I244 WeakPolarHBondContact O-CG1 3.49Å; P240-I244 PolarHBondContact O-N 2.88Å; C241-I244 PolarHBondContact O-N 3.04Å; I244-L247 PolarHBondContact O-N 2.87Å; I244-A248 PolarHBondContact O-N 3.31Å; I244-V268 HydrophobicContact CG2-CG1 4.19Å; I244-L272 HydrophobicContact CG2-CB 4.04Å; I244-L272 HydrophobicContact CG2-CD1 4.14Å; I244-L272 HydrophobicContact CG2-CG 4.5Å; I244-F275 HydrophobicContact CD1-CB 4.47Å
245	S	84.1	Confident	85.6	Confident	11 Å²	11	50 Å²	50	8%	0.077	28%	0.279	C	S	.	.	H	α-helix	trans	-65	-39.4	177	-58.6	0	0	0	0	112.5	C241 V242 L243 A248 L249	C241-S245 VanDerWaalsContact O-CB 3.32Å; C241-S245 WeakPolarHBondContact O-CB 3.46Å; C241-S245 PolarHBondContact O-N 3.12Å; C241-S245 PolarHBondContact O-OG 2.91Å; V242-S245 PolarHBondContact O-N 3.41Å; L243-S245 VanDerWaalsContact C-N 3.27Å; L243-S245 PolarHBondContact O-N 3.31Å; S245-A248 PolarHBondContact O-N 3.03Å; S245-L249 PolarHBondContact O-N 3.35Å
246	T	85.9	Confident	85.6	Confident	77 Å²	77	46 Å²	46	47%	0.472	26%	0.26	S	S	.	.	H	α-helix	trans	-68.7	-35.1	173.6	60.5	0	0	0	0	112.7	V242 L243 L249 L250	V242-T246 WeakPolarHBondContact O-CG2 3.4Å; V242-T246 PolarHBondContact O-N 3.48Å; V242-T246 PolarHBondContact O-OG1 2.74Å; L243-T246 PolarHBondContact O-N 2.82Å; L243-T246 VanDerWaalsContact O-N 3.13Å; L243-T246 PolarHBondContact O-OG1 3.15Å; T246-L249 PolarHBondContact O-N 3.1Å; T246-L250 PolarHBondContact O-N 2.9Å
247	L	87.8	Confident	85.5	Confident	74 Å²	74	47.8 Å²	47.8	39%	0.387	27%	0.269	S	S	.	.	H	α-helix	trans	-66.4	-36.2	174.4	-68.9	172.1	0	0	0	112	L243 I244 L250 V251 V268	L243-L247 WeakPolarHBondContact O-CG 3.37Å; L243-L247 PolarHBondContact O-N 2.87Å; I244-L247 PolarHBondContact O-N 2.87Å; L247-L250 HydrophobicContact CD2-CD2 4.17Å; L247-L250 WeakPolarHBondContact O-CB 3.43Å; L247-L250 PolarHBondContact O-N 3.04Å; L247-V251 WeakPolarHBondContact O-CG2 3.33Å; L247-V251 PolarHBondContact O-N 3.1Å; L247-V268 HydrophobicContact CB-CG2 3.9Å
248	A	85.4	Confident	85.5	Confident	7 Å²	7	50.2 Å²	50.2	6%	0.058	29%	0.287	C	S	.	.	H	α-helix	trans	-62.1	-41.5	173.2	0	0	0	0	0	112.4	I244 S245 L250 V251 V268 V304	I244-A248 PolarHBondContact O-N 3.31Å; S245-A248 PolarHBondContact O-N 3.03Å; A248-L250 VanDerWaalsContact C-N 3.33Å; A248-L250 PolarHBondContact O-N 3.09Å; A248-V251 WeakPolarHBondContact O-CG2 3.36Å; A248-V251 PolarHBondContact O-N 3.39Å; A248-V268 HydrophobicContact CB-CG1 3.97Å; A248-V304 HydrophobicContact CB-CG1 4.44Å; A248-V304 HydrophobicContact CB-CG2 3.78Å
249	L	87.6	Confident	85.6	Confident	38 Å²	38	50 Å²	50	20%	0.199	30%	0.298	C	S	.	.	H	α-helix	trans	-68	-31.9	174.6	-64.9	176.4	0	0	0	112.5	S245 T246 V251 F252 F482	S245-L249 PolarHBondContact O-N 3.35Å; T246-L249 PolarHBondContact O-N 3.1Å; L249-V251 PolarHBondContact O-N 2.78Å; L249-F252 PolarHBondContact O-N 2.91Å; L249-F482 HydrophobicContact CD2-CB 4.06Å
250	L	87.9	Confident	85.7	Confident	80 Å²	80	52.4 Å²	52.4	42%	0.419	30%	0.304	S	S	.	.	H	α-helix	trans	-63.5	-25.4	176.9	-170.1	65.3	0	0	0	112.8	T246 L247 A248 F252 L253 L254	T246-L250 PolarHBondContact O-N 2.9Å; L247-L250 HydrophobicContact CD2-CD2 4.17Å; L247-L250 WeakPolarHBondContact O-CB 3.43Å; L247-L250 PolarHBondContact O-N 3.04Å; A248-L250 VanDerWaalsContact C-N 3.33Å; A248-L250 PolarHBondContact O-N 3.09Å; L250-F252 VanDerWaalsContact C-N 3.26Å; L250-F252 PolarHBondContact O-N 3.38Å; L250-L253 HydrophobicContact CD1-CB 4.24Å; L250-L253 HydrophobicContact CD1-CD1 3.97Å; L250-L253 WeakPolarHBondContact O-CB 3.44Å; L250-L253 PolarHBondContact O-N 2.7Å; L250-L254 PolarHBondContact O-N 2.69Å
251	V	88.9	Confident	85.8	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.024	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-34.5	175.8	-165.2	0	0	0	0	111.9	L247 A248 L249 L253 L254 K261 L264 T311	L247-V251 WeakPolarHBondContact O-CG2 3.33Å; L247-V251 PolarHBondContact O-N 3.1Å; A248-V251 WeakPolarHBondContact O-CG2 3.36Å; A248-V251 PolarHBondContact O-N 3.39Å; L249-V251 PolarHBondContact O-N 2.78Å; V251-L253 VanDerWaalsContact C-N 3.29Å; V251-L253 PolarHBondContact O-N 3.35Å; V251-L254 PolarHBondContact O-N 2.73Å; V251-K261 HydrophobicContact CG1-CG 3.86Å; V251-K261 WeakPolarHBondContact CG1-O 3.47Å; V251-K261 WeakPolarHBondContact O-CE 3.49Å; V251-K261 PolarHBondContact O-NZ 3.06Å; V251-L264 HydrophobicContact CG2-CD2 4.07Å; V251-L264 HydrophobicContact CG2-CG 4.06Å; V251-T311 HydrophobicContact CB-CG2 4.43Å; V251-T311 HydrophobicContact CG1-CG2 3.8Å
252	F	88	Confident	86	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.018	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-3.8	174.8	-59.5	-74.7	0	0	0	114.2	L249 L250 A310 T311 D475 C478 L479 F482	L249-F252 PolarHBondContact O-N 2.91Å; L250-F252 VanDerWaalsContact C-N 3.26Å; L250-F252 PolarHBondContact O-N 3.38Å; F252-A310 HydrophobicContact CE1-CB 4.24Å; F252-A310 HydrophobicContact CZ-CB 4.28Å; F252-T311 HydrophobicContact CD1-CG2 3.81Å; F252-T311 HydrophobicContact CE1-CG2 3.43Å; F252-T311 VanDerWaalsContact CE1-CG2 3.43Å; F252-T311 HydrophobicContact CZ-CG2 3.9Å; F252-D475 WeakPolarHBondContact CD1-OD1 3.49Å; F252-C478 HydrophobicContact CD1-CB 3.84Å; F252-C478 HydrophobicContact CE1-CB 3.51Å; F252-C478 HydrophobicContact CZ-CB 4.04Å; F252-L479 HydrophobicContact CB-CB 3.73Å; F252-L479 HydrophobicContact CB-CD1 4.01Å; F252-L479 HydrophobicContact CB-CG 4.09Å; F252-L479 HydrophobicContact CG-CB 4.35Å; F252-F482 HydrophobicContact CD2-CD2 4.47Å; F252-F482 HydrophobicContact CE1-CD2 4.34Å; F252-F482 HydrophobicContact CE1-CE2 4.34Å; F252-F482 HydrophobicContact CE2-CB 4.44Å; F252-F482 AromaticContact CE2-CD2 3.46Å; F252-F482 HydrophobicContact CE2-CD2 3.46Å; F252-F482 VanDerWaalsContact CE2-CD2 3.46Å; F252-F482 HydrophobicContact CE2-CE2 4.04Å; F252-F482 HydrophobicContact CE2-CG 4.22Å; F252-F482 AromaticContact CZ-CD2 3.4Å; F252-F482 HydrophobicContact CZ-CD2 3.4Å; F252-F482 AromaticContact CZ-CE2 3.5Å; F252-F482 HydrophobicContact CZ-CE2 3.5Å; F252-F482 VanDerWaalsContact CZ-CE2 3.5Å; F252-F482 HydrophobicContact CZ-CG 4.49Å
253	L	85.8	Confident	86.3	Confident	117 Å²	117	53.7 Å²	53.7	61%	0.613	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-22.2	170.6	-71.2	172	0	0	0	112.5	L250 V251 L479	L250-L253 HydrophobicContact CD1-CB 4.24Å; L250-L253 HydrophobicContact CD1-CD1 3.97Å; L250-L253 WeakPolarHBondContact O-CB 3.44Å; L250-L253 PolarHBondContact O-N 2.7Å; V251-L253 VanDerWaalsContact C-N 3.29Å; V251-L253 PolarHBondContact O-N 3.35Å; L253-L479 HydrophobicContact CD2-CD1 3.44Å; L253-L479 VanDerWaalsContact CD2-CD1 3.44Å; L253-L479 HydrophobicContact CG-CD1 3.65Å
254	L	87.6	Confident	86.4	Confident	51 Å²	51	51.2 Å²	51.2	27%	0.267	30%	0.298	S	S	.	.	S	Bend	trans	-74.9	128.8	178.6	-163.6	75.1	0	0	0	110.8	L250 V251 E260 K261	L250-L254 PolarHBondContact O-N 2.69Å; V251-L254 PolarHBondContact O-N 2.73Å; L254-E260 HydrophobicContact CD2-CB 4.37Å; L254-K261 HydrophobicContact CD2-CB 4.18Å; L254-K261 PolarHBondContact O-NZ 2.88Å
255	P	86.2	Confident	86.4	Confident	67 Å²	67	50.6 Å²	50.6	44%	0.435	30%	0.295	S	S	.	.			trans	-67.9	148.5	177.8	28.3	-34.3	0	0	0	111.9	D257 S258	P255-D257 VanDerWaalsContact C-N 3.32Å; P255-D257 PolarHBondContact O-N 3.04Å; P255-S258 PolarHBondContact O-N 3.22Å
256	A	83	Confident	86.6	Confident	10 Å²	10	54.7 Å²	54.7	8%	0.083	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-66.1	-31	-177.7	0	0	0	0	0	113.4	S258 G259 L315 H318	A256-S258 PolarHBondContact O-N 2.97Å; A256-S258 VanDerWaalsContact O-N 3.13Å; A256-G259 PolarHBondContact O-N 3.13Å; A256-L315 HydrophobicContact CB-CD1 3.9Å; A256-H318 HydrophobicContact CB-CB 4.11Å
257	D	83.1	Confident	86.8	Confident	112 Å²	112	54.7 Å²	54.7	60%	0.599	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-63.2	-16	179.7	-52.1	-79.3	0	0	0	113.7	P255 H318 K468	P255-D257 VanDerWaalsContact C-N 3.32Å; P255-D257 PolarHBondContact O-N 3.04Å; D257-H318 IonicContact OD1-CE1 2.69Å; D257-H318 PolarHBondContact OD1-CE1 3.42Å; D257-H318 IonicContact OD1-NE2 2.77Å; D257-K468 IonicContact OD1-NZ 3.84Å
258	S	83.4	Confident	86.8	Confident	65 Å²	65	51.6 Å²	51.6	46%	0.455	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-78.4	-11.6	179.5	-62.7	0	0	0	0	114.7	P255 A256 E260	P255-S258 PolarHBondContact O-N 3.22Å; A256-S258 PolarHBondContact O-N 2.97Å; A256-S258 VanDerWaalsContact O-N 3.13Å; S258-E260 PolarHBondContact O-N 3.43Å
259	G	83.4	Confident	86.9	Confident	49 Å²	49	53.8 Å²	53.8	51%	0.505	31%	0.309	S	S	.	.	S	Bend	trans	72.2	-43.8	-179.1	0	0	0	0	0	115.4	A256 K261	A256-G259 PolarHBondContact O-N 3.13Å; G259-K261 PolarHBondContact O-N 3.33Å
260	E	86.8	Confident	87	Confident	117 Å²	117	57 Å²	57	55%	0.547	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-4.1	-176.4	-66.1	-55.6	141.7	0	0	115.3	L254 S258 I262 S263 L264	L254-E260 HydrophobicContact CD2-CB 4.37Å; S258-E260 PolarHBondContact O-N 3.43Å; E260-I262 VanDerWaalsContact C-N 3.31Å; E260-I262 PolarHBondContact O-N 3.09Å; E260-S263 WeakPolarHBondContact O-CB 3.5Å; E260-S263 PolarHBondContact O-N 3.15Å; E260-S263 VanDerWaalsContact O-N 3.12Å; E260-S263 WeakPolarHBondContact OE2-CB 3.46Å; E260-S263 PolarHBondContact OE2-OG 3.24Å; E260-S263 VanDerWaalsContact OE2-OG 3.05Å; E260-L264 PolarHBondContact O-N 3.26Å
261	K	87.8	Confident	87	Confident	3 Å²	3	56.2 Å²	56.2	1%	0.013	33%	0.327	C	S	.	.	H	α-helix	trans	-59.6	-37	-179.2	-168.3	169.8	-178.9	128.8	0	113.1	V251 L254 G259 G265 D475	V251-K261 HydrophobicContact CG1-CG 3.86Å; V251-K261 WeakPolarHBondContact CG1-O 3.47Å; V251-K261 WeakPolarHBondContact O-CE 3.49Å; V251-K261 PolarHBondContact O-NZ 3.06Å; L254-K261 HydrophobicContact CD2-CB 4.18Å; L254-K261 PolarHBondContact O-NZ 2.88Å; G259-K261 PolarHBondContact O-N 3.33Å; K261-G265 PolarHBondContact O-N 2.8Å; K261-D475 WeakPolarHBondContact CE-OD1 3.42Å; K261-D475 IonicContact NZ-OD1 3.39Å; K261-D475 PolarHBondContact NZ-OD1 2.91Å; K261-D475 IonicContact NZ-OD2 2.7Å; K261-D475 PolarHBondContact NZ-OD2 3.24Å
262	I	87.3	Confident	86.8	Confident	70 Å²	70	56 Å²	56	36%	0.359	33%	0.326	S	S	.	.	H	α-helix	trans	-71.7	-45.1	173.3	-64.6	165.6	0	0	0	110.6	E260 L264 G265 I266 L315	E260-I262 VanDerWaalsContact C-N 3.31Å; E260-I262 PolarHBondContact O-N 3.09Å; I262-L264 VanDerWaalsContact C-N 3.33Å; I262-L264 PolarHBondContact O-N 3.48Å; I262-G265 PolarHBondContact O-N 3.03Å; I262-G265 VanDerWaalsContact O-N 3.1Å; I262-I266 HydrophobicContact CG2-CD1 3.54Å; I262-I266 HydrophobicContact CG2-CG1 4.06Å; I262-I266 WeakPolarHBondContact O-CG1 3.41Å; I262-I266 PolarHBondContact O-N 3.3Å; I262-L315 HydrophobicContact CD1-CD2 3.34Å; I262-L315 HydrophobicContact CG1-CD2 3.85Å
263	S	88.9	Confident	86.7	Confident	57 Å²	57	57.7 Å²	57.7	40%	0.399	34%	0.337	S	S	.	.	H	α-helix	trans	-54.6	-47.8	-179.6	-173	0	0	0	0	111.4	E260 T267	E260-S263 WeakPolarHBondContact O-CB 3.5Å; E260-S263 PolarHBondContact O-N 3.15Å; E260-S263 VanDerWaalsContact O-N 3.12Å; E260-S263 WeakPolarHBondContact OE2-CB 3.46Å; E260-S263 PolarHBondContact OE2-OG 3.24Å; E260-S263 VanDerWaalsContact OE2-OG 3.05Å; S263-T267 WeakPolarHBondContact O-CB 3.46Å; S263-T267 WeakPolarHBondContact O-CG2 3.38Å; S263-T267 PolarHBondContact O-N 2.99Å; S263-T267 PolarHBondContact O-OG1 3.23Å
264	L	88.8	Confident	86.8	Confident	48 Å²	48	56.4 Å²	56.4	25%	0.251	33%	0.334	S	S	.	.	H	α-helix	trans	-64.6	-42.5	175.1	-172	65	0	0	0	112.5	V251 E260 I262 T267 V268	V251-L264 HydrophobicContact CG2-CD2 4.07Å; V251-L264 HydrophobicContact CG2-CG 4.06Å; E260-L264 PolarHBondContact O-N 3.26Å; I262-L264 VanDerWaalsContact C-N 3.33Å; I262-L264 PolarHBondContact O-N 3.48Å; L264-T267 WeakPolarHBondContact CA-OG1 3.44Å; L264-T267 PolarHBondContact O-OG1 3.5Å; L264-T267 VanDerWaalsContact O-OG1 3.09Å; L264-V268 HydrophobicContact CD1-CG2 4.44Å; L264-V268 WeakPolarHBondContact O-CB 3.49Å; L264-V268 VanDerWaalsContact O-CG2 3.26Å; L264-V268 WeakPolarHBondContact O-CG2 3.29Å; L264-V268 PolarHBondContact O-N 3.36Å
265	G	86.3	Confident	86.7	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-62.8	-44.8	178.2	0	0	0	0	0	113.5	K261 I262 L269 V308	K261-G265 PolarHBondContact O-N 2.8Å; I262-G265 PolarHBondContact O-N 3.03Å; I262-G265 VanDerWaalsContact O-N 3.1Å; G265-L269 WeakPolarHBondContact O-CB 3.43Å; G265-L269 PolarHBondContact O-N 3.37Å; G265-L269 VanDerWaalsContact O-N 3.1Å; G265-V308 WeakPolarHBondContact O-CG2 3.34Å
266	I	88.5	Confident	86.4	Confident	97 Å²	97	54.2 Å²	54.2	50%	0.497	32%	0.316	S	S	.	.	H	α-helix	trans	-68.6	-41.7	179.2	-65.7	176.7	0	0	0	111.1	I262 L269 L270	I262-I266 HydrophobicContact CG2-CD1 3.54Å; I262-I266 HydrophobicContact CG2-CG1 4.06Å; I262-I266 WeakPolarHBondContact O-CG1 3.41Å; I262-I266 PolarHBondContact O-N 3.3Å; I266-L269 PolarHBondContact O-N 3.48Å; I266-L270 WeakPolarHBondContact O-CB 3.36Å; I266-L270 PolarHBondContact O-N 3.43Å
267	T	90.7	Very high	86.4	Confident	78 Å²	78	59.3 Å²	59.3	48%	0.479	34%	0.342	S	S	.	.	H	α-helix	trans	-67.4	-38.2	179.6	47.8	0	0	0	0	112.6	S263 L264 L270 S271	S263-T267 WeakPolarHBondContact O-CB 3.46Å; S263-T267 WeakPolarHBondContact O-CG2 3.38Å; S263-T267 PolarHBondContact O-N 2.99Å; S263-T267 PolarHBondContact O-OG1 3.23Å; L264-T267 WeakPolarHBondContact CA-OG1 3.44Å; L264-T267 PolarHBondContact O-OG1 3.5Å; L264-T267 VanDerWaalsContact O-OG1 3.09Å; T267-L270 PolarHBondContact O-N 2.75Å; T267-S271 WeakPolarHBondContact O-CB 3.2Å; T267-S271 PolarHBondContact O-N 3.33Å
268	V	88.3	Confident	86.5	Confident	9 Å²	9	58.3 Å²	58.3	6%	0.055	34%	0.336	C	S	.	.	H	α-helix	trans	-62.6	-45.6	172	168.5	0	0	0	0	111.5	I244 L247 A248 L264 S271 L272 V304	I244-V268 HydrophobicContact CG2-CG1 4.19Å; L247-V268 HydrophobicContact CB-CG2 3.9Å; A248-V268 HydrophobicContact CB-CG1 3.97Å; L264-V268 HydrophobicContact CD1-CG2 4.44Å; L264-V268 WeakPolarHBondContact O-CB 3.49Å; L264-V268 VanDerWaalsContact O-CG2 3.26Å; L264-V268 WeakPolarHBondContact O-CG2 3.29Å; L264-V268 PolarHBondContact O-N 3.36Å; V268-S271 PolarHBondContact O-N 2.81Å; V268-L272 WeakPolarHBondContact O-CB 3.43Å; V268-L272 PolarHBondContact O-N 2.88Å; V268-V304 HydrophobicContact CG1-CG1 4.12Å
269	L	85.8	Confident	86.4	Confident	52 Å²	52	55.2 Å²	55.2	27%	0.272	31%	0.314	S	S	.	.	H	α-helix	trans	-62	-45.9	177.2	-178.5	64.3	0	0	0	111.8	G265 I266 L272 T273 V304 V308	G265-L269 WeakPolarHBondContact O-CB 3.43Å; G265-L269 PolarHBondContact O-N 3.37Å; G265-L269 VanDerWaalsContact O-N 3.1Å; I266-L269 PolarHBondContact O-N 3.48Å; L269-L272 PolarHBondContact O-N 2.9Å; L269-T273 WeakPolarHBondContact O-CG2 3.29Å; L269-T273 PolarHBondContact O-N 2.75Å; L269-V304 HydrophobicContact CD1-CG1 4.16Å; L269-V308 HydrophobicContact CB-CG2 4.37Å
