A0A087X925_POEFO Loading...

Glutamate receptor

Receptor for glutamate that functions as a ligand-gated ion channel in the central nervous system and plays an important role in excitatory synaptic transmission. L-glutamate acts as an excitatory neurotransmitter at many synapses in the central nervous system.

AlphaFold DB , UniProt , Accession A0A087X925, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 560 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	88.1	Confident	91.8	Very high	202 Å²	202	63.5 Å²	63.5	100%	0.995	35%	0