270	L	89.7	Confident	86	Confident	106 Å²	106	55.8 Å²	55.8	56%	0.555	31%	0.314	S	S	*	.	H	α-helix	trans	-61.9	-46.8	177.9	-177.2	63.5	0	0	0	111.4	I266 T267 L272 T273 V274	I266-L270 WeakPolarHBondContact O-CB 3.36Å; I266-L270 PolarHBondContact O-N 3.43Å; T267-L270 PolarHBondContact O-N 2.75Å; L270-L272 VanDerWaalsContact C-N 3.29Å; L270-L272 PolarHBondContact O-N 2.99Å; L270-T273 PolarHBondContact O-N 3.15Å; L270-T273 VanDerWaalsContact O-N 3.13Å; L270-T273 PolarHBondContact O-OG1 2.95Å; L270-V274 WeakPolarHBondContact O-CG2 3.27Å; L270-V274 PolarHBondContact O-N 3.33Å
271	S	89.4	Confident	85.8	Confident	63 Å²	63	58 Å²	58	44%	0.441	33%	0.325	S	S	.	.	H	α-helix	trans	-59.1	-39.8	177.4	-176	0	0	0	0	112.1	T267 V268 F275	T267-S271 WeakPolarHBondContact O-CB 3.2Å; T267-S271 PolarHBondContact O-N 3.33Å; V268-S271 PolarHBondContact O-N 2.81Å; S271-F275 WeakPolarHBondContact O-CB 3.47Å; S271-F275 PolarHBondContact O-N 3.5Å
272	L	84.4	Confident	85.2	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-65.2	-41.2	175.3	-174.9	57.8	0	0	0	112.2	I244 V268 L269 L270 F275 M276 T300 M301 V304	I244-L272 HydrophobicContact CG2-CB 4.04Å; I244-L272 HydrophobicContact CG2-CD1 4.14Å; I244-L272 HydrophobicContact CG2-CG 4.5Å; V268-L272 WeakPolarHBondContact O-CB 3.43Å; V268-L272 PolarHBondContact O-N 2.88Å; L269-L272 PolarHBondContact O-N 2.9Å; L270-L272 VanDerWaalsContact C-N 3.29Å; L270-L272 PolarHBondContact O-N 2.99Å; L272-F275 PolarHBondContact O-N 3.02Å; L272-M276 WeakPolarHBondContact O-CB 3.43Å; L272-M276 PolarHBondContact O-N 3.48Å; L272-T300 HydrophobicContact CD2-CG2 4.33Å; L272-M301 HydrophobicContact CD2-CB 4.19Å; L272-V304 HydrophobicContact CD2-CB 3.78Å; L272-V304 HydrophobicContact CD2-CG1 4.12Å; L272-V304 HydrophobicContact CD2-CG2 3.78Å
273	T	85.3	Confident	84.6	Confident	40 Å²	40	60 Å²	60	25%	0.245	34%	0.335	C	S	.	.	H	α-helix	trans	-65.3	-40.5	177.2	58.7	0	0	0	0	113	L269 L270 M276 L277 M301	L269-T273 WeakPolarHBondContact O-CG2 3.29Å; L269-T273 PolarHBondContact O-N 2.75Å; L270-T273 PolarHBondContact O-N 3.15Å; L270-T273 VanDerWaalsContact O-N 3.13Å; L270-T273 PolarHBondContact O-OG1 2.95Å; T273-M276 PolarHBondContact O-N 3.33Å; T273-L277 WeakPolarHBondContact O-CG 3.38Å; T273-L277 PolarHBondContact O-N 3.03Å; T273-L277 VanDerWaalsContact O-N 3.08Å; T273-M301 HydrophobicContact CG2-CE 3.79Å; T273-M301 HydrophobicContact CG2-SD 4.42Å
274	V	89	Confident	83.6	Confident	89 Å²	89	58.5 Å²	58.5	54%	0.539	32%	0.323	S	S	.	.	H	α-helix	trans	-65.7	-41.6	176.2	173.9	0	0	0	0	110.8	L270 M276 L277 L278	L270-V274 WeakPolarHBondContact O-CG2 3.27Å; L270-V274 PolarHBondContact O-N 3.33Å; V274-M276 VanDerWaalsContact C-N 3.33Å; V274-M276 PolarHBondContact O-N 3.39Å; V274-L277 PolarHBondContact O-N 3.13Å; V274-L278 PolarHBondContact O-N 3.01Å; V274-L278 VanDerWaalsContact O-N 3.16Å
275	F	84	Confident	82.4	Confident	30 Å²	30	61.5 Å²	61.5	13%	0.132	36%	0.355	C	S	.	.	H	α-helix	trans	-65	-37.3	176.3	-162	-110.2	0	0	0	112.2	N236 L237 P240 I244 S271 L272 L278 V279 F297	N236-F275 WeakPolarHBondContact O-CZ 3.38Å; L237-F275 WeakPolarHBondContact O-CE1 3.45Å; P240-F275 HydrophobicContact CB-CE1 4.14Å; P240-F275 HydrophobicContact CB-CE2 3.8Å; P240-F275 HydrophobicContact CB-CZ 3.56Å; P240-F275 HydrophobicContact CG-CE2 4.06Å; P240-F275 HydrophobicContact CG-CZ 3.8Å; I244-F275 HydrophobicContact CD1-CB 4.47Å; S271-F275 WeakPolarHBondContact O-CB 3.47Å; S271-F275 PolarHBondContact O-N 3.5Å; L272-F275 PolarHBondContact O-N 3.02Å; F275-L278 PolarHBondContact O-N 3.35Å; F275-V279 HydrophobicContact CD1-CG2 4.4Å; F275-V279 HydrophobicContact CE1-CG2 4.33Å; F275-V279 WeakPolarHBondContact O-CG2 3.35Å; F275-V279 PolarHBondContact O-N 2.92Å; F275-F297 AromaticContact CD1-CE1 3.69Å; F275-F297 HydrophobicContact CD1-CE1 3.69Å; F275-F297 HydrophobicContact CD1-CZ 4.06Å; F275-F297 AromaticContact CE1-CE1 3.61Å; F275-F297 HydrophobicContact CE1-CE1 3.61Å; F275-F297 AromaticContact CE1-CZ 3.6Å; F275-F297 HydrophobicContact CE1-CZ 3.6Å
276	M	81.2	Confident	81.6	Confident	42 Å²	42	63.8 Å²	63.8	21%	0.207	37%	0.369	C	S	.	.	H	α-helix	trans	-64.2	-38.1	174	-104.3	-67	-109.2	0	0	113.5	L272 T273 V274 V279 A280 F297 A298	L272-M276 WeakPolarHBondContact O-CB 3.43Å; L272-M276 PolarHBondContact O-N 3.48Å; T273-M276 PolarHBondContact O-N 3.33Å; V274-M276 VanDerWaalsContact C-N 3.33Å; V274-M276 PolarHBondContact O-N 3.39Å; M276-V279 PolarHBondContact O-N 2.94Å; M276-A280 WeakPolarHBondContact O-CB 3.5Å; M276-A280 PolarHBondContact O-N 3.48Å; M276-F297 HydrophobicContact CE-CB 3.87Å; M276-F297 HydrophobicContact CG-CB 3.9Å; M276-F297 HydrophobicContact CG-CG 4.49Å; M276-F297 HydrophobicContact SD-CB 3.31Å; M276-F297 WeakPolarHBondContact SD-CB 3.35Å; M276-F297 HydrophobicContact SD-CD2 4.47Å; M276-F297 HydrophobicContact SD-CG 4.02Å; M276-A298 HydrophobicContact CE-CB 4.3Å
277	L	83.4	Confident	80.7	Confident	118 Å²	118	64.6 Å²	64.6	62%	0.618	38%	0.383	S	S	*	.	H	α-helix	trans	-64.5	-42.7	174.8	-69.5	169.2	0	0	0	111.3	T273 V274 V279 A280 E281	T273-L277 WeakPolarHBondContact O-CG 3.38Å; T273-L277 PolarHBondContact O-N 3.03Å; T273-L277 VanDerWaalsContact O-N 3.08Å; V274-L277 PolarHBondContact O-N 3.13Å; L277-V279 VanDerWaalsContact C-N 3.33Å; L277-V279 PolarHBondContact O-N 3.49Å; L277-A280 PolarHBondContact O-N 3.47Å; L277-A280 VanDerWaalsContact O-N 3.14Å; L277-E281 PolarHBondContact O-N 2.82Å; L277-E281 VanDerWaalsContact O-N 3.09Å
278	L	84.4	Confident	79.7	Confident	90 Å²	90	66 Å²	66	47%	0.471	39%	0.388	S	S	.	.	H	α-helix	trans	-60.1	-41.2	174.1	-177.6	68.2	0	0	0	112.2	V274 F275 A280 E281 I282	V274-L278 PolarHBondContact O-N 3.01Å; V274-L278 VanDerWaalsContact O-N 3.16Å; F275-L278 PolarHBondContact O-N 3.35Å; L278-A280 VanDerWaalsContact C-N 3.33Å; L278-E281 PolarHBondContact O-N 3.35Å; L278-I282 PolarHBondContact O-N 3.43Å
279	V	80.8	Confident	79.1	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-66.4	-34.9	175.8	172.3	0	0	0	0	111.6	L237 F275 M276 L277 E281 I282 M283 F297	L237-V279 HydrophobicContact CD2-CG2 4.19Å; F275-V279 HydrophobicContact CD1-CG2 4.4Å; F275-V279 HydrophobicContact CE1-CG2 4.33Å; F275-V279 WeakPolarHBondContact O-CG2 3.35Å; F275-V279 PolarHBondContact O-N 2.92Å; M276-V279 PolarHBondContact O-N 2.94Å; L277-V279 VanDerWaalsContact C-N 3.33Å; L277-V279 PolarHBondContact O-N 3.49Å; V279-E281 VanDerWaalsContact C-N 3.34Å; V279-I282 VanDerWaalsContact O-CG1 3.24Å; V279-I282 WeakPolarHBondContact O-CG1 3.36Å; V279-M283 HydrophobicContact CG1-CE 3.73Å; V279-M283 HydrophobicContact CG1-SD 4.16Å; V279-M283 WeakPolarHBondContact O-CG 3.49Å; V279-M283 PolarHBondContact O-N 3.05Å; V279-F297 HydrophobicContact CB-CE2 4.42Å; V279-F297 HydrophobicContact CG1-CD2 3.93Å; V279-F297 HydrophobicContact CG1-CE2 3.95Å; V279-F297 HydrophobicContact CG2-CD2 4.27Å; V279-F297 HydrophobicContact CG2-CE2 3.75Å; V279-F297 HydrophobicContact CG2-CZ 4.07Å
280	A	76.3	Confident	78.9	Confident	62 Å²	62	68.9 Å²	68.9	51%	0.512	41%	0.408	S	S	.	.	H	α-helix	trans	-71.4	-23.8	176	0	0	0	0	0	113.9	M276 L277 L278	M276-A280 WeakPolarHBondContact O-CB 3.5Å; M276-A280 PolarHBondContact O-N 3.48Å; L277-A280 PolarHBondContact O-N 3.47Å; L277-A280 VanDerWaalsContact O-N 3.14Å; L278-A280 VanDerWaalsContact C-N 3.33Å
281	E	80.8	Confident	78.7	Confident	163 Å²	163	64.5 Å²	64.5	76%	0.762	39%	0.386	S	S	*	.	H	α-helix	trans	-78.2	-29.3	175.8	-73.3	-177.2	166	0	0	113.4	L277 L278 V279	L277-E281 PolarHBondContact O-N 2.82Å; L277-E281 VanDerWaalsContact O-N 3.09Å; L278-E281 PolarHBondContact O-N 3.35Å; V279-E281 VanDerWaalsContact C-N 3.34Å
282	I	76.9	Confident	78.4	Confident	84 Å²	84	62.7 Å²	62.7	43%	0.431	37%	0.371	S	S	.	.	H	α-helix	trans	-88.3	-13.6	-178.6	62.6	170.4	0	0	0	114.3	L237 L278 V279	L237-I282 HydrophobicContact CD1-CD1 3.83Å; L237-I282 HydrophobicContact CD2-CD1 3.83Å; L237-I282 HydrophobicContact CG-CD1 4.45Å; L278-I282 PolarHBondContact O-N 3.43Å; V279-I282 VanDerWaalsContact O-CG1 3.24Å; V279-I282 WeakPolarHBondContact O-CG1 3.36Å
283	M	73.6	Confident	78.3	Confident	32 Å²	32	63.6 Å²	63.6	16%	0.158	38%	0.376	C	S	.	.	S	Bend	trans	-98	137.4	178.3	-65.1	-175.2	-54.1	0	0	110.6	V279 A285 P291 I293 A294	V279-M283 HydrophobicContact CG1-CE 3.73Å; V279-M283 HydrophobicContact CG1-SD 4.16Å; V279-M283 WeakPolarHBondContact O-CG 3.49Å; V279-M283 PolarHBondContact O-N 3.05Å; M283-A285 PolarHBondContact O-N 3.37Å; M283-P291 HydrophobicContact SD-CB 3.98Å; M283-P291 HydrophobicContact SD-CG 3.92Å; M283-I293 HydrophobicContact SD-CG2 3.66Å; M283-A294 HydrophobicContact CE-CB 3.81Å; M283-A294 HydrophobicContact SD-CB 4.41Å
284	P	67.9	Low	78.2	Confident	24 Å²	24	62.5 Å²	62.5	16%	0.156	37%	0.371	C	S	.	.			trans	-67	129.4	177.6	29.1	-35.5	0	0	0	110.6	E67 K68 V154 T286	E67-P284 HydrophobicContact CB-CG 4.07Å; K68-P284 HydrophobicContact CB-CB 4.19Å; V154-P284 HydrophobicContact CG1-CG 3.97Å; P284-T286 VanDerWaalsContact C-N 3.25Å; P284-T286 HydrophobicContact CB-CG2 4.4Å; P284-T286 PolarHBondContact O-N 2.79Å; P284-T286 PolarHBondContact O-OG1 3.37Å
285	A	64.6	Low	78	Confident	112 Å²	112	63 Å²	63	93%	0.926	37%	0.368	S	S	*	.			trans	-71.5	75.9	-178.7	0	0	0	0	0	111.9	M283	M283-A285 PolarHBondContact O-N 3.37Å
286	T	68.6	Low	78	Confident	48 Å²	48	62.4 Å²	62.4	29%	0.294	37%	0.365	S	S	.	.			trans	-104.9	139.4	179.4	51.7	0	0	0	0	110.7	P284	P284-T286 VanDerWaalsContact C-N 3.25Å; P284-T286 HydrophobicContact CB-CG2 4.4Å; P284-T286 PolarHBondContact O-N 2.79Å; P284-T286 PolarHBondContact O-OG1 3.37Å
287	S	68.9	Low	78.1	Confident	114 Å²	114	60.4 Å²	60.4	80%	0.797	36%	0.355	S	S	*	.	S	Bend	trans	-85	-22	178.5	42.3	0	0	0	0	113.8	S289	S287-S289 VanDerWaalsContact C-N 3.29Å; S287-S289 PolarHBondContact O-N 3.14Å
288	D	70.8	Confident	78.2	Confident	108 Å²	108	57 Å²	57	58%	0.578	34%	0.343	S	S	*	.	S	Bend	trans	-80.4	-18.4	-159.8	-54.4	-7	0	0	0	111.9
289	S	75.4	Confident	78.2	Confident	16 Å²	16	54.7 Å²	54.7	11%	0.112	33%	0.333	C	S	.	.			trans	-156.1	147.1	171	69.8	0	0	0	0	112.1	V154 S287	V154-S289 WeakPolarHBondContact CG2-OG 3.06Å; S287-S289 VanDerWaalsContact C-N 3.29Å; S287-S289 PolarHBondContact O-N 3.14Å
290	V	81.2	Confident	78.4	Confident	105 Å²	105	55 Å²	55	64%	0.636	34%	0.335	S	S	*	.			trans	-92.3	128.5	171.3	-179.2	0	0	0	0	108.6	A294	V290-A294 HydrophobicContact CG1-CB 4.22Å
291	P	85.6	Confident	78.9	Confident	14 Å²	14	55.6 Å²	55.6	9%	0.091	33%	0.328	C	S	.	.			trans	-63.8	137.3	173.3	-23.2	33.9	0	0	0	111.9	V154 M283 I293 A294 E295	V154-P291 HydrophobicContact CB-CG 4.26Å; V154-P291 HydrophobicContact CG2-CG 3.94Å; M283-P291 HydrophobicContact SD-CB 3.98Å; M283-P291 HydrophobicContact SD-CG 3.92Å; P291-I293 HydrophobicContact CB-CG2 4.05Å; P291-I293 PolarHBondContact O-N 2.99Å; P291-I293 VanDerWaalsContact O-N 3.17Å; P291-A294 HydrophobicContact CB-CB 4.23Å; P291-A294 WeakPolarHBondContact O-CA 3.01Å; P291-A294 VanDerWaalsContact O-CB 3.28Å; P291-A294 WeakPolarHBondContact O-CB 3.32Å; P291-A294 PolarHBondContact O-N 2.95Å; P291-E295 PolarHBondContact O-N 3.3Å; P291-E295 VanDerWaalsContact O-N 3.15Å
292	L	83.1	Confident	79.3	Confident	25 Å²	25	52.2 Å²	52.2	13%	0.131	32%	0.318	C	S	.	.	H	α-helix	trans	-55.3	-35.1	177.3	-176.3	66.5	0	0	0	112.8	R155 A294 E295 Y296 I493 S496 A497	R155-L292 VanDerWaalsContact O-CB 3.28Å; R155-L292 WeakPolarHBondContact O-CB 3.49Å; R155-L292 PolarHBondContact O-N 3.08Å; L292-A294 VanDerWaalsContact C-N 3.32Å; L292-A294 PolarHBondContact O-N 3.02Å; L292-E295 PolarHBondContact O-N 2.73Å; L292-Y296 PolarHBondContact O-N 3.18Å; L292-I493 HydrophobicContact CD1-CG2 3.83Å; L292-I493 HydrophobicContact CG-CG2 3.96Å; L292-S496 VanDerWaalsContact CD1-OG 3.24Å; L292-S496 WeakPolarHBondContact CD1-OG 3.23Å; L292-S496 WeakPolarHBondContact CD2-OG 3.38Å; L292-A497 HydrophobicContact CD2-CB 3.82Å
293	I	82.8	Confident	79.8	Confident	19 Å²	19	48.8 Å²	48.8	10%	0.097	30%	0.301	C	S	.	.	H	α-helix	trans	-66.4	-32.9	175.2	-165.4	65.3	0	0	0	112.3	F157 M283 P291 Y296 F297	F157-I293 HydrophobicContact CD1-CG2 3.84Å; F157-I293 HydrophobicContact CE1-CG2 4.41Å; M283-I293 HydrophobicContact SD-CG2 3.66Å; P291-I293 HydrophobicContact CB-CG2 4.05Å; P291-I293 PolarHBondContact O-N 2.99Å; P291-I293 VanDerWaalsContact O-N 3.17Å; I293-Y296 HydrophobicContact CD1-CD1 4.09Å; I293-Y296 WeakPolarHBondContact O-CB 3.45Å; I293-Y296 PolarHBondContact O-N 3.45Å; I293-F297 HydrophobicContact CD1-CD2 4.38Å; I293-F297 HydrophobicContact CD1-CE2 3.87Å; I293-F297 HydrophobicContact CG1-CD2 3.96Å; I293-F297 HydrophobicContact CG1-CE2 3.59Å; I293-F297 WeakPolarHBondContact O-CD2 3.48Å; I293-F297 PolarHBondContact O-N 2.87Å
294	A	83.1	Confident	80.4	Confident	17 Å²	17	47.4 Å²	47.4	14%	0.14	29%	0.294	C	S	.	.	H	α-helix	trans	-71.3	-40.6	176.6	0	0	0	0	0	111	M283 V290 P291 L292 Y296 F297 A298	M283-A294 HydrophobicContact CE-CB 3.81Å; M283-A294 HydrophobicContact SD-CB 4.41Å; V290-A294 HydrophobicContact CG1-CB 4.22Å; P291-A294 HydrophobicContact CB-CB 4.23Å; P291-A294 WeakPolarHBondContact O-CA 3.01Å; P291-A294 VanDerWaalsContact O-CB 3.28Å; P291-A294 WeakPolarHBondContact O-CB 3.32Å; P291-A294 PolarHBondContact O-N 2.95Å; L292-A294 VanDerWaalsContact C-N 3.32Å; L292-A294 PolarHBondContact O-N 3.02Å; A294-Y296 VanDerWaalsContact C-N 3.33Å; A294-F297 PolarHBondContact O-N 3.44Å; A294-A298 VanDerWaalsContact O-CB 3.24Å; A294-A298 WeakPolarHBondContact O-CB 3.45Å; A294-A298 PolarHBondContact O-N 3.18Å
295	E	84.2	Confident	81.3	Confident	101 Å²	101	47.2 Å²	47.2	47%	0.472	30%	0.297	S	S	.	.	H	α-helix	trans	-61.6	-41.3	171.8	-174.8	175.9	-172.7	0	0	111.6	P291 L292 A298 T299	P291-E295 PolarHBondContact O-N 3.3Å; P291-E295 VanDerWaalsContact O-N 3.15Å; L292-E295 PolarHBondContact O-N 2.73Å; E295-A298 PolarHBondContact O-N 3.49Å; E295-T299 HydrophobicContact CG-CG2 4.47Å; E295-T299 WeakPolarHBondContact O-CB 3.21Å; E295-T299 WeakPolarHBondContact O-CG2 3.43Å; E295-T299 PolarHBondContact O-N 2.88Å; E295-T299 PolarHBondContact O-OG1 3.31Å
296	Y	84.6	Confident	82.5	Confident	17 Å²	17	46.3 Å²	46.3	7%	0.067	28%	0.275	C	S	.	.	H	α-helix	trans	-58.9	-49.6	174.3	-179.7	-122.5	0	0	0	113	C241 L292 I293 A294 T299 T300 T490 I493	C241-Y296 HydrophobicContact CB-CE1 4.16Å; C241-Y296 WeakPolarHBondContact SG-CE1 3.01Å; L292-Y296 PolarHBondContact O-N 3.18Å; I293-Y296 HydrophobicContact CD1-CD1 4.09Å; I293-Y296 WeakPolarHBondContact O-CB 3.45Å; I293-Y296 PolarHBondContact O-N 3.45Å; A294-Y296 VanDerWaalsContact C-N 3.33Å; Y296-T299 PolarHBondContact O-OG1 2.8Å; Y296-T300 VanDerWaalsContact O-CB 3.29Å; Y296-T300 WeakPolarHBondContact O-CB 3.28Å; Y296-T300 PolarHBondContact O-N 3.37Å; Y296-T300 PolarHBondContact O-OG1 3.06Å; Y296-T490 HydrophobicContact CE2-CG2 3.66Å; Y296-T490 WeakPolarHBondContact OH-CG2 3.4Å; Y296-I493 HydrophobicContact CD2-CD1 4.09Å; Y296-I493 HydrophobicContact CD2-CG2 4.24Å; Y296-I493 HydrophobicContact CG-CG2 4.38Å
297	F	83.5	Confident	83.4	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-69.3	-37.5	177.8	-74.9	-68.4	0	0	0	112.7	C241 F275 M276 V279 I293 A294 T300 M301	C241-F297 HydrophobicContact CB-CD1 4.41Å; C241-F297 HydrophobicContact CB-CE1 3.5Å; C241-F297 VanDerWaalsContact CB-CE1 3.5Å; C241-F297 HydrophobicContact CB-CZ 4.02Å; C241-F297 WeakPolarHBondContact SG-CE1 3.24Å; F275-F297 AromaticContact CD1-CE1 3.69Å; F275-F297 HydrophobicContact CD1-CE1 3.69Å; F275-F297 HydrophobicContact CD1-CZ 4.06Å; F275-F297 AromaticContact CE1-CE1 3.61Å; F275-F297 HydrophobicContact CE1-CE1 3.61Å; F275-F297 AromaticContact CE1-CZ 3.6Å; F275-F297 HydrophobicContact CE1-CZ 3.6Å; M276-F297 HydrophobicContact CE-CB 3.87Å; M276-F297 HydrophobicContact CG-CB 3.9Å; M276-F297 HydrophobicContact CG-CG 4.49Å; M276-F297 HydrophobicContact SD-CB 3.31Å; M276-F297 WeakPolarHBondContact SD-CB 3.35Å; M276-F297 HydrophobicContact SD-CD2 4.47Å; M276-F297 HydrophobicContact SD-CG 4.02Å; V279-F297 HydrophobicContact CB-CE2 4.42Å; V279-F297 HydrophobicContact CG1-CD2 3.93Å; V279-F297 HydrophobicContact CG1-CE2 3.95Å; V279-F297 HydrophobicContact CG2-CD2 4.27Å; V279-F297 HydrophobicContact CG2-CE2 3.75Å; V279-F297 HydrophobicContact CG2-CZ 4.07Å; I293-F297 HydrophobicContact CD1-CD2 4.38Å; I293-F297 HydrophobicContact CD1-CE2 3.87Å; I293-F297 HydrophobicContact CG1-CD2 3.96Å; I293-F297 HydrophobicContact CG1-CE2 3.59Å; I293-F297 WeakPolarHBondContact O-CD2 3.48Å; I293-F297 PolarHBondContact O-N 2.87Å; A294-F297 PolarHBondContact O-N 3.44Å; F297-T300 PolarHBondContact O-N 2.99Å; F297-M301 VanDerWaalsContact O-CB 3.3Å; F297-M301 WeakPolarHBondContact O-CB 3.44Å; F297-M301 PolarHBondContact O-N 2.85Å
298	A	85.2	Confident	84.3	Confident	45 Å²	45	39.9 Å²	39.9	37%	0.372	23%	0.232	S	C	.	.	H	α-helix	trans	-64.2	-46.4	177.9	0	0	0	0	0	111.7	M276 A294 E295 M301 V302	M276-A298 HydrophobicContact CE-CB 4.3Å; A294-A298 VanDerWaalsContact O-CB 3.24Å; A294-A298 WeakPolarHBondContact O-CB 3.45Å; A294-A298 PolarHBondContact O-N 3.18Å; E295-A298 PolarHBondContact O-N 3.49Å; A298-M301 PolarHBondContact O-N 2.64Å; A298-V302 WeakPolarHBondContact O-CG2 3.37Å; A298-V302 PolarHBondContact O-N 2.79Å
299	T	85.4	Confident	85.3	Confident	43 Å²	43	39.7 Å²	39.7	26%	0.264	23%	0.23	S	C	.	.	H	α-helix	trans	-62.2	-44.7	174.1	50.9	0	0	0	0	111.4	E295 Y296 M301 V302 I303	E295-T299 HydrophobicContact CG-CG2 4.47Å; E295-T299 WeakPolarHBondContact O-CB 3.21Å; E295-T299 WeakPolarHBondContact O-CG2 3.43Å; E295-T299 PolarHBondContact O-N 2.88Å; E295-T299 PolarHBondContact O-OG1 3.31Å; Y296-T299 PolarHBondContact O-OG1 2.8Å; T299-M301 VanDerWaalsContact C-N 3.32Å; T299-M301 PolarHBondContact O-N 2.61Å; T299-V302 PolarHBondContact O-N 2.78Å; T299-I303 VanDerWaalsContact O-CG1 3.25Å; T299-I303 WeakPolarHBondContact O-CG1 3.27Å; T299-I303 PolarHBondContact O-N 3.38Å
300	T	84.3	Confident	85.9	Confident	7 Å²	7	39.6 Å²	39.6	4%	0.043	23%	0.23	C	C	.	.	H	α-helix	trans	-58.9	-40.6	174.3	-58.1	0	0	0	0	112.2	L272 Y296 F297 I303 V304	L272-T300 HydrophobicContact CD2-CG2 4.33Å; Y296-T300 VanDerWaalsContact O-CB 3.29Å; Y296-T300 WeakPolarHBondContact O-CB 3.28Å; Y296-T300 PolarHBondContact O-N 3.37Å; Y296-T300 PolarHBondContact O-OG1 3.06Å; F297-T300 PolarHBondContact O-N 2.99Å; T300-I303 PolarHBondContact O-N 3.36Å; T300-V304 HydrophobicContact CG2-CG2 4.43Å; T300-V304 WeakPolarHBondContact O-CG2 3.34Å; T300-V304 PolarHBondContact O-N 2.95Å
301	M	86.3	Confident	86.3	Confident	73 Å²	73	34.8 Å²	34.8	36%	0.36	20%	0.201	S	C	.	.	H	α-helix	trans	-65.6	-39.3	177	-178.6	173.5	166.3	0	0	112.6	L272 T273 F297 A298 T299 G305	L272-M301 HydrophobicContact CD2-CB 4.19Å; T273-M301 HydrophobicContact CG2-CE 3.79Å; T273-M301 HydrophobicContact CG2-SD 4.42Å; F297-M301 VanDerWaalsContact O-CB 3.3Å; F297-M301 WeakPolarHBondContact O-CB 3.44Å; F297-M301 PolarHBondContact O-N 2.85Å; A298-M301 PolarHBondContact O-N 2.64Å; T299-M301 VanDerWaalsContact C-N 3.32Å; T299-M301 PolarHBondContact O-N 2.61Å; M301-G305 PolarHBondContact O-N 2.84Å
302	V	88.8	Confident	86.4	Confident	93 Å²	93	37.6 Å²	37.6	56%	0.564	22%	0.217	S	C	*	.	H	α-helix	trans	-64.8	-42.6	172.3	176.2	0	0	0	0	111.1	A298 T299 G305 L306	A298-V302 WeakPolarHBondContact O-CG2 3.37Å; A298-V302 PolarHBondContact O-N 2.79Å; T299-V302 PolarHBondContact O-N 2.78Å; V302-G305 PolarHBondContact O-N 2.83Å; V302-L306 HydrophobicContact CG1-CD1 3.96Å; V302-L306 HydrophobicContact CG1-CG 4.39Å; V302-L306 WeakPolarHBondContact O-CB 3.44Å; V302-L306 WeakPolarHBondContact O-CG 3.16Å; V302-L306 PolarHBondContact O-N 2.88Å
303	I	87.6	Confident	86.6	Confident	12 Å²	12	40.7 Å²	40.7	6%	0.062	23%	0.234	C	C	.	.	H	α-helix	trans	-59.7	-49.6	176.9	-66.6	164.5	0	0	0	110.8	T299 T300 L306 S307 F482 F485 C489	T299-I303 VanDerWaalsContact O-CG1 3.25Å; T299-I303 WeakPolarHBondContact O-CG1 3.27Å; T299-I303 PolarHBondContact O-N 3.38Å; T300-I303 PolarHBondContact O-N 3.36Å; I303-L306 PolarHBondContact O-N 2.85Å; I303-S307 WeakPolarHBondContact O-CB 3.07Å; I303-S307 PolarHBondContact O-N 3.11Å; I303-F482 HydrophobicContact CG2-CD1 4.08Å; I303-F485 HydrophobicContact CD1-CD1 3.55Å; I303-F485 HydrophobicContact CD1-CE1 3.63Å; I303-F485 HydrophobicContact CG1-CD1 3.63Å; I303-F485 HydrophobicContact CG1-CE1 3.6Å; I303-C489 HydrophobicContact CD1-CB 4.49Å
304	V	86.1	Confident	86.9	Confident	3 Å²	3	40 Å²	40	2%	0.018	23%	0.23	C	C	.	.	H	α-helix	trans	-66.5	-41	-179.7	173.9	0	0	0	0	111.1	A248 V268 L269 L272 T300 L306 S307 V308	A248-V304 HydrophobicContact CB-CG1 4.44Å; A248-V304 HydrophobicContact CB-CG2 3.78Å; V268-V304 HydrophobicContact CG1-CG1 4.12Å; L269-V304 HydrophobicContact CD1-CG1 4.16Å; L272-V304 HydrophobicContact CD2-CB 3.78Å; L272-V304 HydrophobicContact CD2-CG1 4.12Å; L272-V304 HydrophobicContact CD2-CG2 3.78Å; T300-V304 HydrophobicContact CG2-CG2 4.43Å; T300-V304 WeakPolarHBondContact O-CG2 3.34Å; T300-V304 PolarHBondContact O-N 2.95Å; V304-L306 PolarHBondContact O-N 2.97Å; V304-S307 WeakPolarHBondContact CA-OG 3.46Å; V304-S307 WeakPolarHBondContact O-CB 3.34Å; V304-S307 PolarHBondContact O-N 2.68Å; V304-S307 VanDerWaalsContact O-N 3.14Å; V304-S307 PolarHBondContact O-OG 2.94Å; V304-V308 PolarHBondContact O-N 3.23Å
305	G	88.1	Confident	87	Confident	20 Å²	20	40.8 Å²	40.8	21%	0.206	23%	0.232	C	C	.	.	H	α-helix	trans	-58.4	-47.7	173.4	0	0	0	0	0	113	M301 V302 S307 V308 I309	M301-G305 PolarHBondContact O-N 2.84Å; V302-G305 PolarHBondContact O-N 2.83Å; G305-S307 VanDerWaalsContact C-N 3.28Å; G305-S307 PolarHBondContact O-N 2.87Å; G305-V308 PolarHBondContact O-N 3.31Å; G305-I309 WeakPolarHBondContact O-CG1 3.45Å; G305-I309 PolarHBondContact O-N 2.85Å; G305-I309 VanDerWaalsContact O-N 3.16Å
306	L	89.4	Confident	87.1	Confident	92 Å²	92	42 Å²	42	48%	0.482	24%	0.238	S	C	.	.	H	α-helix	trans	-63.2	-33.8	174.4	-71.2	173.3	0	0	0	112.4	V302 I303 V304 I309 A310 F482	V302-L306 HydrophobicContact CG1-CD1 3.96Å; V302-L306 HydrophobicContact CG1-CG 4.39Å; V302-L306 WeakPolarHBondContact O-CB 3.44Å; V302-L306 WeakPolarHBondContact O-CG 3.16Å; V302-L306 PolarHBondContact O-N 2.88Å; I303-L306 PolarHBondContact O-N 2.85Å; V304-L306 PolarHBondContact O-N 2.97Å; L306-I309 PolarHBondContact O-N 3.49Å; L306-A310 WeakPolarHBondContact O-CB 3.15Å; L306-A310 PolarHBondContact O-N 2.76Å; L306-F482 HydrophobicContact CB-CE1 4.07Å; L306-F482 HydrophobicContact CB-CZ 4.21Å
307	S	88.1	Confident	87	Confident	5 Å²	5	45.3 Å²	45.3	4%	0.035	25%	0.25	C	S	.	.	H	α-helix	trans	-65.3	-41.2	176.6	82.3	0	0	0	0	112.5	I303 V304 G305 A310 T311	I303-S307 WeakPolarHBondContact O-CB 3.07Å; I303-S307 PolarHBondContact O-N 3.11Å; V304-S307 WeakPolarHBondContact CA-OG 3.46Å; V304-S307 WeakPolarHBondContact O-CB 3.34Å; V304-S307 PolarHBondContact O-N 2.68Å; V304-S307 VanDerWaalsContact O-N 3.14Å; V304-S307 PolarHBondContact O-OG 2.94Å; G305-S307 VanDerWaalsContact C-N 3.28Å; G305-S307 PolarHBondContact O-N 2.87Å; S307-A310 WeakPolarHBondContact O-CB 3.4Å; S307-A310 PolarHBondContact O-N 2.81Å; S307-T311 WeakPolarHBondContact O-CG2 3.39Å; S307-T311 PolarHBondContact O-N 2.82Å
308	V	87.9	Confident	87.1	Confident	23 Å²	23	46.1 Å²	46.1	14%	0.139	25%	0.254	C	S	.	.	H	α-helix	trans	-68.5	-37.6	177.3	175.2	0	0	0	0	111.2	G265 L269 V304 G305 A310 T311 V312	G265-V308 WeakPolarHBondContact O-CG2 3.34Å; L269-V308 HydrophobicContact CB-CG2 4.37Å; V304-V308 PolarHBondContact O-N 3.23Å; G305-V308 PolarHBondContact O-N 3.31Å; V308-A310 VanDerWaalsContact C-N 3.31Å; V308-A310 PolarHBondContact O-N 2.58Å; V308-T311 PolarHBondContact O-N 2.95Å; V308-T311 PolarHBondContact O-OG1 2.81Å; V308-V312 WeakPolarHBondContact O-CG2 3.34Å; V308-V312 PolarHBondContact O-N 2.74Å; V308-V312 VanDerWaalsContact O-N 3.15Å
309	I	90.2	Very high	87	Confident	104 Å²	104	49.3 Å²	49.3	53%	0.533	26%	0.261	S	S	.	.	H	α-helix	trans	-62.4	-41.7	172.2	-65	165.9	0	0	0	110.3	G305 L306 V312 L313	G305-I309 WeakPolarHBondContact O-CG1 3.45Å; G305-I309 PolarHBondContact O-N 2.85Å; G305-I309 VanDerWaalsContact O-N 3.16Å; L306-I309 PolarHBondContact O-N 3.49Å; I309-V312 PolarHBondContact O-N 2.86Å; I309-L313 HydrophobicContact CG2-CD1 4.41Å; I309-L313 WeakPolarHBondContact O-CG 3.47Å; I309-L313 PolarHBondContact O-N 2.96Å; I309-L313 VanDerWaalsContact O-N 3.14Å
310	A	89.4	Confident	86.7	Confident	14 Å²	14	50.6 Å²	50.6	12%	0.116	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-38.7	176.9	0	0	0	0	0	113.1	F252 L306 S307 V308 L313 V314 F482	F252-A310 HydrophobicContact CE1-CB 4.24Å; F252-A310 HydrophobicContact CZ-CB 4.28Å; L306-A310 WeakPolarHBondContact O-CB 3.15Å; L306-A310 PolarHBondContact O-N 2.76Å; S307-A310 WeakPolarHBondContact O-CB 3.4Å; S307-A310 PolarHBondContact O-N 2.81Å; V308-A310 VanDerWaalsContact C-N 3.31Å; V308-A310 PolarHBondContact O-N 2.58Å; A310-L313 PolarHBondContact O-N 2.79Å; A310-V314 WeakPolarHBondContact O-CG2 3.27Å; A310-V314 PolarHBondContact O-N 2.79Å; A310-F482 HydrophobicContact CB-CE2 3.88Å; A310-F482 HydrophobicContact CB-CZ 4.23Å
311	T	88.1	Confident	85.9	Confident	4 Å²	4	55.6 Å²	55.6	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-69.4	-32.8	177.7	58.7	0	0	0	0	112.6	V251 F252 S307 V308 V314 L315	V251-T311 HydrophobicContact CB-CG2 4.43Å; V251-T311 HydrophobicContact CG1-CG2 3.8Å; F252-T311 HydrophobicContact CD1-CG2 3.81Å; F252-T311 HydrophobicContact CE1-CG2 3.43Å; F252-T311 VanDerWaalsContact CE1-CG2 3.43Å; F252-T311 HydrophobicContact CZ-CG2 3.9Å; S307-T311 WeakPolarHBondContact O-CG2 3.39Å; S307-T311 PolarHBondContact O-N 2.82Å; V308-T311 PolarHBondContact O-N 2.95Å; V308-T311 PolarHBondContact O-OG1 2.81Å; T311-V314 PolarHBondContact O-N 2.7Å; T311-L315 WeakPolarHBondContact O-CB 3.4Å; T311-L315 PolarHBondContact O-N 2.03Å
312	V	88.2	Confident	84.6	Confident	73 Å²	73	55 Å²	55	44%	0.442	29%	0.293	S	S	.	.	H	α-helix	trans	-63	-44.5	170.4	172.4	0	0	0	0	111	V308 I309 L315 Q316	V308-V312 WeakPolarHBondContact O-CG2 3.34Å; V308-V312 PolarHBondContact O-N 2.74Å; V308-V312 VanDerWaalsContact O-N 3.15Å; I309-V312 PolarHBondContact O-N 2.86Å; V312-L315 PolarHBondContact O-N 3.13Å; V312-Q316 PolarHBondContact O-N 2.78Å
313	L	87.9	Confident	83.2	Confident	90 Å²	90	58.2 Å²	58.2	47%	0.471	31%	0.307	S	S	.	.	H	α-helix	trans	-64	-41.8	175.8	-68.6	171.3	0	0	0	112.3	I309 A310 L315 Q316 Y317	I309-L313 HydrophobicContact CG2-CD1 4.41Å; I309-L313 WeakPolarHBondContact O-CG 3.47Å; I309-L313 PolarHBondContact O-N 2.96Å; I309-L313 VanDerWaalsContact O-N 3.14Å; A310-L313 PolarHBondContact O-N 2.79Å; L313-L315 VanDerWaalsContact C-N 3.32Å; L313-L315 PolarHBondContact O-N 2.7Å; L313-Q316 PolarHBondContact O-N 3.39Å; L313-Y317 WeakPolarHBondContact O-CD2 3.38Å; L313-Y317 PolarHBondContact O-N 3.05Å
314	V	87.9	Confident	82	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.024	33%	0.331	C	S	.	.	H	α-helix	trans	-59	-43.5	173.2	166.8	0	0	0	0	111.1	A310 T311 Y317 H318 I474 D475	A310-V314 WeakPolarHBondContact O-CG2 3.27Å; A310-V314 PolarHBondContact O-N 2.79Å; T311-V314 PolarHBondContact O-N 2.7Å; V314-Y317 PolarHBondContact O-N 3.19Å; V314-H318 WeakPolarHBondContact O-CB 3.43Å; V314-H318 PolarHBondContact O-N 2.78Å; V314-I474 HydrophobicContact CG2-CB 4.22Å; V314-I474 HydrophobicContact CG2-CG2 3.68Å; V314-D475 HydrophobicContact CG1-CB 3.87Å; V314-D475 HydrophobicContact CG2-CB 4.34Å
315	L	86.1	Confident	80.9	Confident	34 Å²	34	61.8 Å²	61.8	18%	0.178	35%	0.347	C	S	.	.	H	α-helix	trans	-68	-35.9	179.7	-163.6	73.8	0	0	0	112.5	A256 I262 T311 V312 L313 Y317 H318 H319	A256-L315 HydrophobicContact CB-CD1 3.9Å; I262-L315 HydrophobicContact CD1-CD2 3.34Å; I262-L315 HydrophobicContact CG1-CD2 3.85Å; T311-L315 WeakPolarHBondContact O-CB 3.4Å; T311-L315 PolarHBondContact O-N 2.03Å; V312-L315 PolarHBondContact O-N 3.13Å; L313-L315 VanDerWaalsContact C-N 3.32Å; L313-L315 PolarHBondContact O-N 2.7Å; L315-Y317 VanDerWaalsContact C-N 3.35Å; L315-H318 PolarHBondContact O-N 2.9Å; L315-H319 PolarHBondContact O-N 3.34Å; L315-H319 PolarHBondContact O-ND1 3.1Å
316	Q	86.6	Confident	79.9	Confident	127 Å²	127	68.2 Å²	68.2	59%	0.593	37%	0.369	S	S	*	.	H	α-helix	trans	-65	-37	173.7	-171.6	-178.5	10.3	0	0	112	V312 L313 H320	V312-Q316 PolarHBondContact O-N 2.78Å; L313-Q316 PolarHBondContact O-N 3.39Å; Q316-H320 PolarHBondContact O-N 3.45Å
317	Y	82.8	Confident	79	Confident	85 Å²	85	64.7 Å²	64.7	33%	0.333	35%	0.35	S	S	.	.	H	α-helix	trans	-70.8	-31.2	171.3	-92.1	-106.8	0	0	0	112.7	L313 V314 L315 W467 I474	L313-Y317 WeakPolarHBondContact O-CD2 3.38Å; L313-Y317 PolarHBondContact O-N 3.05Å; V314-Y317 PolarHBondContact O-N 3.19Å; L315-Y317 VanDerWaalsContact C-N 3.35Å; Y317-W467 HydrophobicContact CD1-CE3 4Å; Y317-W467 AromaticContact CD1-CZ3 3.78Å; Y317-W467 HydrophobicContact CD1-CZ3 3.78Å; Y317-W467 HydrophobicContact CE1-CE3 4.42Å; Y317-W467 AromaticContact CE1-CZ3 3.76Å; Y317-W467 HydrophobicContact CE1-CZ3 3.76Å; Y317-I474 HydrophobicContact CD1-CD1 3.79Å; Y317-I474 HydrophobicContact CE1-CD1 4.11Å; Y317-I474 HydrophobicContact CG-CD1 4.04Å
318	H	85.1	Confident	78.5	Confident	17 Å²	17	67.1 Å²	67.1	8%	0.079	37%	0.366	C	S	.	.	H	α-helix	trans	-72.6	-37.2	179.3	-171.9	-95.8	0	0	0	113.2	A256 D257 V314 L315 A471	A256-H318 HydrophobicContact CB-CB 4.11Å; D257-H318 IonicContact OD1-CE1 2.69Å; D257-H318 PolarHBondContact OD1-CE1 3.42Å; D257-H318 IonicContact OD1-NE2 2.77Å; V314-H318 WeakPolarHBondContact O-CB 3.43Å; V314-H318 PolarHBondContact O-N 2.78Å; L315-H318 PolarHBondContact O-N 2.9Å; H318-A471 HydrophobicContact CB-CB 3.91Å
319	H	83.7	Confident	78	Confident	113 Å²	113	74.9 Å²	74.9	52%	0.523	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	34.9	-179.8	-61.4	97.6	0	0	0	112.1	L315	L315-H319 PolarHBondContact O-N 3.34Å; L315-H319 PolarHBondContact O-ND1 3.1Å
320	H	79.3	Confident	77.4	Confident	69 Å²	69	78.9 Å²	78.9	32%	0.319	41%	0.407	S	S	.	.			trans	-73.5	128.6	176.9	-168.6	62.8	0	0	0	110.9	Q316 W467	Q316-H320 PolarHBondContact O-N 3.45Å; H320-W467 HydrophobicContact CB-CD2 4.33Å; H320-W467 HydrophobicContact CB-CE3 4.42Å; H320-W467 AromaticContact CD2-CD2 3.89Å; H320-W467 AromaticContact CD2-CE2 3.41Å; H320-W467 VanDerWaalsContact CD2-CE2 3.41Å; H320-W467 AromaticContact CD2-CH2 3.82Å; H320-W467 AromaticContact CD2-CZ2 3.38Å; H320-W467 WeakPolarHBondContact CD2-CZ2 3.49Å; H320-W467 AromaticContact CD2-NE1 3.76Å; H320-W467 AromaticContact NE2-CH2 3.97Å; H320-W467 AromaticContact NE2-CZ2 3.64Å
321	D	67.1	Low	76.7	Confident	112 Å²	112	79 Å²	79	60%	0.599	41%	0.405	S	S	*	.			trans	-61	134.4	-178.4	-67.3	-63.5	0	0	0	111.9	D323 G324	D321-D323 VanDerWaalsContact C-N 3.26Å; D321-D323 PolarHBondContact O-N 3.46Å; D321-G324 PolarHBondContact O-N 3.33Å
322	P	59.4	Low	76.1	Confident	62 Å²	62	84.4 Å²	84.4	40%	0.403	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-63.2	-33.3	178.7	25.7	-33.5	0	0	0	112.3	G324	P322-G324 PolarHBondContact O-N 3.4Å
323	D	59.4	Low	75.4	Confident	160 Å²	160	85.4 Å²	85.4	86%	0.856	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-66.4	-16.9	173.5	-66.4	-57.8	0	0	0	113.4	D321 G325	D321-D323 VanDerWaalsContact C-N 3.26Å; D321-D323 PolarHBondContact O-N 3.46Å; D323-G325 PolarHBondContact O-N 2.89Å
324	G	60.6	Low	75	Confident	55 Å²	55	84.7 Å²	84.7	57%	0.567	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-66.4	-15.7	-177.6	0	0	0	0	0	114.9	D321 P322	D321-G324 PolarHBondContact O-N 3.33Å; P322-G324 PolarHBondContact O-N 3.4Å
325	G	63.4	Low	74.2	Confident	35 Å²	35	85.3 Å²	85.3	36%	0.361	43%	0.431	S	S	.	.			trans	114.6	160.9	171.7	0	0	0	0	0	114.9	D323 M327	D323-G325 PolarHBondContact O-N 2.89Å; G325-M327 PolarHBondContact O-N 2.81Å
326	K	66.8	Low	73.2	Confident	155 Å²	155	84.3 Å²	84.3	67%	0.674	43%	0.425	S	S	*	.	S	Bend	trans	-71.9	127.2	-173.4	-56.3	-163.3	178.2	-159.4	0	110.8	E459	K326-E459 IonicContact NZ-OE2 3.8Å; K326-E459 PolarHBondContact NZ-OE2 2.94Å
327	M	70.3	Confident	72.4	Confident	17 Å²	17	83.8 Å²	83.8	8%	0.084	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-47.1	130.5	-172.2	-178.1	162.9	47.4	0	0	112.8	G325 K329 T331 R332 L336 E466 W467 A470	G325-M327 PolarHBondContact O-N 2.81Å; M327-K329 PolarHBondContact O-N 3.33Å; M327-T331 HydrophobicContact CG-CG2 4.2Å; M327-T331 HydrophobicContact SD-CG2 3.98Å; M327-R332 HydrophobicContact CE-CG 4.21Å; M327-L336 HydrophobicContact CE-CD1 3.63Å; M327-E466 HydrophobicContact CE-CB 4.49Å; M327-W467 HydrophobicContact CB-CD2 4.4Å; M327-W467 HydrophobicContact CB-CH2 3.95Å; M327-W467 HydrophobicContact CB-CZ2 3.57Å; M327-W467 HydrophobicContact CB-CZ3 4.5Å; M327-W467 HydrophobicContact CG-CH2 3.85Å; M327-W467 HydrophobicContact CG-CZ2 4.01Å; M327-W467 HydrophobicContact CG-CZ3 4.1Å; M327-W467 HydrophobicContact SD-CD2 4.35Å; M327-W467 HydrophobicContact SD-CE3 3.95Å; M327-W467 HydrophobicContact SD-CH2 4.28Å; M327-W467 HydrophobicContact SD-CZ3 3.91Å; M327-A470 HydrophobicContact CE-CB 4.16Å; M327-A470 HydrophobicContact SD-CB 4.19Å
328	P	78.3	Confident	71.9	Confident	57 Å²	57	87.8 Å²	87.8	37%	0.37	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-56.9	139.6	-173.7	-26.8	34.5	0	0	0	113.3	W330 T331 R332	P328-W330 HydrophobicContact CB-CG 4.49Å; P328-W330 VanDerWaalsContact CB-NE1 3.32Å; P328-W330 PolarHBondContact O-N 3.09Å; P328-W330 VanDerWaalsContact O-N 3.09Å; P328-T331 WeakPolarHBondContact O-CB 3.38Å; P328-T331 PolarHBondContact O-N 2.73Å; P328-T331 VanDerWaalsContact O-N 3.09Å; P328-R332 PolarHBondContact O-N 3.06Å
329	K	77.2	Confident	71.2	Confident	185 Å²	185	87.1 Å²	87.1	80%	0.804	44%	0.438	S	S	*	.	H	α-helix	trans	-56.1	-33.2	-172.6	-63.8	-179.1	-177.8	176.8	0	113.6	M327 V333	M327-K329 PolarHBondContact O-N 3.33Å; K329-V333 WeakPolarHBondContact O-CG2 3.38Å; K329-V333 PolarHBondContact O-N 2.64Å
330	W	78.4	Confident	70.5	Confident	189 Å²	189	82.1 Å²	82.1	72%	0.716	42%	0.416	S	S	*	.	H	α-helix	trans	-70.4	-51.9	176.6	60.5	-75.2	0	0	0	111.6	P328 R332 V333 I334	P328-W330 HydrophobicContact CB-CG 4.49Å; P328-W330 VanDerWaalsContact CB-NE1 3.32Å; P328-W330 PolarHBondContact O-N 3.09Å; P328-W330 VanDerWaalsContact O-N 3.09Å; W330-R332 VanDerWaalsContact C-N 3.25Å; W330-R332 PolarHBondContact O-N 3.16Å; W330-V333 PolarHBondContact O-N 2.89Å; W330-V333 VanDerWaalsContact O-N 3.11Å; W330-I334 HydrophobicContact CE3-CD1 4.11Å; W330-I334 WeakPolarHBondContact O-CG1 3.36Å; W330-I334 PolarHBondContact O-N 2.99Å
331	T	74.6	Confident	70.2	Confident	15 Å²	15	88.5 Å²	88.5	9%	0.092	44%	0.438	C	S	.	.	H	α-helix	trans	-52.9	-43	172.3	-41.8	0	0	0	0	111.8	M327 P328 V333 I334 L335	M327-T331 HydrophobicContact CG-CG2 4.2Å; M327-T331 HydrophobicContact SD-CG2 3.98Å; P328-T331 WeakPolarHBondContact O-CB 3.38Å; P328-T331 PolarHBondContact O-N 2.73Å; P328-T331 VanDerWaalsContact O-N 3.09Å; T331-V333 PolarHBondContact O-N 2.67Å; T331-I334 PolarHBondContact O-N 3.4Å; T331-L335 HydrophobicContact CG2-CD1 3.82Å; T331-L335 HydrophobicContact CG2-CG 4.37Å; T331-L335 PolarHBondContact O-N 2.8Å
332	R	75.3	Confident	70.6	Confident	119 Å²	119	89.7 Å²	89.7	45%	0.449	44%	0.438	S	S	.	.	H	α-helix	trans	-61.5	-41.9	178	-153.6	179.3	-161	-157.1	9.5	112.2	M327 P328 W330 L336 E466	M327-R332 HydrophobicContact CE-CG 4.21Å; P328-R332 PolarHBondContact O-N 3.06Å; W330-R332 VanDerWaalsContact C-N 3.25Å; W330-R332 PolarHBondContact O-N 3.16Å; R332-L336 HydrophobicContact CB-CD1 4.48Å; R332-L336 HydrophobicContact CG-CD1 3.52Å; R332-L336 WeakPolarHBondContact O-CB 3.37Å; R332-L336 PolarHBondContact O-N 2.85Å; R332-L336 VanDerWaalsContact O-N 3.15Å; R332-E466 IonicContact CZ-OE1 3.67Å; R332-E466 IonicContact CZ-OE2 3.18Å; R332-E466 IonicContact NE-OE1 2.79Å; R332-E466 IonicContact NE-OE2 3.13Å; R332-E466 PolarHBondContact NE-OE2 2.77Å; R332-E466 IonicContact NH2-OE1 2.78Å; R332-E466 PolarHBondContact NH2-OE1 2.8Å; R332-E466 IonicContact NH2-OE2 3.2Å; R332-E466 PolarHBondContact NH2-OE2 2.82Å
333	V	73.9	Confident	71.1	Confident	93 Å²	93	88.3 Å²	88.3	56%	0.564	43%	0.427	S	S	*	.	H	α-helix	trans	-72.4	-41.3	177.2	171.8	0	0	0	0	111.8	K329 W330 T331 N337 W338	K329-V333 WeakPolarHBondContact O-CG2 3.38Å; K329-V333 PolarHBondContact O-N 2.64Å; W330-V333 PolarHBondContact O-N 2.89Å; W330-V333 VanDerWaalsContact O-N 3.11Å; T331-V333 PolarHBondContact O-N 2.67Å; V333-N337 VanDerWaalsContact O-CB 3.23Å; V333-N337 WeakPolarHBondContact O-CB 3.32Å; V333-N337 PolarHBondContact O-N 2.8Å; V333-W338 PolarHBondContact O-N 2.97Å
334	I	78.3	Confident	71.6	Confident	76 Å²	76	91.9 Å²	91.9	39%	0.39	43%	0.428	S	S	.	.	I	π-helix	trans	-64.4	-53.9	-179.9	-66.2	166.2	0	0	0	110.2	W330 T331 W338 C339	W330-I334 HydrophobicContact CE3-CD1 4.11Å; W330-I334 WeakPolarHBondContact O-CG1 3.36Å; W330-I334 PolarHBondContact O-N 2.99Å; T331-I334 PolarHBondContact O-N 3.4Å; I334-W338 WeakPolarHBondContact O-CB 3.42Å; I334-W338 PolarHBondContact O-N 2.83Å; I334-C339 PolarHBondContact O-N 3.37Å; I334-C339 PolarHBondContact O-SG 2.98Å; I334-C339 VanDerWaalsContact O-SG 3.4Å
335	L	71.6	Confident	71.9	Confident	17 Å²	17	90.9 Å²	90.9	9%	0.089	41%	0.409	C	S	.	.	I	π-helix	trans	-76	-54.4	-174	-61	179.6	0	0	0	113	T331 N337 A340 A470 I474	T331-L335 HydrophobicContact CG2-CD1 3.82Å; T331-L335 HydrophobicContact CG2-CG 4.37Å; T331-L335 PolarHBondContact O-N 2.8Å; L335-N337 VanDerWaalsContact C-N 3.33Å; L335-N337 PolarHBondContact O-N 3.35Å; L335-A340 PolarHBondContact O-N 3.32Å; L335-A470 HydrophobicContact CD1-CB 3.91Å; L335-I474 HydrophobicContact CD1-CD1 3.84Å; L335-I474 HydrophobicContact CD1-CG1 4.03Å; L335-I474 HydrophobicContact CD2-CD1 4.43Å; L335-I474 HydrophobicContact CD2-CG1 3.79Å
336	L	66.3	Low	71.7	Confident	12 Å²	12	96.5 Å²	96.5	6%	0.063	42%	0.424	C	S	.	.	I	π-helix	trans	-79.3	-10.7	-172.2	-70.9	141.5	0	0	0	114.4	M327 R332 F469	M327-L336 HydrophobicContact CE-CD1 3.63Å; R332-L336 HydrophobicContact CB-CD1 4.48Å; R332-L336 HydrophobicContact CG-CD1 3.52Å; R332-L336 WeakPolarHBondContact O-CB 3.37Å; R332-L336 PolarHBondContact O-N 2.85Å; R332-L336 VanDerWaalsContact O-N 3.15Å; L336-F469 HydrophobicContact CD2-CD1 3.5Å; L336-F469 HydrophobicContact CD2-CE1 3.86Å; L336-F469 HydrophobicContact CG-CD1 4.49Å
337	N	68.2	Low	71.2	Confident	116 Å²	116	94.6 Å²	94.6	62%	0.62	41%	0.413	S	S	*	.	I	π-helix	trans	-120.8	-53.4	179.9	-155.6	40.2	0	0	0	112.3	V333 L335 W341	V333-N337 VanDerWaalsContact O-CB 3.23Å; V333-N337 WeakPolarHBondContact O-CB 3.32Å; V333-N337 PolarHBondContact O-N 2.8Å; L335-N337 VanDerWaalsContact C-N 3.33Å; L335-N337 PolarHBondContact O-N 3.35Å; N337-W341 WeakPolarHBondContact O-CB 3.3Å; N337-W341 PolarHBondContact O-N 3.17Å
338	W	74	Confident	70.1	Confident	169 Å²	169	98 Å²	98	64%	0.64	44%	0.436	S	S	*	.	I	π-helix	trans	-78.4	-55.3	-177.2	-168.4	76	0	0	0	112.5	V333 I334 W341 F342	V333-W338 PolarHBondContact O-N 2.97Å; I334-W338 WeakPolarHBondContact O-CB 3.42Å; I334-W338 PolarHBondContact O-N 2.83Å; W338-W341 PolarHBondContact O-N 2.9Å; W338-F342 WeakPolarHBondContact O-CB 3.46Å; W338-F342 PolarHBondContact O-N 3.11Å
339	C	69.6	Low	68.8	Low	3 Å²	3	99 Å²	99	2%	0.02	46%	0.456	C	S	.	.	I	π-helix	trans	-66.2	-41.7	179.1	-59.5	0	0	0	0	112.2	I334 W341 F342 L343 V473 L477	I334-C339 PolarHBondContact O-N 3.37Å; I334-C339 PolarHBondContact O-SG 2.98Å; I334-C339 VanDerWaalsContact O-SG 3.4Å; C339-W341 VanDerWaalsContact C-N 3.33Å; C339-W341 PolarHBondContact O-N 3.07Å; C339-F342 PolarHBondContact O-N 3.11Å; C339-L343 WeakPolarHBondContact O-CB 3.22Å; C339-L343 PolarHBondContact O-N 3.25Å; C339-V473 HydrophobicContact CB-CG1 3.53Å; C339-L477 HydrophobicContact CB-CD1 4.1Å; C339-L477 VanDerWaalsContact SG-CD1 3.56Å
340	A	68.1	Low	67.3	Low	8 Å²	8	95.5 Å²	95.5	7%	0.066	44%	0.443	C	S	.	.	H	α-helix	trans	-62.9	-36.5	177.3	0	0	0	0	0	113.1	L335 R344 M345 F469	L335-A340 PolarHBondContact O-N 3.32Å; A340-R344 PolarHBondContact O-N 3.22Å; A340-M345 PolarHBondContact O-N 3.14Å; A340-F469 HydrophobicContact CB-CE1 4.41Å
341	W	72.9	Confident	65.2	Low	204 Å²	204	93 Å²	93	77%	0.773	44%	0.443	S	S	*	.	H	α-helix	trans	-67.1	-46.9	172.7	177.2	84.9	0	0	0	111.6	N337 W338 C339 R344	N337-W341 WeakPolarHBondContact O-CB 3.3Å; N337-W341 PolarHBondContact O-N 3.17Å; W338-W341 PolarHBondContact O-N 2.9Å; C339-W341 VanDerWaalsContact C-N 3.33Å; C339-W341 PolarHBondContact O-N 3.07Å; W341-R344 PolarHBondContact O-N 2.84Å; W341-R344 VanDerWaalsContact O-N 3.08Å
342	F	76.5	Confident	63.4	Low	137 Å²	137	101.8 Å²	101.8	60%	0.601	48%	0.475	S	S	*	.	H	α-helix	trans	-61.4	-45	178.6	-179.8	-102.1	0	0	0	112.8	W338 C339 R344	W338-F342 WeakPolarHBondContact O-CB 3.46Å; W338-F342 PolarHBondContact O-N 3.11Å; C339-F342 PolarHBondContact O-N 3.11Å; F342-R344 PolarHBondContact O-N 3Å
343	L	69.3	Low	61.7	Low	32 Å²	32	102.8 Å²	102.8	17%	0.168	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-1.8	175.5	-68.7	166.2	0	0	0	113.5	C339 M345 V473 R476 L477 M480	C339-L343 WeakPolarHBondContact O-CB 3.22Å; C339-L343 PolarHBondContact O-N 3.25Å; L343-M345 HydrophobicContact CB-CG 3.92Å; L343-M345 HydrophobicContact CB-SD 3.98Å; L343-M345 HydrophobicContact CD1-SD 4.15Å; L343-M345 PolarHBondContact O-N 2.83Å; L343-M345 VanDerWaalsContact O-N 3.14Å; L343-V473 HydrophobicContact CD1-CG1 4.1Å; L343-V473 VanDerWaalsContact CD1-O 3.28Å; L343-V473 WeakPolarHBondContact CD1-O 3.35Å; L343-R476 HydrophobicContact CD1-CB 4.07Å; L343-R476 HydrophobicContact CD2-CB 4.22Å; L343-L477 HydrophobicContact CD1-CB 4.11Å; L343-M480 HydrophobicContact CD2-CG 3.89Å
344	R	69.5	Low	59.5	Low	235 Å²	235	109.7 Å²	109.7	89%	0.887	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	28.9	178.3	-150.5	174	-175.8	176.2	0.9	113.8	A340 W341 F342	A340-R344 PolarHBondContact O-N 3.22Å; W341-R344 PolarHBondContact O-N 2.84Å; W341-R344 VanDerWaalsContact O-N 3.08Å; F342-R344 PolarHBondContact O-N 3Å
345	M	68.4	Low	57.2	Low	34 Å²	34	111 Å²	111	17%	0.167	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-83.5	125.8	-177.4	-66.4	176	76.8	0	0	110.5	A340 L343 R347 F469 V473 R476	A340-M345 PolarHBondContact O-N 3.14Å; L343-M345 HydrophobicContact CB-CG 3.92Å; L343-M345 HydrophobicContact CB-SD 3.98Å; L343-M345 HydrophobicContact CD1-SD 4.15Å; L343-M345 PolarHBondContact O-N 2.83Å; L343-M345 VanDerWaalsContact O-N 3.14Å; M345-R347 PolarHBondContact O-N 2.96Å; M345-F469 HydrophobicContact CB-CZ 4.28Å; M345-F469 HydrophobicContact CE-CE2 4.48Å; M345-V473 HydrophobicContact CE-CG2 4.33Å; M345-V473 HydrophobicContact SD-CG2 3.97Å; M345-R476 HydrophobicContact SD-CB 4.36Å; M345-R476 HydrophobicContact SD-CG 4.44Å
346	K	58.5	Low	55.5	Low	154 Å²	154	115 Å²	115	67%	0.67	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-73	126.1	177.3	-156.4	-172.8	-178.6	-156.3	0	109.4
347	R	55.4	Low	53.8	Low	115 Å²	115	119.5 Å²	119.5	43%	0.434	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-67.8	134.3	-179.3	-169.7	178.8	-179.8	162.9	-0.6	110.8	M345 G349 E466	M345-R347 PolarHBondContact O-N 2.96Å; R347-G349 PolarHBondContact O-N 3.34Å; R347-E466 IonicContact CZ-OE1 3.43Å; R347-E466 IonicContact NH2-OE1 3.14Å; R347-E466 PolarHBondContact NH2-OE1 2.9Å
348	P	48.9	Very low	51.9	Low	88 Å²	88	122.9 Å²	122.9	57%	0.571	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	135.7	169.3	-22.2	32.8	0	0	0	110.3	F469	P348-F469 VanDerWaalsContact CD-CE2 3.46Å; P348-F469 HydrophobicContact CG-CD2 3.66Å; P348-F469 HydrophobicContact CG-CE2 4.14Å; P348-F469 HydrophobicContact CG-CG 4.23Å
349	G	50.9	Low	50	Low	77 Å²	77	121.7 Å²	121.7	79%	0.794	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	93.1	3	177.9	0	0	0	0	0	117	R347 D351	R347-G349 PolarHBondContact O-N 3.34Å; G349-D351 PolarHBondContact O-N 2.96Å
350	E	44.5	Very low	48.1	Very low	112 Å²	112	130.4 Å²	130.4	52%	0.523	65%	0.648	S	S	.	*			trans	-85.6	16.9	167.7	-142.6	-155.1	148.4	0	0	114.3	R352	E350-R352 VanDerWaalsContact C-N 3.27Å; E350-R352 PolarHBondContact O-N 2.89Å; E350-R352 IonicContact OE1-NE 3.92Å; E350-R352 IonicContact OE1-NH2 3.59Å
351	D	34.4	Very low	46.2	Very low	136 Å²	136	135.7 Å²	135.7	73%	0.727	68%	0.68	S	S	*	*	S	Bend	trans	-74.2	90.9	156.7	-75.1	-33	0	0	0	108.2	G349 V353	G349-D351 PolarHBondContact O-N 2.96Å; D351-V353 PolarHBondContact O-N 3.33Å
352	R	36.5	Very low	44	Very low	201 Å²	201	136.8 Å²	136.8	76%	0.758	68%	0.684	S	S	*	*			trans	-51.7	114.6	-178.8	-61.9	178.8	-175.1	-177.8	0.6	110.2	E350 R354	E350-R352 VanDerWaalsContact C-N 3.27Å; E350-R352 PolarHBondContact O-N 2.89Å; E350-R352 IonicContact OE1-NE 3.92Å; E350-R352 IonicContact OE1-NH2 3.59Å; R352-R354 PolarHBondContact O-N 2.75Å
353	V	39.4	Very low	41.6	Very low	140 Å²	140	141.9 Å²	141.9	85%	0.848	70%	0.699	S	S	*	*			trans	-53.3	104.3	159.7	176.9	0	0	0	0	106.9	D351 S355	D351-V353 PolarHBondContact O-N 3.33Å; V353-S355 VanDerWaalsContact C-N 3.29Å; V353-S355 PolarHBondContact O-N 3.01Å
354	R	28.4	Very low	39.4	Very low	237 Å²	237	145 Å²	145	89%	0.894	72%	0.724	S	S	*	*			trans	-67.7	91.8	177.1	-92.7	-177.2	165.5	174.5	-3.2	107.8	R352 A356	R352-R354 PolarHBondContact O-N 2.75Å; R354-A356 PolarHBondContact O-N 2.78Å
355	S	30.2	Very low	37.2	Very low	104 Å²	104	139.5 Å²	139.5	73%	0.727	72%	0.721	S	S	*	*			trans	-54.3	110.3	173.2	-176.7	0	0	0	0	109.4	V353 C357	V353-S355 VanDerWaalsContact C-N 3.29Å; V353-S355 PolarHBondContact O-N 3.01Å; S355-C357 PolarHBondContact O-N 3.19Å
356	A	35.1	Very low	35.3	Very low	102 Å²	102	145.5 Å²	145.5	84%	0.843	75%	0.753	S	S	*	*	S	Bend	trans	-80.9	57.1	-171.1	0	0	0	0	0	111.8	R354	R354-A356 PolarHBondContact O-N 2.78Å
357	C	31.8	Very low	33.7	Very low	106 Å²	106	144.4 Å²	144.4	72%	0.716	76%	0.759	S	S	*	*			trans	-150.1	75.3	177.4	-100.7	0	0	0	0	112.4	S355 N359	S355-C357 PolarHBondContact O-N 3.19Å; C357-N359 PolarHBondContact O-N 3.35Å
358	H	28.5	Very low	32.3	Very low	187 Å²	187	143.9 Å²	143.9	87%	0.866	77%	0.773	S	S	*	*			trans	-97.4	58.4	166.9	-140.7	-64.1	0	0	0	111.4	K360	H358-K360 PolarHBondContact O-N 3.46Å
359	N	33.2	Very low	31.3	Very low	143 Å²	143	147.4 Å²	147.4	77%	0.765	78%	0.784	S	S	*	*			trans	-83.1	105.4	-175.1	-161.9	-0	0	0	0	111	C357	C357-N359 PolarHBondContact O-N 3.35Å
360	K	28.9	Very low	30.1	Very low	186 Å²	186	149.4 Å²	149.4	81%	0.809	78%	0.777	S	S	*	*			trans	-150.5	78.4	178.5	-153.2	173.6	-170.7	178.2	0	114	H358	H358-K360 PolarHBondContact O-N 3.46Å
361	T	28.1	Very low	29.4	Very low	120 Å²	120	151 Å²	151	74%	0.736	79%	0.788	S	S	*	*			trans	-68	158.5	159.8	39.5	0	0	0	0	111.1
362	R	27.9	Very low	29	Very low	227 Å²	227	151.6 Å²	151.6	86%	0.857	79%	0.791	S	S	*	*			cis	-169.5	134.6	-18.1	171.4	-173.9	-170.3	-162.6	5.8	108.1
363	R	25.2	Very low	28.6	Very low	243 Å²	243	145.8 Å²	145.8	92%	0.917	79%	0.786	S	S	*	*			trans	-172.5	138.9	157.4	-102.7	177.4	-174.1	174.1	2.9	108.4
364	S	23.4	Very low	28	Very low	98 Å²	98	144.5 Å²	144.5	69%	0.685	78%	0.783	S	S	*	*			cis	161.3	101.3	-34.3	49.6	0	0	0	0	107.5
365	S	23.7	Very low	28	Very low	119 Å²	119	137.9 Å²	137.9	83%	0.832	77%	0.774	S	S	*	*			trans	-161.7	144.3	161.6	49.3	0	0	0	0	109.5
366	L	27.7	Very low	27.7	Very low	161 Å²	161	137.9 Å²	137.9	84%	0.843	77%	0.773	S	S	*	*			trans	-86.7	157.3	-177.6	-56.3	85.7	0	0	0	111.3
367	T	25.5	Very low	27.3	Very low	130 Å²	130	141.5 Å²	141.5	80%	0.798	78%	0.777	S	S	*	*				173.9	147.9	111	35.5	0	0	0	0	112.4
368	S	25.6	Very low	26.9	Very low	104 Å²	104	141.5 Å²	141.5	73%	0.727	78%	0.778	S	S	*	*			trans	60.6	132.9	165.8	37.5	0	0	0	0	117.7
369	M	27.7	Very low	26.7	Very low	162 Å²	162	141.6 Å²	141.6	80%	0.798	78%	0.779	S	S	*	*				69.6	125	53.1	-62.4	175.3	84.4	0	0	111.5
370	D	26.3	Very low	26.3	Very low	119 Å²	119	139.3 Å²	139.3	64%	0.636	77%	0.774	S	S	*	*			cis	-150.6	173.2	10.3	-95.3	-36.3	0	0	0	114.2
371	L	29.7	Very low	26.1	Very low	146 Å²	146	136.9 Å²	136.9	76%	0.764	78%	0.775	S	S	*	*			trans	6.3	143	144.8	-57.3	160.6	0	0	0	117.6
372	N	27	Very low	26.1	Very low	149 Å²	149	138.8 Å²	138.8	80%	0.797	78%	0.78	S	S	*	*			cis	-167	-171.1	20.4	-140.6	-9.3	0	0	0	108.8
373	A	27.8	Very low	26	Very low	79 Å²	79	131.9 Å²	131.9	65%	0.653	78%	0.78	S	S	*	*			cis	-157.8	-150.4	2.2	0	0	0	0	0	111.8
374	S	27.3	Very low	26.1	Very low	112 Å²	112	128.5 Å²	128.5	78%	0.783	77%	0.774	S	S	*	*			trans	-67.1	169	172.2	52.2	0	0	0	0	115.4
375	S	28	Very low	26.3	Very low	99 Å²	99	131.4 Å²	131.4	69%	0.692	78%	0.779	S	S	*	*			cis	-151.1	130.4	22.4	49	0	0	0	0	110.8
376	S	23.5	Very low	26.4	Very low	103 Å²	103	131.5 Å²	131.5	72%	0.72	77%	0.769	S	S	*	*				60.2	109.2	71.2	76.9	0	0	0	0	117.1
377	I	26.1	Very low	26.5	Very low	179 Å²	179	134.1 Å²	134.1	92%	0.918	77%	0.769	S	S	*	*			trans	-167.1	153.7	136.6	-101.6	158.6	0	0	0	109.1
378	S	23.4	Very low	26.7	Very low	106 Å²	106	133.6 Å²	133.6	74%	0.741	77%	0.766	S	S	*	*			trans	-147.6	143.9	-166.7	54	0	0	0	0	114.4
379	Q	25.8	Very low	26.8	Very low	189 Å²	189	131.9 Å²	131.9	88%	0.883	76%	0.764	S	S	*	*			trans	-172.2	133.7	163.4	-104	153.4	32.2	0	0	106.6
380	S	23.1	Very low	27	Very low	94 Å²	94	130.9 Å²	130.9	66%	0.657	77%	0.767	S	S	*	*			cis	66.7	118.9	31.6	-158.9	0	0	0	0	111.8
381	T	26.2	Very low	27.2	Very low	136 Å²	136	136.7 Å²	136.7	83%	0.834	78%	0.78	S	S	*	*				-141.4	176.1	61.2	47.3	0	0	0	0	116.4
382	N	26.6	Very low	27	Very low	159 Å²	159	133.4 Å²	133.4	85%	0.85	78%	0.782	S	S	*	*			trans	-84.7	157.9	-168.4	-58.3	-46.7	0	0	0	116.2
383	G	26.9	Very low	27.1	Very low	82 Å²	82	134.8 Å²	134.8	85%	0.845	79%	0.788	S	S	*	*			trans	-140.5	139.8	150.4	0	0	0	0	0	108.9
384	H	27.5	Very low	27.2	Very low	173 Å²	173	140 Å²	140	80%	0.801	80%	0.799	S	S	*	*			trans	-124.7	174.8	-162.4	-179.7	-100.6	0	0	0	113.1
385	M	27.5	Very low	27.1	Very low	158 Å²	158	139.7 Å²	139.7	78%	0.778	80%	0.797	S	S	*	*			trans	97.9	126.3	160.3	-150.5	162.8	-173.9	0	0	114.6
386	L	26.4	Very low	27	Very low	121 Å²	121	141.7 Å²	141.7	63%	0.634	80%	0.799	S	S	*	*			cis	-157.1	152.7	-6.9	-132.3	175.1	0	0	0	109.7
387	Y	27.9	Very low	27.1	Very low	216 Å²	216	146 Å²	146	85%	0.847	81%	0.807	S	S	*	*			trans	-137.4	140.8	157.1	-169.5	-92.5	0	0	0	109.8	G389	Y387-G389 PolarHBondContact O-N 2.54Å
388	V	30.2	Very low	27	Very low	120 Å²	120	143.2 Å²	143.2	73%	0.727	80%	0.802	S	S	*	*			trans	-94.1	100.1	-172.2	179.8	0	0	0	0	110.3
389	G	29.1	Very low	27	Very low	67 Å²	67	143.4 Å²	143.4	69%	0.691	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-89.1	125.5	168.8	0	0	0	0	0	111.7	Y387	Y387-G389 PolarHBondContact O-N 2.54Å
390	V	31.3	Very low	26.9	Very low	141 Å²	141	141 Å²	141	86%	0.855	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71.4	143.7	173.4	177.9	0	0	0	0	110
391	R	29.1	Very low	27.2	Very low	241 Å²	241	141.1 Å²	141.1	91%	0.909	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-60.7	140	-177.4	-76.5	-177.1	170.4	-176.1	-3.7	112.6
392	G	26.4	Very low	27.3	Very low	78 Å²	78	139.5 Å²	139.5	80%	0.804	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-75.8	159.8	158.2	0	0	0	0	0	112.2
393	L	30.2	Very low	27.4	Very low	177 Å²	177	137.8 Å²	137.8	93%	0.927	80%	0.804	S	S	*	*			trans	-108.9	134.2	166.7	-176.4	67.6	0	0	0	107.9
394	E	28.4	Very low	27.4	Very low	188 Å²	188	139.4 Å²	139.4	88%	0.879	80%	0.802	S	S	*	*			trans	-76.7	150.5	179.9	-57.8	178.7	122.9	0	0	111.6
395	S	25.1	Very low	27.9	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	80%	0.801	S	S	*	*				179.3	169.1	109.7	-156.6	0	0	0	0	113.3
396	I	26.6	Very low	27.9	Very low	142 Å²	142	137 Å²	137	73%	0.728	81%	0.805	S	S	*	*			trans	62.2	97	164.7	-57.9	142.6	0	0	0	116.4	C398	I396-C398 HydrophobicContact CG2-CB 4.43Å
397	H	24.6	Very low	28	Very low	193 Å²	193	137 Å²	137	89%	0.894	82%	0.815	S	S	*	*			trans	-82.8	136.2	137	-91.7	45.9	0	0	0	109
398	C	24.4	Very low	28	Very low	121 Å²	121	130.1 Å²	130.1	82%	0.818	81%	0.81	S	S	*	*			trans	-144.8	129.7	152.2	-157.4	0	0	0	0	108.3	I396	I396-C398 HydrophobicContact CG2-CB 4.43Å
399	S	24.1	Very low	28.1	Very low	110 Å²	110	131 Å²	131	77%	0.769	82%	0.816	S	S	*	*			trans	-116.5	136.6	-169.8	46.4	0	0	0	0	111.4
400	T	24.5	Very low	28	Very low	138 Å²	138	135.9 Å²	135.9	85%	0.847	83%	0.825	S	S	*	*			trans	-135.2	104.1	171.3	-41.9	0	0	0	0	109.8
401	A	28.2	Very low	28.1	Very low	97 Å²	97	134.2 Å²	134.2	80%	0.802	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-83.8	125.2	161.5	0	0	0	0	0	108.2
402	A	28.7	Very low	28.1	Very low	101 Å²	101	127 Å²	127	84%	0.835	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-79	132.7	177.2	0	0	0	0	0	111.1
403	T	28.2	Very low	28.2	Very low	124 Å²	124	133.8 Å²	133.8	76%	0.761	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-99.1	132.7	171.6	47.5	0	0	0	0	111.5
404	S	27.2	Very low	28.2	Very low	115 Å²	115	133.9 Å²	133.9	80%	0.804	82%	0.82	S	S	*	*			trans	65.3	153.4	167.5	66.2	0	0	0	0	117.8
405	P	39.1	Very low	28.3	Very low	118 Å²	118	132.7 Å²	132.7	77%	0.766	82%	0.818	S	S	*	*			trans	-95.8	147.7	174.9	36.6	-31.4	0	0	0	112
406	D	25.4	Very low	28.5	Very low	162 Å²	162	131.2 Å²	131.2	87%	0.866	82%	0.82	S	S	*	*			trans	-161.6	141	135.4	-130	-24.5	0	0	0	113.7
407	S	29.7	Very low	28.5	Very low	122 Å²	122	136.5 Å²	136.5	85%	0.853	83%	0.831	S	S	*	*			trans	54.8	170.7	163.6	-152.4	0	0	0	0	120.6
408	G	28.6	Very low	28.7	Very low	71 Å²	71	132.2 Å²	132.2	73%	0.732	83%	0.828	S	S	*	*			trans	98.5	83.3	159.8	0	0	0	0	0	118.6
409	V	31.3	Very low	29	Very low	140 Å²	140	129.9 Å²	129.9	85%	0.848	83%	0.825	S	S	*	*			trans	-76.6	130.2	167	174	0	0	0	0	111.5
410	L	28	Very low	29.3	Very low	169 Å²	169	133.5 Å²	133.5	89%	0.885	83%	0.83	S	S	*	*			trans	-163.9	159.4	130.2	-137.7	80.9	0	0	0	113.8
411	C	32.6	Very low	29.6	Very low	106 Å²	106	134.7 Å²	134.7	72%	0.716	83%	0.831	S	S	*	*			trans	-109.1	129	176.2	-178.8	0	0	0	0	110.7
412	G	28	Very low	29.8	Very low	88 Å²	88	138.2 Å²	138.2	91%	0.907	83%	0.831	S	S	*	*			trans	-100	87.2	177.6	0	0	0	0	0	112.8
413	R	30	Very low	29.9	Very low	222 Å²	222	141.2 Å²	141.2	84%	0.838	83%	0.832	S	S	*	*			trans	-110.4	121.1	178.1	-163.5	178.9	-170	-179.9	3.2	110.2	I415	R413-I415 PolarHBondContact O-N 2.85Å; R413-I415 VanDerWaalsContact O-N 3.12Å
414	L	29	Very low	30.1	Very low	178 Å²	178	141.8 Å²	141.8	93%	0.932	83%	0.83	S	S	*	*			trans	-66.5	106.2	-177.5	-81.9	164.5	0	0	0	112.7
415	I	30.9	Very low	30.4	Very low	163 Å²	163	143.4 Å²	143.4	84%	0.836	83%	0.829	S	S	*	*			trans	-140.7	124.4	152.7	-58.3	-177.8	0	0	0	106.2	R413	R413-I415 PolarHBondContact O-N 2.85Å; R413-I415 VanDerWaalsContact O-N 3.12Å
416	G	29.5	Very low	31.1	Very low	76 Å²	76	142.7 Å²	142.7	78%	0.784	82%	0.824	S	S	*	*			trans	-102.6	154.5	-177.8	0	0	0	0	0	113.8
417	R	27.1	Very low	31.3	Very low	253 Å²	253	140.5 Å²	140.5	96%	0.955	82%	0.822	S	S	*	*			trans	-154.1	158.6	157.4	-161.3	164	178.3	166.3	-0.3	110.7
418	A	28.8	Very low	31.4	Very low	102 Å²	102	139.7 Å²	139.7	84%	0.843	82%	0.816	S	S	*	*			trans	-62.2	159	-169.3	0	0	0	0	0	116.9
419	G	29.4	Very low	31.8	Very low	73 Å²	73	145.3 Å²	145.3	75%	0.753	82%	0.823	S	S	*	*			trans	-167.7	148.4	165.1	0	0	0	0	0	108
420	E	30.6	Very low	31.9	Very low	186 Å²	186	143.5 Å²	143.5	87%	0.869	82%	0.816	S	S	*	*			trans	-106.5	178.5	-164.6	-71.9	162.2	114.4	0	0	114.2
421	D	31.5	Very low	32.9	Very low	163 Å²	163	142 Å²	142	87%	0.872	82%	0.817	S	S	*	*			trans	96	147	159.8	-61.3	-25.8	0	0	0	122.1
422	E	32.8	Very low	33.6	Very low	170 Å²	170	141.2 Å²	141.2	79%	0.794	81%	0.812	S	S	*	*			trans	-88.4	157.1	-169.9	-54.1	175.3	54.9	0	0	113.7
423	L	30.5	Very low	34.5	Very low	164 Å²	164	143.8 Å²	143.8	86%	0.859	80%	0.803	S	S	*	*				-169.1	156.5	108.2	-150.7	57.8	0	0	0	113.8
424	L	31.7	Very low	35.7	Very low	137 Å²	137	135.7 Å²	135.7	72%	0.717	79%	0.788	S	S	*	*			trans	-81.5	164.2	-179.8	-55.3	178.6	0	0	0	111.8
425	L	33.7	Very low	37.1	Very low	149 Å²	149	135.1 Å²	135.1	78%	0.78	77%	0.774	S	S	*	*			cis	-177.4	-166.6	-6.6	-107.9	176.3	0	0	0	106.5
426	P	55.1	Low	38.4	Very low	102 Å²	102	133.9 Å²	133.9	66%	0.662	77%	0.767	S	S	*	*			cis	-132.8	-167.9	-27.7	35	-15.1	0	0	0	114.5
427	S	28.4	Very low	40.2	Very low	117 Å²	117	136.7 Å²	136.7	82%	0.818	76%	0.76	S	S	*	*			trans	87.4	144	161	83.3	0	0	0	0	117.5
428	S	31.7	Very low	42.2	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	74%	0.741	S	S	*	*			cis	-150	140.6	1.5	58.6	0	0	0	0	114.5
429	Q	37.4	Very low	44.4	Very low	189 Å²	189	129.6 Å²	129.6	88%	0.883	72%	0.723	S	S	*	*			trans	32.6	120.2	153.5	-61.8	-176.6	-1.5	0	0	122.1
430	S	34.4	Very low	46.8	Very low	101 Å²	101	131.4 Å²	131.4	71%	0.706	71%	0.714	S	S	*	*				-173.5	130.9	121.8	46.4	0	0	0	0	112.6
431	P	48.2	Very low	49.1	Very low	139 Å²	139	125.3 Å²	125.3	90%	0.903	70%	0.696	S	S	*	*			trans	-114.8	72.3	176.9	38.9	-28.9	0	0	0	112.7
432	S	46	Very low	51.5	Low	88 Å²	88	124.6 Å²	124.6	62%	0.615	69%	0.685	S	S	*	*			trans	-142.3	-26	177.3	57.9	0	0	0	0	115.4	G434	S432-G434 PolarHBondContact O-N 2.94Å
433	M	48.9	Very low	54	Low	143 Å²	143	121.5 Å²	121.5	70%	0.704	67%	0.673	S	S	*	*	H	α-helix	trans	-65.6	-40.4	-170	-161.3	142.5	65	0	0	113.7	Y435 M436 E437	M433-Y435 VanDerWaalsContact C-N 3.32Å; M433-Y435 PolarHBondContact O-N 2.92Å; M433-M436 PolarHBondContact O-N 3.45Å; M433-E437 PolarHBondContact O-N 3.38Å; M433-E437 VanDerWaalsContact O-N 3.1Å
434	G	54.9	Low	56.5	Low	51 Å²	51	117.5 Å²	117.5	53%	0.526	65%	0.652	S	S	.	*	H	α-helix	trans	-68.5	-19.8	-174.8	0	0	0	0	0	116	S432 L438	S432-G434 PolarHBondContact O-N 2.94Å; G434-L438 WeakPolarHBondContact O-CB 3.42Å; G434-L438 PolarHBondContact O-N 2.87Å
435	Y	57.2	Low	59.1	Low	166 Å²	166	115.8 Å²	115.8	65%	0.651	64%	0.643	S	S	*	*	H	α-helix	trans	-76.3	-44.8	176.2	-161.9	-83.8	0	0	0	111	M433 E437 L438 E439	M433-Y435 VanDerWaalsContact C-N 3.32Å; M433-Y435 PolarHBondContact O-N 2.92Å; Y435-E437 VanDerWaalsContact C-N 3.32Å; Y435-E437 PolarHBondContact O-N 3.08Å; Y435-L438 WeakPolarHBondContact O-CB 3.45Å; Y435-L438 PolarHBondContact O-N 2.71Å; Y435-L438 VanDerWaalsContact O-N 3.17Å; Y435-E439 HydrophobicContact CD1-CG 4.22Å; Y435-E439 HydrophobicContact CE1-CG 4.06Å; Y435-E439 PolarHBondContact O-N 2.88Å
436	M	58.3	Low	61.7	Low	137 Å²	137	114.2 Å²	114.2	68%	0.675	63%	0.632	S	S	*	*	H	α-helix	trans	-69.6	-31	178	-169.3	159.9	58	0	0	111.8	M433 L440	M433-M436 PolarHBondContact O-N 3.45Å; M436-L440 VanDerWaalsContact O-CB 3.26Å; M436-L440 WeakPolarHBondContact O-CB 3.21Å; M436-L440 PolarHBondContact O-N 3.3Å
437	E	66.8	Low	63.3	Low	135 Å²	135	113.6 Å²	113.6	63%	0.631	63%	0.626	S	S	*	*	H	α-helix	trans	-65.7	-37.6	169.9	-168.3	168.1	-151.8	0	0	112.2	M433 Y435 A441	M433-E437 PolarHBondContact O-N 3.38Å; M433-E437 VanDerWaalsContact O-N 3.1Å; Y435-E437 VanDerWaalsContact C-N 3.32Å; Y435-E437 PolarHBondContact O-N 3.08Å; E437-A441 WeakPolarHBondContact O-CB 3.41Å; E437-A441 PolarHBondContact O-N 2.96Å
438	L	71	Confident	66.1	Low	107 Å²	107	115.5 Å²	115.5	56%	0.56	62%	0.616	S	S	*	*	H	α-helix	trans	-69.8	-39.2	175.5	-163.9	80.1	0	0	0	112.8	G434 Y435 K442	G434-L438 WeakPolarHBondContact O-CB 3.42Å; G434-L438 PolarHBondContact O-N 2.87Å; Y435-L438 WeakPolarHBondContact O-CB 3.45Å; Y435-L438 PolarHBondContact O-N 2.71Å; Y435-L438 VanDerWaalsContact O-N 3.17Å; L438-K442 PolarHBondContact O-N 2.91Å; L438-K442 VanDerWaalsContact O-N 3.13Å
439	E	74.4	Confident	69	Low	100 Å²	100	117.2 Å²	117.2	47%	0.467	61%	0.607	S	S	.	*	H	α-helix	trans	-67.9	-43	173.7	-72.3	-172.8	129.1	0	0	111.7	Y435 A441 K442 I443	Y435-E439 HydrophobicContact CD1-CG 4.22Å; Y435-E439 HydrophobicContact CE1-CG 4.06Å; Y435-E439 PolarHBondContact O-N 2.88Å; E439-A441 VanDerWaalsContact C-N 3.31Å; E439-A441 PolarHBondContact O-N 2.84Å; E439-K442 PolarHBondContact O-N 2.85Å; E439-I443 WeakPolarHBondContact O-CG1 3.34Å; E439-I443 PolarHBondContact O-N 2.93Å
440	L	79.1	Confident	71.5	Confident	110 Å²	110	112.3 Å²	112.3	58%	0.576	59%	0.586	S	S	*	*	H	α-helix	trans	-61	-40.5	174.7	-176.2	63.3	0	0	0	111.6	M436 I443 L444	M436-L440 VanDerWaalsContact O-CB 3.26Å; M436-L440 WeakPolarHBondContact O-CB 3.21Å; M436-L440 PolarHBondContact O-N 3.3Å; L440-I443 PolarHBondContact O-N 3.11Å; L440-L444 VanDerWaalsContact O-CB 3.24Å; L440-L444 WeakPolarHBondContact O-CB 3.39Å; L440-L444 PolarHBondContact O-N 2.98Å
441	A	78.4	Confident	74.1	Confident	58 Å²	58	110.2 Å²	110.2	48%	0.479	57%	0.574	S	S	.	*	H	α-helix	trans	-61.2	-42.7	175	0	0	0	0	0	112.3	E437 E439 L444 D445	E437-A441 WeakPolarHBondContact O-CB 3.41Å; E437-A441 PolarHBondContact O-N 2.96Å; E439-A441 VanDerWaalsContact C-N 3.31Å; E439-A441 PolarHBondContact O-N 2.84Å; A441-L444 PolarHBondContact O-N 2.85Å; A441-D445 PolarHBondContact O-N 2.87Å
442	K	82.2	Confident	76.1	Confident	148 Å²	148	109.6 Å²	109.6	64%	0.643	56%	0.558	S	S	*	*	H	α-helix	trans	-63.1	-47.7	174.4	-77.4	-179	174.7	-179.5	0	112.5	L438 E439 L444 D445 E446	L438-K442 PolarHBondContact O-N 2.91Å; L438-K442 VanDerWaalsContact O-N 3.13Å; E439-K442 PolarHBondContact O-N 2.85Å; K442-L444 VanDerWaalsContact C-N 3.25Å; K442-L444 PolarHBondContact O-N 2.86Å; K442-D445 PolarHBondContact O-N 2.9Å; K442-D445 VanDerWaalsContact O-N 3.15Å; K442-E446 PolarHBondContact O-N 3.29Å
443	I	85.7	Confident	78.2	Confident	105 Å²	105	112.8 Å²	112.8	54%	0.538	56%	0.556	S	S	.	*	H	α-helix	trans	-60.4	-39.8	178.5	-67.1	164.2	0	0	0	110.4	E439 L440 D445 E446 V447	E439-I443 WeakPolarHBondContact O-CG1 3.34Å; E439-I443 PolarHBondContact O-N 2.93Å; L440-I443 PolarHBondContact O-N 3.11Å; I443-D445 VanDerWaalsContact C-N 3.34Å; I443-E446 PolarHBondContact O-N 2.83Å; I443-V447 WeakPolarHBondContact O-CB 3.42Å; I443-V447 VanDerWaalsContact O-CG2 3.28Å; I443-V447 WeakPolarHBondContact O-CG2 3.37Å; I443-V447 PolarHBondContact O-N 2.93Å
444	L	83.1	Confident	80.1	Confident	80 Å²	80	112.3 Å²	112.3	42%	0.419	55%	0.55	S	S	.	*	H	α-helix	trans	-69.2	-31.7	178.4	-166.2	148.8	0	0	0	112.3	L440 A441 K442 R448	L440-L444 VanDerWaalsContact O-CB 3.24Å; L440-L444 WeakPolarHBondContact O-CB 3.39Å; L440-L444 PolarHBondContact O-N 2.98Å; A441-L444 PolarHBondContact O-N 2.85Å; K442-L444 VanDerWaalsContact C-N 3.25Å; K442-L444 PolarHBondContact O-N 2.86Å; L444-R448 HydrophobicContact CD2-CG 4.37Å; L444-R448 VanDerWaalsContact CD2-NE 3.35Å; L444-R448 WeakPolarHBondContact O-CB 3.23Å; L444-R448 VanDerWaalsContact O-CG 3.28Å; L444-R448 WeakPolarHBondContact O-CG 3.35Å; L444-R448 PolarHBondContact O-N 3.37Å
445	D	85.8	Confident	81.7	Confident	101 Å²	101	115.9 Å²	115.9	54%	0.54	55%	0.548	S	S	.	.	H	α-helix	trans	-74.7	-39.8	174.3	-146.6	47.6	0	0	0	112.4	A441 K442 I443 R448 Y449	A441-D445 PolarHBondContact O-N 2.87Å; K442-D445 PolarHBondContact O-N 2.9Å; K442-D445 VanDerWaalsContact O-N 3.15Å; I443-D445 VanDerWaalsContact C-N 3.34Å; D445-R448 CarbonylContact O-C 3.57Å; D445-R448 WeakPolarHBondContact O-CB 3.34Å; D445-R448 PolarHBondContact O-N 3.47Å; D445-Y449 WeakPolarHBondContact O-CB 3.32Å; D445-Y449 PolarHBondContact O-N 2.95Å
446	E	88.3	Confident	82.9	Confident	117 Å²	117	110.4 Å²	110.4	55%	0.547	53%	0.53	S	S	.	.	H	α-helix	trans	-61	-43.6	170.1	-71.6	-67	169.1	0	0	111.7	K442 I443 R448 Y449 I450	K442-E446 PolarHBondContact O-N 3.29Å; I443-E446 PolarHBondContact O-N 2.83Å; E446-R448 VanDerWaalsContact C-N 3.32Å; E446-R448 PolarHBondContact O-N 2.73Å; E446-Y449 PolarHBondContact O-N 2.83Å; E446-I450 WeakPolarHBondContact O-CB 3.43Å; E446-I450 VanDerWaalsContact O-CG1 3.29Å; E446-I450 WeakPolarHBondContact O-CG1 3.36Å; E446-I450 PolarHBondContact O-N 3.22Å
447	V	89.9	Confident	84.1	Confident	88 Å²	88	107.9 Å²	107.9	53%	0.533	52%	0.517	S	S	.	.	H	α-helix	trans	-64.6	-36	174.7	169.5	0	0	0	0	111.5	I443 A451	I443-V447 WeakPolarHBondContact O-CB 3.42Å; I443-V447 VanDerWaalsContact O-CG2 3.28Å; I443-V447 WeakPolarHBondContact O-CG2 3.37Å; I443-V447 PolarHBondContact O-N 2.93Å; V447-A451 WeakPolarHBondContact O-CB 3.38Å; V447-A451 PolarHBondContact O-N 2.88Å
448	R	87.3	Confident	85	Confident	158 Å²	158	106.3 Å²	106.3	60%	0.596	51%	0.513	S	S	*	.	H	α-helix	trans	-66.2	-39.9	171.2	-79.9	171.6	175.2	166.1	2	112.3	L444 D445 E446 K452	L444-R448 HydrophobicContact CD2-CG 4.37Å; L444-R448 VanDerWaalsContact CD2-NE 3.35Å; L444-R448 WeakPolarHBondContact O-CB 3.23Å; L444-R448 VanDerWaalsContact O-CG 3.28Å; L444-R448 WeakPolarHBondContact O-CG 3.35Å; L444-R448 PolarHBondContact O-N 3.37Å; D445-R448 CarbonylContact O-C 3.57Å; D445-R448 WeakPolarHBondContact O-CB 3.34Å; D445-R448 PolarHBondContact O-N 3.47Å; E446-R448 VanDerWaalsContact C-N 3.32Å; E446-R448 PolarHBondContact O-N 2.73Å; R448-K452 WeakPolarHBondContact O-CB 3.4Å; R448-K452 PolarHBondContact O-N 2.88Å
449	Y	91.1	Very high	85.5	Confident	140 Å²	140	104.6 Å²	104.6	55%	0.549	50%	0.501	S	S	.	.	H	α-helix	trans	-65.1	-45.2	176.9	176.4	-109.3	0	0	0	111.3	D445 E446 K452 R453	D445-Y449 WeakPolarHBondContact O-CB 3.32Å; D445-Y449 PolarHBondContact O-N 2.95Å; E446-Y449 PolarHBondContact O-N 2.83Å; Y449-K452 PolarHBondContact O-N 2.87Å; Y449-R453 WeakPolarHBondContact O-CB 3.39Å; Y449-R453 PolarHBondContact O-N 3.29Å
450	I	90.4	Very high	85.8	Confident	87 Å²	87	104.1 Å²	104.1	45%	0.446	50%	0.502	S	S	.	.	H	α-helix	trans	-60.9	-50.9	173.6	-68.8	164.4	0	0	0	110.6	E446 K452 R453 F454	E446-I450 WeakPolarHBondContact O-CB 3.43Å; E446-I450 VanDerWaalsContact O-CG1 3.29Å; E446-I450 WeakPolarHBondContact O-CG1 3.36Å; E446-I450 PolarHBondContact O-N 3.22Å; I450-K452 VanDerWaalsContact C-N 3.32Å; I450-K452 PolarHBondContact O-N 2.79Å; I450-R453 PolarHBondContact O-N 3.49Å; I450-R453 VanDerWaalsContact O-N 3.17Å; I450-F454 HydrophobicContact CG2-CD2 3.74Å; I450-F454 HydrophobicContact CG2-CE2 3.79Å; I450-F454 WeakPolarHBondContact O-CD2 3.46Å; I450-F454 PolarHBondContact O-N 3.2Å
451	A	89.6	Confident	85.8	Confident	56 Å²	56	103.5 Å²	103.5	46%	0.463	50%	0.497	S	S	.	.	H	α-helix	trans	-62	-39.1	179.5	0	0	0	0	0	112.2	V447 R455	V447-A451 WeakPolarHBondContact O-CB 3.38Å; V447-A451 PolarHBondContact O-N 2.88Å; A451-R455 VanDerWaalsContact O-CB 3.24Å; A451-R455 WeakPolarHBondContact O-CB 3.32Å; A451-R455 PolarHBondContact O-N 3.26Å
452	K	89.5	Confident	85.9	Confident	127 Å²	127	104.9 Å²	104.9	55%	0.552	50%	0.499	S	S	*	.	H	α-helix	trans	-63.8	-47.6	172.6	-178.9	-178.8	172.9	-170.7	0	110.9	R448 Y449 I450 F454 R455 D456	R448-K452 WeakPolarHBondContact O-CB 3.4Å; R448-K452 PolarHBondContact O-N 2.88Å; Y449-K452 PolarHBondContact O-N 2.87Å; I450-K452 VanDerWaalsContact C-N 3.32Å; I450-K452 PolarHBondContact O-N 2.79Å; K452-F454 PolarHBondContact O-N 2.64Å; K452-R455 PolarHBondContact O-N 3.42Å; K452-R455 VanDerWaalsContact O-N 3.13Å; K452-D456 WeakPolarHBondContact CE-OD2 3.42Å; K452-D456 WeakPolarHBondContact CG-OD2 3.48Å; K452-D456 WeakPolarHBondContact O-CB 3.43Å; K452-D456 PolarHBondContact O-N 2.67Å
453	R	89.9	Confident	85.8	Confident	155 Å²	155	99 Å²	99	59%	0.585	48%	0.476	S	S	*	.	H	α-helix	trans	-60.9	-42.3	-179.7	-177.4	172.7	176.4	76.4	10.1	112.2	Y449 I450 Q457	Y449-R453 WeakPolarHBondContact O-CB 3.39Å; Y449-R453 PolarHBondContact O-N 3.29Å; I450-R453 PolarHBondContact O-N 3.49Å; I450-R453 VanDerWaalsContact O-N 3.17Å; R453-Q457 VanDerWaalsContact O-CB 3.32Å; R453-Q457 WeakPolarHBondContact O-CB 3.37Å; R453-Q457 PolarHBondContact O-N 3.49Å
454	F	88.4	Confident	85.4	Confident	132 Å²	132	96.2 Å²	96.2	58%	0.579	47%	0.465	S	S	*	.	H	α-helix	trans	-62.2	-44.7	172.1	-88.6	-71.7	0	0	0	112.1	I450 K452 D456 Q457 D458	I450-F454 HydrophobicContact CG2-CD2 3.74Å; I450-F454 HydrophobicContact CG2-CE2 3.79Å; I450-F454 WeakPolarHBondContact O-CD2 3.46Å; I450-F454 PolarHBondContact O-N 3.2Å; K452-F454 PolarHBondContact O-N 2.64Å; F454-D456 PolarHBondContact O-N 3.43Å; F454-Q457 PolarHBondContact O-N 3.35Å; F454-D458 PolarHBondContact O-N 3.46Å
455	R	88.4	Confident	85.3	Confident	127 Å²	127	97 Å²	97	48%	0.479	47%	0.469	S	S	.	.	H	α-helix	trans	-68.3	-33	-178.9	-165.5	-148.8	75.8	81.1	13.3	113.2	A451 K452 E459	A451-R455 VanDerWaalsContact O-CB 3.24Å; A451-R455 WeakPolarHBondContact O-CB 3.32Å; A451-R455 PolarHBondContact O-N 3.26Å; K452-R455 PolarHBondContact O-N 3.42Å; K452-R455 VanDerWaalsContact O-N 3.13Å; R455-E459 IonicContact CZ-OE1 2.87Å; R455-E459 IonicContact NH1-OE1 3.7Å; R455-E459 PolarHBondContact NH1-OE1 3.23Å; R455-E459 IonicContact NH2-OE1 3.96Å; R455-E459 PolarHBondContact NH2-OE1 2.88Å; R455-E459 PolarHBondContact O-N 2.83Å
456	D	84.1	Confident	85.2	Confident	51 Å²	51	93.8 Å²	93.8	27%	0.273	45%	0.451	S	S	.	.	H	α-helix	trans	-75.9	-38.7	175.6	-64.1	-7.8	0	0	0	109.8	K452 F454 E459 D460	K452-D456 WeakPolarHBondContact CE-OD2 3.42Å; K452-D456 WeakPolarHBondContact CG-OD2 3.48Å; K452-D456 WeakPolarHBondContact O-CB 3.43Å; K452-D456 PolarHBondContact O-N 2.67Å; F454-D456 PolarHBondContact O-N 3.43Å; D456-E459 WeakPolarHBondContact O-CB 3.33Å; D456-E459 PolarHBondContact O-N 3.41Å; D456-D460 PolarHBondContact O-N 2.84Å
457	Q	83.6	Confident	84.9	Confident	84 Å²	84	89 Å²	89	39%	0.393	43%	0.428	S	S	.	.	H	α-helix	trans	-62.2	-41.7	170.1	-178.1	179.8	-27.2	0	0	112.6	R453 F454 E459 D460 E461	R453-Q457 VanDerWaalsContact O-CB 3.32Å; R453-Q457 WeakPolarHBondContact O-CB 3.37Å; R453-Q457 PolarHBondContact O-N 3.49Å; F454-Q457 PolarHBondContact O-N 3.35Å; Q457-E459 VanDerWaalsContact C-N 3.3Å; Q457-E459 PolarHBondContact O-N 2.96Å; Q457-D460 PolarHBondContact O-N 3.04Å; Q457-E461 HydrophobicContact CG-CG 4.49Å; Q457-E461 PolarHBondContact NE2-OE1 3.35Å; Q457-E461 WeakPolarHBondContact O-CB 3.23Å; Q457-E461 PolarHBondContact O-N 2.84Å
458	D	84.8	Confident	84.6	Confident	102 Å²	102	88.3 Å²	88.3	55%	0.545	42%	0.418	S	S	.	.	H	α-helix	trans	-58.3	-41.5	172	-93.6	6.4	0	0	0	111.1	F454 T462	F454-D458 PolarHBondContact O-N 3.46Å; D458-T462 VanDerWaalsContact O-CG2 3.3Å; D458-T462 WeakPolarHBondContact O-CG2 3.41Å; D458-T462 PolarHBondContact O-N 3.08Å; D458-T462 PolarHBondContact O-OG1 2.68Å
459	E	81.8	Confident	84.4	Confident	70 Å²	70	81.9 Å²	81.9	33%	0.327	39%	0.394	S	S	.	.	H	α-helix	trans	-61.5	-46.2	174.8	-84.9	-166	-141.8	0	0	111.4	K326 R455 D456 Q457 T462 V463	K326-E459 IonicContact NZ-OE2 3.8Å; K326-E459 PolarHBondContact NZ-OE2 2.94Å; R455-E459 IonicContact CZ-OE1 2.87Å; R455-E459 IonicContact NH1-OE1 3.7Å; R455-E459 PolarHBondContact NH1-OE1 3.23Å; R455-E459 IonicContact NH2-OE1 3.96Å; R455-E459 PolarHBondContact NH2-OE1 2.88Å; R455-E459 PolarHBondContact O-N 2.83Å; D456-E459 WeakPolarHBondContact O-CB 3.33Å; D456-E459 PolarHBondContact O-N 3.41Å; Q457-E459 VanDerWaalsContact C-N 3.3Å; Q457-E459 PolarHBondContact O-N 2.96Å; E459-T462 PolarHBondContact O-N 2.94Å; E459-T462 PolarHBondContact O-OG1 2.9Å; E459-V463 WeakPolarHBondContact O-CG2 3.37Å; E459-V463 PolarHBondContact O-N 2.93Å
460	D	79.9	Confident	84.1	Confident	91 Å²	91	75.2 Å²	75.2	49%	0.487	37%	0.368	S	S	.	.	H	α-helix	trans	-66	-40.7	179.5	-64.8	-28.4	0	0	0	112.3	D456 Q457 T462 V463 C464	D456-D460 PolarHBondContact O-N 2.84Å; Q457-D460 PolarHBondContact O-N 3.04Å; D460-T462 PolarHBondContact O-N 3.45Å; D460-V463 PolarHBondContact O-N 3.48Å; D460-C464 WeakPolarHBondContact O-CB 3.43Å; D460-C464 PolarHBondContact O-N 3.33Å
461	E	80	Confident	83.8	Confident	97 Å²	97	71.1 Å²	71.1	45%	0.453	35%	0.347	S	S	.	.	H	α-helix	trans	-63.8	-38.9	173.6	-75.3	-171.6	-146.8	0	0	111.7	Q457 C464 N465	Q457-E461 HydrophobicContact CG-CG 4.49Å; Q457-E461 PolarHBondContact NE2-OE1 3.35Å; Q457-E461 WeakPolarHBondContact O-CB 3.23Å; Q457-E461 PolarHBondContact O-N 2.84Å; E461-C464 PolarHBondContact O-N 3.01Å; E461-N465 WeakPolarHBondContact O-CB 3.45Å; E461-N465 PolarHBondContact O-N 2.83Å; E461-N465 PolarHBondContact O-ND2 2.63Å
462	T	80	Confident	83.6	Confident	87 Å²	87	70.8 Å²	70.8	53%	0.534	34%	0.341	S	S	.	.	H	α-helix	trans	-67.3	-34.9	174.1	61.8	0	0	0	0	113	D458 E459 D460 E466	D458-T462 VanDerWaalsContact O-CG2 3.3Å; D458-T462 WeakPolarHBondContact O-CG2 3.41Å; D458-T462 PolarHBondContact O-N 3.08Å; D458-T462 PolarHBondContact O-OG1 2.68Å; E459-T462 PolarHBondContact O-N 2.94Å; E459-T462 PolarHBondContact O-OG1 2.9Å; D460-T462 PolarHBondContact O-N 3.45Å; T462-E466 PolarHBondContact O-N 3.32Å
463	V	79.6	Confident	83.4	Confident	25 Å²	25	64.7 Å²	64.7	15%	0.152	32%	0.315	C	S	.	.	H	α-helix	trans	-66.8	-46.4	174.5	170.6	0	0	0	0	110.8	E459 D460 N465 E466 W467	E459-V463 WeakPolarHBondContact O-CG2 3.37Å; E459-V463 PolarHBondContact O-N 2.93Å; D460-V463 PolarHBondContact O-N 3.48Å; V463-N465 VanDerWaalsContact C-N 3.33Å; V463-N465 PolarHBondContact O-N 3.36Å; V463-E466 PolarHBondContact O-N 3.27Å; V463-W467 VanDerWaalsContact O-CD1 3.25Å; V463-W467 PolarHBondContact O-N 2.91Å; V463-W467 VanDerWaalsContact O-N 3.11Å
464	C	78.6	Confident	83.2	Confident	45 Å²	45	59 Å²	59	30%	0.304	30%	0.295	S	S	.	.	H	α-helix	trans	-58.5	-44.2	175.5	-176.5	0	0	0	0	111.7	D460 E461 E466 W467 K468	D460-C464 WeakPolarHBondContact O-CB 3.43Å; D460-C464 PolarHBondContact O-N 3.33Å; E461-C464 PolarHBondContact O-N 3.01Å; C464-E466 VanDerWaalsContact C-N 3.35Å; C464-E466 PolarHBondContact O-N 2.95Å; C464-W467 PolarHBondContact O-N 3.43Å; C464-K468 WeakPolarHBondContact O-CG 3.32Å; C464-K468 PolarHBondContact O-N 2.59Å
465	N	80.8	Confident	83.3	Confident	96 Å²	96	53.3 Å²	53.3	51%	0.513	27%	0.271	S	S	.	.	H	α-helix	trans	-65.3	-32.4	177	-77.1	-55.1	0	0	0	113.5	E461 V463 F469	E461-N465 WeakPolarHBondContact O-CB 3.45Å; E461-N465 PolarHBondContact O-N 2.83Å; E461-N465 PolarHBondContact O-ND2 2.63Å; V463-N465 VanDerWaalsContact C-N 3.33Å; V463-N465 PolarHBondContact O-N 3.36Å; N465-F469 WeakPolarHBondContact O-CB 3.29Å; N465-F469 PolarHBondContact O-N 2.82Å
466	E	82.3	Confident	83.3	Confident	35 Å²	35	53.7 Å²	53.7	16%	0.164	27%	0.273	C	S	.	.	H	α-helix	trans	-67.4	-39.8	171	-80.5	-156.5	163.1	0	0	113	M327 R332 R347 T462 V463 C464 A470	M327-E466 HydrophobicContact CE-CB 4.49Å; R332-E466 IonicContact CZ-OE1 3.67Å; R332-E466 IonicContact CZ-OE2 3.18Å; R332-E466 IonicContact NE-OE1 2.79Å; R332-E466 IonicContact NE-OE2 3.13Å; R332-E466 PolarHBondContact NE-OE2 2.77Å; R332-E466 IonicContact NH2-OE1 2.78Å; R332-E466 PolarHBondContact NH2-OE1 2.8Å; R332-E466 IonicContact NH2-OE2 3.2Å; R332-E466 PolarHBondContact NH2-OE2 2.82Å; R347-E466 IonicContact CZ-OE1 3.43Å; R347-E466 IonicContact NH2-OE1 3.14Å; R347-E466 PolarHBondContact NH2-OE1 2.9Å; T462-E466 PolarHBondContact O-N 3.32Å; V463-E466 PolarHBondContact O-N 3.27Å; C464-E466 VanDerWaalsContact C-N 3.35Å; C464-E466 PolarHBondContact O-N 2.95Å; E466-A470 VanDerWaalsContact O-CB 3.27Å; E466-A470 WeakPolarHBondContact O-CB 3.49Å; E466-A470 PolarHBondContact O-N 3.12Å
467	W	82.8	Confident	83.5	Confident	17 Å²	17	54.2 Å²	54.2	6%	0.064	28%	0.275	C	S	.	.	H	α-helix	trans	-65.5	-44.6	175.2	-76.4	112.2	0	0	0	111.9	Y317 H320 M327 V463 C464 F469 A470 A471	Y317-W467 HydrophobicContact CD1-CE3 4Å; Y317-W467 AromaticContact CD1-CZ3 3.78Å; Y317-W467 HydrophobicContact CD1-CZ3 3.78Å; Y317-W467 HydrophobicContact CE1-CE3 4.42Å; Y317-W467 AromaticContact CE1-CZ3 3.76Å; Y317-W467 HydrophobicContact CE1-CZ3 3.76Å; H320-W467 HydrophobicContact CB-CD2 4.33Å; H320-W467 HydrophobicContact CB-CE3 4.42Å; H320-W467 AromaticContact CD2-CD2 3.89Å; H320-W467 AromaticContact CD2-CE2 3.41Å; H320-W467 VanDerWaalsContact CD2-CE2 3.41Å; H320-W467 AromaticContact CD2-CH2 3.82Å; H320-W467 AromaticContact CD2-CZ2 3.38Å; H320-W467 WeakPolarHBondContact CD2-CZ2 3.49Å; H320-W467 AromaticContact CD2-NE1 3.76Å; H320-W467 AromaticContact NE2-CH2 3.97Å; H320-W467 AromaticContact NE2-CZ2 3.64Å; M327-W467 HydrophobicContact CB-CD2 4.4Å; M327-W467 HydrophobicContact CB-CH2 3.95Å; M327-W467 HydrophobicContact CB-CZ2 3.57Å; M327-W467 HydrophobicContact CB-CZ3 4.5Å; M327-W467 HydrophobicContact CG-CH2 3.85Å; M327-W467 HydrophobicContact CG-CZ2 4.01Å; M327-W467 HydrophobicContact CG-CZ3 4.1Å; M327-W467 HydrophobicContact SD-CD2 4.35Å; M327-W467 HydrophobicContact SD-CE3 3.95Å; M327-W467 HydrophobicContact SD-CH2 4.28Å; M327-W467 HydrophobicContact SD-CZ3 3.91Å; V463-W467 VanDerWaalsContact O-CD1 3.25Å; V463-W467 PolarHBondContact O-N 2.91Å; V463-W467 VanDerWaalsContact O-N 3.11Å; C464-W467 PolarHBondContact O-N 3.43Å; W467-F469 PolarHBondContact O-N 2.98Å; W467-A470 WeakPolarHBondContact O-CB 3.45Å; W467-A470 PolarHBondContact O-N 2.98Å; W467-A471 PolarHBondContact O-N 3.05Å
468	K	83.9	Confident	83.7	Confident	73 Å²	73	51.1 Å²	51.1	32%	0.317	26%	0.262	S	S	.	.	H	α-helix	trans	-61	-42.4	175	-70.1	-172.2	175.5	-163.4	0	112.6	D257 C464 A471 S472	D257-K468 IonicContact OD1-NZ 3.84Å; C464-K468 WeakPolarHBondContact O-CG 3.32Å; C464-K468 PolarHBondContact O-N 2.59Å; K468-A471 PolarHBondContact O-N 2.64Å; K468-S472 PolarHBondContact O-N 2.77Å
469	F	83.7	Confident	84	Confident	23 Å²	23	47.7 Å²	47.7	10%	0.101	24%	0.244	C	C	.	.	H	α-helix	trans	-66	-41	174.3	-176.9	-97.6	0	0	0	111.9	L336 A340 M345 P348 N465 W467 A471 S472 V473	L336-F469 HydrophobicContact CD2-CD1 3.5Å; L336-F469 HydrophobicContact CD2-CE1 3.86Å; L336-F469 HydrophobicContact CG-CD1 4.49Å; A340-F469 HydrophobicContact CB-CE1 4.41Å; M345-F469 HydrophobicContact CB-CZ 4.28Å; M345-F469 HydrophobicContact CE-CE2 4.48Å; P348-F469 VanDerWaalsContact CD-CE2 3.46Å; P348-F469 HydrophobicContact CG-CD2 3.66Å; P348-F469 HydrophobicContact CG-CE2 4.14Å; P348-F469 HydrophobicContact CG-CG 4.23Å; N465-F469 WeakPolarHBondContact O-CB 3.29Å; N465-F469 PolarHBondContact O-N 2.82Å; W467-F469 PolarHBondContact O-N 2.98Å; F469-A471 PolarHBondContact O-N 2.83Å; F469-S472 PolarHBondContact O-N 2.72Å; F469-V473 HydrophobicContact CD1-CG2 3.95Å; F469-V473 HydrophobicContact CE1-CG2 3.52Å; F469-V473 HydrophobicContact CE2-CG2 4.34Å; F469-V473 HydrophobicContact CZ-CG2 3.74Å; F469-V473 WeakPolarHBondContact O-CG2 3.37Å; F469-V473 PolarHBondContact O-N 3.2Å
470	A	83.2	Confident	84.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.3	-43.3	174.9	0	0	0	0	0	111.9	M327 L335 E466 W467 V473 I474	M327-A470 HydrophobicContact CE-CB 4.16Å; M327-A470 HydrophobicContact SD-CB 4.19Å; L335-A470 HydrophobicContact CD1-CB 3.91Å; E466-A470 VanDerWaalsContact O-CB 3.27Å; E466-A470 WeakPolarHBondContact O-CB 3.49Å; E466-A470 PolarHBondContact O-N 3.12Å; W467-A470 WeakPolarHBondContact O-CB 3.45Å; W467-A470 PolarHBondContact O-N 2.98Å; A470-V473 PolarHBondContact O-N 3.44Å; A470-I474 WeakPolarHBondContact O-CG1 3.41Å; A470-I474 PolarHBondContact O-N 3Å
471	A	85.1	Confident	84.8	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-59.5	-46.1	173.4	0	0	0	0	0	111.8	H318 W467 K468 F469 V473 I474 D475	H318-A471 HydrophobicContact CB-CB 3.91Å; W467-A471 PolarHBondContact O-N 3.05Å; K468-A471 PolarHBondContact O-N 2.64Å; F469-A471 PolarHBondContact O-N 2.83Å; A471-V473 VanDerWaalsContact C-N 3.32Å; A471-V473 PolarHBondContact O-N 3.27Å; A471-I474 PolarHBondContact O-N 3.07Å; A471-D475 WeakPolarHBondContact O-CB 3.41Å; A471-D475 PolarHBondContact O-N 2.87Å
472	S	84.8	Confident	85.4	Confident	48 Å²	48	44.8 Å²	44.8	34%	0.336	24%	0.237	S	C	.	.	H	α-helix	trans	-63.4	-34	176.6	-170.2	0	0	0	0	113.5	K468 F469 R476	K468-S472 PolarHBondContact O-N 2.77Å; F469-S472 PolarHBondContact O-N 2.72Å; S472-R476 PolarHBondContact O-N 3.04Å; S472-R476 VanDerWaalsContact O-N 3.15Å
473	V	85.7	Confident	85.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.4	-40.7	173.1	167.3	0	0	0	0	111.4	C339 L343 M345 F469 A470 A471 L477	C339-V473 HydrophobicContact CB-CG1 3.53Å; L343-V473 HydrophobicContact CD1-CG1 4.1Å; L343-V473 VanDerWaalsContact CD1-O 3.28Å; L343-V473 WeakPolarHBondContact CD1-O 3.35Å; M345-V473 HydrophobicContact CE-CG2 4.33Å; M345-V473 HydrophobicContact SD-CG2 3.97Å; F469-V473 HydrophobicContact CD1-CG2 3.95Å; F469-V473 HydrophobicContact CE1-CG2 3.52Å; F469-V473 HydrophobicContact CE2-CG2 4.34Å; F469-V473 HydrophobicContact CZ-CG2 3.74Å; F469-V473 WeakPolarHBondContact O-CG2 3.37Å; F469-V473 PolarHBondContact O-N 3.2Å; A470-V473 PolarHBondContact O-N 3.44Å; A471-V473 VanDerWaalsContact C-N 3.32Å; A471-V473 PolarHBondContact O-N 3.27Å; V473-L477 WeakPolarHBondContact O-CB 3.32Å; V473-L477 PolarHBondContact O-N 3.06Å
474	I	86.2	Confident	86.4	Confident	34 Å²	34	46 Å²	46	17%	0.174	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-46.8	173.6	-62.3	162.4	0	0	0	110.2	V314 Y317 L335 A470 A471 R476 L477 C478	V314-I474 HydrophobicContact CG2-CB 4.22Å; V314-I474 HydrophobicContact CG2-CG2 3.68Å; Y317-I474 HydrophobicContact CD1-CD1 3.79Å; Y317-I474 HydrophobicContact CE1-CD1 4.11Å; Y317-I474 HydrophobicContact CG-CD1 4.04Å; L335-I474 HydrophobicContact CD1-CD1 3.84Å; L335-I474 HydrophobicContact CD1-CG1 4.03Å; L335-I474 HydrophobicContact CD2-CD1 4.43Å; L335-I474 HydrophobicContact CD2-CG1 3.79Å; A470-I474 WeakPolarHBondContact O-CG1 3.41Å; A470-I474 PolarHBondContact O-N 3Å; A471-I474 PolarHBondContact O-N 3.07Å; I474-R476 VanDerWaalsContact C-N 3.32Å; I474-R476 PolarHBondContact O-N 2.94Å; I474-L477 WeakPolarHBondContact O-CB 3.32Å; I474-L477 PolarHBondContact O-N 3.02Å; I474-C478 PolarHBondContact O-N 2.96Å; I474-C478 PolarHBondContact O-SG 2.93Å
475	D	89.4	Confident	86.9	Confident	14 Å²	14	49 Å²	49	8%	0.075	25%	0.25	C	C	.	.	H	α-helix	trans	-53.9	-46.1	-179.7	-158.2	32.4	0	0	0	111.7	F252 K261 V314 A471 C478 L479	F252-D475 WeakPolarHBondContact CD1-OD1 3.49Å; K261-D475 WeakPolarHBondContact CE-OD1 3.42Å; K261-D475 IonicContact NZ-OD1 3.39Å; K261-D475 PolarHBondContact NZ-OD1 2.91Å; K261-D475 IonicContact NZ-OD2 2.7Å; K261-D475 PolarHBondContact NZ-OD2 3.24Å; V314-D475 HydrophobicContact CG1-CB 3.87Å; V314-D475 HydrophobicContact CG2-CB 4.34Å; A471-D475 WeakPolarHBondContact O-CB 3.41Å; A471-D475 PolarHBondContact O-N 2.87Å; D475-C478 PolarHBondContact O-N 3.11Å; D475-L479 PolarHBondContact O-N 3.14Å
476	R	88.6	Confident	87.3	Confident	135 Å²	135	45.4 Å²	45.4	51%	0.509	23%	0.231	S	C	.	.	H	α-helix	trans	-74.4	-29.3	175.7	-67.7	-161.5	-176.2	-161.7	-1.2	114.2	L343 M345 S472 I474 M480	L343-R476 HydrophobicContact CD1-CB 4.07Å; L343-R476 HydrophobicContact CD2-CB 4.22Å; M345-R476 HydrophobicContact SD-CB 4.36Å; M345-R476 HydrophobicContact SD-CG 4.44Å; S472-R476 PolarHBondContact O-N 3.04Å; S472-R476 VanDerWaalsContact O-N 3.15Å; I474-R476 VanDerWaalsContact C-N 3.32Å; I474-R476 PolarHBondContact O-N 2.94Å; R476-M480 WeakPolarHBondContact O-CG 3.37Å; R476-M480 PolarHBondContact O-N 2.79Å
477	L	88.2	Confident	87.6	Confident	61 Å²	61	47.8 Å²	47.8	32%	0.319	24%	0.244	S	C	.	.	H	α-helix	trans	-66	-45	172.3	-169.7	148.5	0	0	0	110.3	C339 L343 V473 I474 M480 A481	C339-L477 HydrophobicContact CB-CD1 4.1Å; C339-L477 VanDerWaalsContact SG-CD1 3.56Å; L343-L477 HydrophobicContact CD1-CB 4.11Å; V473-L477 WeakPolarHBondContact O-CB 3.32Å; V473-L477 PolarHBondContact O-N 3.06Å; I474-L477 WeakPolarHBondContact O-CB 3.32Å; I474-L477 PolarHBondContact O-N 3.02Å; L477-M480 PolarHBondContact O-N 3.2Å; L477-A481 WeakPolarHBondContact O-CB 3.27Å; L477-A481 PolarHBondContact O-N 3.37Å
478	C	89	Confident	87.9	Confident	19 Å²	19	52.1 Å²	52.1	13%	0.128	27%	0.268	C	S	.	.	H	α-helix	trans	-59.4	-48.2	172.8	-71.1	0	0	0	0	111.3	F252 I474 D475 M480 A481 F482	F252-C478 HydrophobicContact CD1-CB 3.84Å; F252-C478 HydrophobicContact CE1-CB 3.51Å; F252-C478 HydrophobicContact CZ-CB 4.04Å; I474-C478 PolarHBondContact O-N 2.96Å; I474-C478 PolarHBondContact O-SG 2.93Å; D475-C478 PolarHBondContact O-N 3.11Å; C478-M480 PolarHBondContact O-N 2.97Å; C478-A481 PolarHBondContact O-N 3.11Å; C478-F482 HydrophobicContact CB-CD2 4.06Å; C478-F482 HydrophobicContact CB-CE2 4.07Å; C478-F482 WeakPolarHBondContact O-CB 3.46Å; C478-F482 WeakPolarHBondContact O-CD2 3.31Å; C478-F482 PolarHBondContact O-N 2.63Å
479	L	90.6	Very high	88	Confident	31 Å²	31	49.9 Å²	49.9	16%	0.162	26%	0.261	C	S	.	.	H	α-helix	trans	-52	-52.1	175.2	-171.1	158.8	0	0	0	111.9	F252 L253 D475 A481 S483	F252-L479 HydrophobicContact CB-CB 3.73Å; F252-L479 HydrophobicContact CB-CD1 4.01Å; F252-L479 HydrophobicContact CB-CG 4.09Å; F252-L479 HydrophobicContact CG-CB 4.35Å; L253-L479 HydrophobicContact CD2-CD1 3.44Å; L253-L479 VanDerWaalsContact CD2-CD1 3.44Å; L253-L479 HydrophobicContact CG-CD1 3.65Å; D475-L479 PolarHBondContact O-N 3.14Å; L479-A481 PolarHBondContact O-N 2.87Å; L479-S483 WeakPolarHBondContact O-CB 3.24Å; L479-S483 PolarHBondContact O-N 3.18Å
480	M	89.4	Confident	88	Confident	109 Å²	109	50.2 Å²	50.2	54%	0.537	27%	0.265	S	S	.	.	H	α-helix	trans	-65.3	-40.1	-178.2	-69.8	-63	-64.1	0	0	112.1	L343 R476 L477 C478 L484	L343-M480 HydrophobicContact CD2-CG 3.89Å; R476-M480 WeakPolarHBondContact O-CG 3.37Å; R476-M480 PolarHBondContact O-N 2.79Å; L477-M480 PolarHBondContact O-N 3.2Å; C478-M480 PolarHBondContact O-N 2.97Å; M480-L484 VanDerWaalsContact O-CB 3.27Å; M480-L484 WeakPolarHBondContact O-CB 3.38Å; M480-L484 PolarHBondContact O-N 3.36Å
481	A	89.9	Confident	88.1	Confident	53 Å²	53	54.7 Å²	54.7	44%	0.438	29%	0.289	S	S	.	.	H	α-helix	trans	-67.7	-49.5	178.6	0	0	0	0	0	112.2	L477 C478 L479 L484 F485	L477-A481 WeakPolarHBondContact O-CB 3.27Å; L477-A481 PolarHBondContact O-N 3.37Å; C478-A481 PolarHBondContact O-N 3.11Å; L479-A481 PolarHBondContact O-N 2.87Å; A481-L484 PolarHBondContact O-N 3.06Å; A481-F485 VanDerWaalsContact O-CB 3.32Å; A481-F485 WeakPolarHBondContact O-CB 3.38Å; A481-F485 PolarHBondContact O-N 3Å
482	F	91.1	Very high	88	Confident	34 Å²	34	56.9 Å²	56.9	15%	0.149	31%	0.311	C	S	.	.	H	α-helix	trans	-67.8	-39.3	178.4	-72.6	-62.1	0	0	0	112	L249 F252 I303 L306 A310 C478 F485 T486	L249-F482 HydrophobicContact CD2-CB 4.06Å; F252-F482 HydrophobicContact CD2-CD2 4.47Å; F252-F482 HydrophobicContact CE1-CD2 4.34Å; F252-F482 HydrophobicContact CE1-CE2 4.34Å; F252-F482 HydrophobicContact CE2-CB 4.44Å; F252-F482 AromaticContact CE2-CD2 3.46Å; F252-F482 HydrophobicContact CE2-CD2 3.46Å; F252-F482 VanDerWaalsContact CE2-CD2 3.46Å; F252-F482 HydrophobicContact CE2-CE2 4.04Å; F252-F482 HydrophobicContact CE2-CG 4.22Å; F252-F482 AromaticContact CZ-CD2 3.4Å; F252-F482 HydrophobicContact CZ-CD2 3.4Å; F252-F482 AromaticContact CZ-CE2 3.5Å; F252-F482 HydrophobicContact CZ-CE2 3.5Å; F252-F482 VanDerWaalsContact CZ-CE2 3.5Å; F252-F482 HydrophobicContact CZ-CG 4.49Å; I303-F482 HydrophobicContact CG2-CD1 4.08Å; L306-F482 HydrophobicContact CB-CE1 4.07Å; L306-F482 HydrophobicContact CB-CZ 4.21Å; A310-F482 HydrophobicContact CB-CE2 3.88Å; A310-F482 HydrophobicContact CB-CZ 4.23Å; C478-F482 HydrophobicContact CB-CD2 4.06Å; C478-F482 HydrophobicContact CB-CE2 4.07Å; C478-F482 WeakPolarHBondContact O-CB 3.46Å; C478-F482 WeakPolarHBondContact O-CD2 3.31Å; C478-F482 PolarHBondContact O-N 2.63Å; F482-F485 PolarHBondContact O-N 3.24Å; F482-T486 WeakPolarHBondContact O-CB 3.31Å; F482-T486 PolarHBondContact O-N 3.4Å; F482-T486 PolarHBondContact O-OG1 3.23Å
483	S	90.2	Very high	87.9	Confident	32 Å²	32	55.7 Å²	55.7	22%	0.224	30%	0.3	C	S	.	.	H	α-helix	trans	-60.8	-48.9	174.8	-178	0	0	0	0	111.5	L479 F485 T486 I487	L479-S483 WeakPolarHBondContact O-CB 3.24Å; L479-S483 PolarHBondContact O-N 3.18Å; S483-F485 PolarHBondContact O-N 3.43Å; S483-T486 PolarHBondContact O-N 3.09Å; S483-I487 WeakPolarHBondContact O-CB 3.38Å; S483-I487 WeakPolarHBondContact O-CD1 3.41Å; S483-I487 VanDerWaalsContact O-CG1 3.23Å; S483-I487 WeakPolarHBondContact O-CG1 3.32Å; S483-I487 PolarHBondContact O-N 3.42Å
484	L	90.6	Very high	87.4	Confident	105 Å²	105	58.5 Å²	58.5	55%	0.55	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-43.6	175.9	179.3	61.6	0	0	0	111.9	M480 A481 I487 L488	M480-L484 VanDerWaalsContact O-CB 3.27Å; M480-L484 WeakPolarHBondContact O-CB 3.38Å; M480-L484 PolarHBondContact O-N 3.36Å; A481-L484 PolarHBondContact O-N 3.06Å; L484-I487 PolarHBondContact O-N 3.45Å; L484-L488 HydrophobicContact CD1-CD1 4Å; L484-L488 HydrophobicContact CD1-CG 4.18Å; L484-L488 HydrophobicContact CG-CD1 3.97Å; L484-L488 WeakPolarHBondContact O-CB 3.34Å; L484-L488 VanDerWaalsContact O-CG 3.29Å; L484-L488 WeakPolarHBondContact O-CG 3.44Å; L484-L488 PolarHBondContact O-N 2.9Å
485	F	90.3	Very high	87	Confident	108 Å²	108	63.5 Å²	63.5	47%	0.474	34%	0.34	S	S	.	.	H	α-helix	trans	-66.4	-45.4	-179.5	-166.6	-102	0	0	0	112	I303 A481 F482 S483 I487 L488 C489	I303-F485 HydrophobicContact CD1-CD1 3.55Å; I303-F485 HydrophobicContact CD1-CE1 3.63Å; I303-F485 HydrophobicContact CG1-CD1 3.63Å; I303-F485 HydrophobicContact CG1-CE1 3.6Å; A481-F485 VanDerWaalsContact O-CB 3.32Å; A481-F485 WeakPolarHBondContact O-CB 3.38Å; A481-F485 PolarHBondContact O-N 3Å; F482-F485 PolarHBondContact O-N 3.24Å; S483-F485 PolarHBondContact O-N 3.43Å; F485-I487 VanDerWaalsContact C-N 3.33Å; F485-I487 PolarHBondContact O-N 3.38Å; F485-L488 PolarHBondContact O-N 2.91Å; F485-C489 VanDerWaalsContact CE1-SG 3.57Å; F485-C489 WeakPolarHBondContact O-CB 3.37Å; F485-C489 PolarHBondContact O-N 2.99Å; F485-C489 PolarHBondContact O-SG 3.31Å; F485-C489 VanDerWaalsContact O-SG 3.39Å
486	T	87.8	Confident	86.4	Confident	21 Å²	21	65.6 Å²	65.6	13%	0.129	36%	0.355	C	S	.	.	H	α-helix	trans	-60.4	-40.4	174.2	-61.3	0	0	0	0	111.9	F482 S483 T490	F482-T486 WeakPolarHBondContact O-CB 3.31Å; F482-T486 PolarHBondContact O-N 3.4Å; F482-T486 PolarHBondContact O-OG1 3.23Å; S483-T486 PolarHBondContact O-N 3.09Å; T486-T490 HydrophobicContact CG2-CG2 4.36Å; T486-T490 WeakPolarHBondContact O-CB 3.49Å; T486-T490 VanDerWaalsContact O-CG2 3.31Å; T486-T490 WeakPolarHBondContact O-CG2 3.45Å; T486-T490 PolarHBondContact O-N 2.98Å; T486-T490 PolarHBondContact O-OG1 3.14Å
487	I	88.4	Confident	85.7	Confident	85 Å²	85	59.5 Å²	59.5	44%	0.436	33%	0.334	S	S	.	.	H	α-helix	trans	-65.7	-42	176.1	-69.8	165.8	0	0	0	111.2	S483 L484 F485 T490 I491	S483-I487 WeakPolarHBondContact O-CB 3.38Å; S483-I487 WeakPolarHBondContact O-CD1 3.41Å; S483-I487 VanDerWaalsContact O-CG1 3.23Å; S483-I487 WeakPolarHBondContact O-CG1 3.32Å; S483-I487 PolarHBondContact O-N 3.42Å; L484-I487 PolarHBondContact O-N 3.45Å; F485-I487 VanDerWaalsContact C-N 3.33Å; F485-I487 PolarHBondContact O-N 3.38Å; I487-T490 WeakPolarHBondContact CA-OG1 3.19Å; I487-T490 PolarHBondContact O-OG1 3.39Å; I487-I491 HydrophobicContact CG2-CD1 3.74Å; I487-I491 WeakPolarHBondContact O-CB 2.97Å; I487-I491 VanDerWaalsContact O-CG1 3.25Å; I487-I491 WeakPolarHBondContact O-CG1 3.25Å; I487-I491 PolarHBondContact O-N 3.01Å
488	L	89.4	Confident	84.8	Confident	108 Å²	108	61 Å²	61	57%	0.565	35%	0.347	S	S	*	.	H	α-helix	trans	-68.9	-41	177.7	-71.1	172.4	0	0	0	112.4	L484 F485 G492	L484-L488 HydrophobicContact CD1-CD1 4Å; L484-L488 HydrophobicContact CD1-CG 4.18Å; L484-L488 HydrophobicContact CG-CD1 3.97Å; L484-L488 WeakPolarHBondContact O-CB 3.34Å; L484-L488 VanDerWaalsContact O-CG 3.29Å; L484-L488 WeakPolarHBondContact O-CG 3.44Å; L484-L488 PolarHBondContact O-N 2.9Å; F485-L488 PolarHBondContact O-N 2.91Å; L488-G492 PolarHBondContact O-N 2.93Å
489	C	86.5	Confident	83.7	Confident	26 Å²	26	62.3 Å²	62.3	18%	0.176	35%	0.353	C	S	.	.	H	α-helix	trans	-66.8	-47.1	176.2	-71.2	0	0	0	0	111.9	I303 F485 I491 G492 I493	I303-C489 HydrophobicContact CD1-CB 4.49Å; F485-C489 VanDerWaalsContact CE1-SG 3.57Å; F485-C489 WeakPolarHBondContact O-CB 3.37Å; F485-C489 PolarHBondContact O-N 2.99Å; F485-C489 PolarHBondContact O-SG 3.31Å; F485-C489 VanDerWaalsContact O-SG 3.39Å; C489-I491 PolarHBondContact O-N 2.71Å; C489-G492 PolarHBondContact O-N 3.26Å; C489-I493 VanDerWaalsContact O-CB 3.25Å; C489-I493 WeakPolarHBondContact O-CB 3.47Å; C489-I493 VanDerWaalsContact O-CG1 3.25Å; C489-I493 WeakPolarHBondContact O-CG1 3.39Å; C489-I493 PolarHBondContact O-N 2.85Å
490	T	84.4	Confident	82.8	Confident	30 Å²	30	62.7 Å²	62.7	18%	0.184	35%	0.353	C	S	.	.	H	α-helix	trans	-59	-49.1	176.6	46.5	0	0	0	0	111.6	Y296 T486 I487 L494	Y296-T490 HydrophobicContact CE2-CG2 3.66Å; Y296-T490 WeakPolarHBondContact OH-CG2 3.4Å; T486-T490 HydrophobicContact CG2-CG2 4.36Å; T486-T490 WeakPolarHBondContact O-CB 3.49Å; T486-T490 VanDerWaalsContact O-CG2 3.31Å; T486-T490 WeakPolarHBondContact O-CG2 3.45Å; T486-T490 PolarHBondContact O-N 2.98Å; T486-T490 PolarHBondContact O-OG1 3.14Å; I487-T490 WeakPolarHBondContact CA-OG1 3.19Å; I487-T490 PolarHBondContact O-OG1 3.39Å; T490-L494 VanDerWaalsContact O-CB 3.32Å; T490-L494 WeakPolarHBondContact O-CB 3.25Å; T490-L494 WeakPolarHBondContact O-CD1 3.36Å; T490-L494 WeakPolarHBondContact O-CG 3.35Å; T490-L494 PolarHBondContact O-N 3.32Å
491	I	83.8	Confident	81.7	Confident	95 Å²	95	62.6 Å²	62.6	49%	0.487	36%	0.359	S	S	.	.	H	α-helix	trans	-64.3	-48	178.5	-66.8	170.8	0	0	0	111.1	I487 C489 I493 L494 M495	I487-I491 HydrophobicContact CG2-CD1 3.74Å; I487-I491 WeakPolarHBondContact O-CB 2.97Å; I487-I491 VanDerWaalsContact O-CG1 3.25Å; I487-I491 WeakPolarHBondContact O-CG1 3.25Å; I487-I491 PolarHBondContact O-N 3.01Å; C489-I491 PolarHBondContact O-N 2.71Å; I491-I493 VanDerWaalsContact C-N 3.32Å; I491-I493 PolarHBondContact O-N 3.42Å; I491-L494 PolarHBondContact O-N 2.85Å; I491-M495 HydrophobicContact CG2-CG 4.07Å; I491-M495 VanDerWaalsContact O-CB 3.23Å; I491-M495 WeakPolarHBondContact O-CB 3.39Å; I491-M495 WeakPolarHBondContact O-CG 3.37Å; I491-M495 PolarHBondContact O-N 2.89Å
492	G	84.7	Confident	80.7	Confident	46 Å²	46	64.7 Å²	64.7	47%	0.474	36%	0.359	S	S	.	.	H	α-helix	trans	-61	-40.2	-177.7	0	0	0	0	0	113.1	L488 C489 S496	L488-G492 PolarHBondContact O-N 2.93Å; C489-G492 PolarHBondContact O-N 3.26Å; G492-S496 PolarHBondContact O-N 2.86Å
493	I	81.3	Confident	79.3	Confident	23 Å²	23	63.3 Å²	63.3	12%	0.118	35%	0.354	C	S	.	.	H	α-helix	trans	-74.1	-47.2	179.7	-68.9	172.9	0	0	0	110.7	L292 Y296 C489 I491 M495 S496	L292-I493 HydrophobicContact CD1-CG2 3.83Å; L292-I493 HydrophobicContact CG-CG2 3.96Å; Y296-I493 HydrophobicContact CD2-CD1 4.09Å; Y296-I493 HydrophobicContact CD2-CG2 4.24Å; Y296-I493 HydrophobicContact CG-CG2 4.38Å; C489-I493 VanDerWaalsContact O-CB 3.25Å; C489-I493 WeakPolarHBondContact O-CB 3.47Å; C489-I493 VanDerWaalsContact O-CG1 3.25Å; C489-I493 WeakPolarHBondContact O-CG1 3.39Å; C489-I493 PolarHBondContact O-N 2.85Å; I491-I493 VanDerWaalsContact C-N 3.32Å; I491-I493 PolarHBondContact O-N 3.42Å; I493-M495 VanDerWaalsContact C-N 3.3Å; I493-M495 PolarHBondContact O-N 3.06Å; I493-S496 WeakPolarHBondContact O-CB 3.45Å; I493-S496 PolarHBondContact O-N 2.7Å; I493-S496 VanDerWaalsContact O-N 3.07Å; I493-S496 PolarHBondContact O-OG 2.92Å
494	L	76.1	Confident	78.2	Confident	59 Å²	59	64.3 Å²	64.3	31%	0.309	36%	0.357	S	S	.	.	H	α-helix	trans	-61.9	-36.3	177.2	-67.4	171.5	0	0	0	112.5	L238 T490 I491 S496 F500	L238-L494 HydrophobicContact CD1-CD2 4.25Å; T490-L494 VanDerWaalsContact O-CB 3.32Å; T490-L494 WeakPolarHBondContact O-CB 3.25Å; T490-L494 WeakPolarHBondContact O-CD1 3.36Å; T490-L494 WeakPolarHBondContact O-CG 3.35Å; T490-L494 PolarHBondContact O-N 3.32Å; I491-L494 PolarHBondContact O-N 2.85Å; L494-S496 VanDerWaalsContact C-N 3.26Å; L494-S496 PolarHBondContact O-N 3.1Å; L494-F500 HydrophobicContact CB-CE1 4.39Å; L494-F500 HydrophobicContact CB-CZ 4.25Å; L494-F500 HydrophobicContact CD1-CZ 4.38Å; L494-F500 HydrophobicContact CD2-CD2 4.46Å; L494-F500 HydrophobicContact CD2-CE2 3.73Å; L494-F500 HydrophobicContact CD2-CZ 3.96Å; L494-F500 HydrophobicContact CG-CZ 4.42Å
495	M	77.1	Confident	77	Confident	140 Å²	140	62.3 Å²	62.3	69%	0.69	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-11.6	176.5	-70.7	-64.5	-57.2	0	0	114.2	I491 I493	I491-M495 HydrophobicContact CG2-CG 4.07Å; I491-M495 VanDerWaalsContact O-CB 3.23Å; I491-M495 WeakPolarHBondContact O-CB 3.39Å; I491-M495 WeakPolarHBondContact O-CG 3.37Å; I491-M495 PolarHBondContact O-N 2.89Å; I493-M495 VanDerWaalsContact C-N 3.3Å; I493-M495 PolarHBondContact O-N 3.06Å
496	S	78.1	Confident	75.9	Confident	58 Å²	58	61.3 Å²	61.3	41%	0.406	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-16.4	177.7	76.2	0	0	0	0	113.7	L292 G492 I493 L494 P498	L292-S496 VanDerWaalsContact CD1-OG 3.24Å; L292-S496 WeakPolarHBondContact CD1-OG 3.23Å; L292-S496 WeakPolarHBondContact CD2-OG 3.38Å; G492-S496 PolarHBondContact O-N 2.86Å; I493-S496 WeakPolarHBondContact O-CB 3.45Å; I493-S496 PolarHBondContact O-N 2.7Å; I493-S496 VanDerWaalsContact O-N 3.07Å; I493-S496 PolarHBondContact O-OG 2.92Å; L494-S496 VanDerWaalsContact C-N 3.26Å; L494-S496 PolarHBondContact O-N 3.1Å; S496-P498 WeakPolarHBondContact O-CD 3.48Å
497	A	73.9	Confident	74.7	Confident	6 Å²	6	61.4 Å²	61.4	5%	0.05	35%	0.347	C	S	.	.			trans	-82.1	107.8	173.6	0	0	0	0	0	110.1	F159 L292 N499 F500	F159-A497 HydrophobicContact CD2-CB 4.36Å; L292-A497 HydrophobicContact CD2-CB 3.82Å; A497-N499 PolarHBondContact O-N 3.02Å; A497-N499 VanDerWaalsContact O-N 3.17Å; A497-F500 HydrophobicContact CB-CB 4.02Å; A497-F500 VanDerWaalsContact O-CB 3.3Å; A497-F500 WeakPolarHBondContact O-CB 3.47Å; A497-F500 PolarHBondContact O-N 3.3Å; A497-F500 VanDerWaalsContact O-N 3.16Å
498	P	68	Low	73.3	Confident	94 Å²	94	62.8 Å²	62.8	61%	0.61	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-28.1	-169.6	26.4	-35	0	0	0	113.2	S496	S496-P498 WeakPolarHBondContact O-CD 3.48Å
499	N	66.6	Low	71.6	Confident	45 Å²	45	65.9 Å²	65.9	24%	0.241	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-2.9	-177.1	-54.7	-27.9	0	0	0	113.5	F159 A497 V501 E502 A503	F159-N499 PolarHBondContact O-ND2 3.4Å; F159-N499 VanDerWaalsContact O-ND2 3.15Å; A497-N499 PolarHBondContact O-N 3.02Å; A497-N499 VanDerWaalsContact O-N 3.17Å; N499-V501 PolarHBondContact O-N 2.84Å; N499-E502 PolarHBondContact O-N 3.33Å; N499-E502 VanDerWaalsContact O-N 3.13Å; N499-A503 WeakPolarHBondContact O-CB 3.24Å; N499-A503 PolarHBondContact O-N 3.28Å
500	F	70.3	Confident	69.7	Low	39 Å²	39	72.7 Å²	72.7	17%	0.171	40%	0.4	C	S	.	.	H	α-helix	trans	-54.4	-47.1	-169.5	177.9	-106.3	0	0	0	113.3	F159 L494 A497 I504	F159-F500 HydrophobicContact CD1-CD2 4.33Å; F159-F500 HydrophobicContact CD2-CD2 4.37Å; F159-F500 AromaticContact CE1-CD2 3.81Å; F159-F500 HydrophobicContact CE1-CD2 3.81Å; F159-F500 HydrophobicContact CE1-CE2 4.29Å; F159-F500 AromaticContact CE2-CD2 3.84Å; F159-F500 HydrophobicContact CE2-CD2 3.84Å; F159-F500 HydrophobicContact CE2-CE2 4.25Å; F159-F500 AromaticContact CZ-CD2 3.55Å; F159-F500 HydrophobicContact CZ-CD2 3.55Å; F159-F500 AromaticContact CZ-CE2 3.77Å; F159-F500 HydrophobicContact CZ-CE2 3.77Å; L494-F500 HydrophobicContact CB-CE1 4.39Å; L494-F500 HydrophobicContact CB-CZ 4.25Å; L494-F500 HydrophobicContact CD1-CZ 4.38Å; L494-F500 HydrophobicContact CD2-CD2 4.46Å; L494-F500 HydrophobicContact CD2-CE2 3.73Å; L494-F500 HydrophobicContact CD2-CZ 3.96Å; L494-F500 HydrophobicContact CG-CZ 4.42Å; A497-F500 HydrophobicContact CB-CB 4.02Å; A497-F500 VanDerWaalsContact O-CB 3.3Å; A497-F500 WeakPolarHBondContact O-CB 3.47Å; A497-F500 PolarHBondContact O-N 3.3Å; A497-F500 VanDerWaalsContact O-N 3.16Å; F500-I504 HydrophobicContact CD1-CD1 4.34Å; F500-I504 HydrophobicContact CD2-CD1 3.98Å; F500-I504 HydrophobicContact CE1-CD1 3.83Å; F500-I504 HydrophobicContact CE2-CD1 3.42Å; F500-I504 VanDerWaalsContact CE2-CD1 3.42Å; F500-I504 HydrophobicContact CE2-CG1 4.5Å; F500-I504 HydrophobicContact CG-CD1 4.41Å; F500-I504 HydrophobicContact CZ-CD1 3.34Å; F500-I504 WeakPolarHBondContact O-CG1 3.46Å; F500-I504 PolarHBondContact O-N 3.41Å; F500-I504 VanDerWaalsContact O-N 3.09Å
501	V	66.8	Low	69	Low	108 Å²	108	74.9 Å²	74.9	66%	0.655	41%	0.411	S	S	*	.	H	α-helix	trans	-68.1	-40.3	-179.5	-176.9	0	0	0	0	111.3	N499 S505	N499-V501 PolarHBondContact O-N 2.84Å; V501-S505 VanDerWaalsContact O-CB 3.26Å; V501-S505 WeakPolarHBondContact O-CB 3.47Å; V501-S505 PolarHBondContact O-N 2.87Å; V501-S505 PolarHBondContact O-OG 2.9Å
502	E	68.6	Low	68.2	Low	96 Å²	96	73.8 Å²	73.8	45%	0.449	41%	0.407	S	S	.	.	H	α-helix	trans	-67.6	-47.2	179.2	-163.8	-167.8	139.5	0	0	111	R227 N499 S505 K506	R227-E502 IonicContact CZ-OE1 2.64Å; R227-E502 IonicContact NH1-OE1 3.16Å; R227-E502 PolarHBondContact NH1-OE1 2.89Å; R227-E502 IonicContact NH2-OE1 3.93Å; R227-E502 PolarHBondContact NH2-OE1 2.92Å; R227-E502 IonicContact NH2-OE2 2.7Å; N499-E502 PolarHBondContact O-N 3.33Å; N499-E502 VanDerWaalsContact O-N 3.13Å; E502-S505 WeakPolarHBondContact CA-OG 3.38Å; E502-S505 PolarHBondContact O-N 3.5Å; E502-S505 PolarHBondContact O-OG 3.2Å; E502-K506 PolarHBondContact O-N 3.29Å
503	A	63.3	Low	67.3	Low	5 Å²	5	75.3 Å²	75.3	4%	0.041	40%	0.403	C	S	.	.	H	α-helix	trans	-58.4	-50.3	178.3	0	0	0	0	0	111.8	F159 T230 N499 S505 K506 D507	F159-A503 HydrophobicContact CD1-CB 3.77Å; F159-A503 HydrophobicContact CE1-CB 4.35Å; T230-A503 HydrophobicContact CG2-CB 4.06Å; N499-A503 WeakPolarHBondContact O-CB 3.24Å; N499-A503 PolarHBondContact O-N 3.28Å; A503-S505 VanDerWaalsContact C-N 3.33Å; A503-S505 PolarHBondContact O-N 2.86Å; A503-K506 PolarHBondContact O-N 3.38Å; A503-D507 WeakPolarHBondContact O-CB 3.46Å; A503-D507 PolarHBondContact O-N 2.95Å
504	I	66.6	Low	66.4	Low	54 Å²	54	78.4 Å²	78.4	28%	0.277	42%	0.42	S	S	.	.	H	α-helix	trans	-64.2	-38.1	177.1	-71.1	177.8	0	0	0	111.5	F500 K506 F508	F500-I504 HydrophobicContact CD1-CD1 4.34Å; F500-I504 HydrophobicContact CD2-CD1 3.98Å; F500-I504 HydrophobicContact CE1-CD1 3.83Å; F500-I504 HydrophobicContact CE2-CD1 3.42Å; F500-I504 VanDerWaalsContact CE2-CD1 3.42Å; F500-I504 HydrophobicContact CE2-CG1 4.5Å; F500-I504 HydrophobicContact CG-CD1 4.41Å; F500-I504 HydrophobicContact CZ-CD1 3.34Å; F500-I504 WeakPolarHBondContact O-CG1 3.46Å; F500-I504 PolarHBondContact O-N 3.41Å; F500-I504 VanDerWaalsContact O-N 3.09Å; I504-K506 PolarHBondContact O-N 2.93Å; I504-F508 HydrophobicContact CB-CD2 4.4Å; I504-F508 HydrophobicContact CG1-CE2 4.45Å; I504-F508 HydrophobicContact CG2-CD2 3.91Å; I504-F508 HydrophobicContact CG2-CE2 4.47Å; I504-F508 WeakPolarHBondContact O-CB 3.34Å; I504-F508 PolarHBondContact O-N 3.39Å
505	S	65.1	Low	65.8	Low	62 Å²	62	79.6 Å²	79.6	43%	0.434	43%	0.426	S	S	.	.	H	α-helix	trans	-62.5	-31.3	177	75.4	0	0	0	0	112.9	V501 E502 A503	V501-S505 VanDerWaalsContact O-CB 3.26Å; V501-S505 WeakPolarHBondContact O-CB 3.47Å; V501-S505 PolarHBondContact O-N 2.87Å; V501-S505 PolarHBondContact O-OG 2.9Å; E502-S505 WeakPolarHBondContact CA-OG 3.38Å; E502-S505 PolarHBondContact O-N 3.5Å; E502-S505 PolarHBondContact O-OG 3.2Å; A503-S505 VanDerWaalsContact C-N 3.33Å; A503-S505 PolarHBondContact O-N 2.86Å
506	K	66.8	Low	65.1	Low	88 Å²	88	75.6 Å²	75.6	38%	0.383	41%	0.409	S	S	.	.	H	α-helix	trans	-85	-44.8	179.4	-161.6	-173.2	-176.3	-167.2	0	112.5	D197 E502 A503 I504 F508 T510	D197-K506 IonicContact OD2-NZ 2.69Å; D197-K506 PolarHBondContact OD2-NZ 3.42Å; E502-K506 PolarHBondContact O-N 3.29Å; A503-K506 PolarHBondContact O-N 3.38Å; I504-K506 PolarHBondContact O-N 2.93Å; K506-F508 PolarHBondContact O-N 3.43Å; K506-T510 PolarHBondContact O-OG1 2.93Å
507	D	63.8	Low	64.1	Low	23 Å²	23	76.9 Å²	76.9	12%	0.123	41%	0.409	C	S	.	.	H	α-helix	trans	-77.7	-17	-173.5	-76.1	-1.3	0	0	0	114.1	T230 L231 A503	T230-D507 WeakPolarHBondContact CA-OD2 3.24Å; T230-D507 WeakPolarHBondContact CB-OD2 3.47Å; T230-D507 PolarHBondContact N-OD2 3.4Å; T230-D507 PolarHBondContact OG1-OD2 2.86Å; L231-D507 PolarHBondContact N-OD2 3.33Å; A503-D507 WeakPolarHBondContact O-CB 3.46Å; A503-D507 PolarHBondContact O-N 2.95Å
508	F	58.8	Low	63.4	Low	113 Å²	113	82.3 Å²	82.3	50%	0.496	44%	0.437	S	S	.	.	H	α-helix	trans	-115.1	-11.5	-177.9	-74.7	-91.9	0	0	0	115.7	I504 K506	I504-F508 HydrophobicContact CB-CD2 4.4Å; I504-F508 HydrophobicContact CG1-CE2 4.45Å; I504-F508 HydrophobicContact CG2-CD2 3.91Å; I504-F508 HydrophobicContact CG2-CE2 4.47Å; I504-F508 WeakPolarHBondContact O-CB 3.34Å; I504-F508 PolarHBondContact O-N 3.39Å; K506-F508 PolarHBondContact O-N 3.43Å
509	F	54.1	Low	63	Low	174 Å²	174	81.3 Å²	81.3	76%	0.763	42%	0.422	S	S	*	.	H	α-helix	trans	-123.5	10.1	-176.9	-60.3	-88.3	0	0	0	114.2
510	T	45.4	Very low	62.7	Low	169 Å²	169	84.6 Å²	84.6	100%	1.037	44%	0.439	S	S	*	.			trans	-131.7	0	174.9	-6.2	0	0	0	0	111.4	K506	K506-T510 PolarHBondContact O-OG1 2.93Å

Retrieved 510 of 510 residues in 672.8 ms (Link to these results)

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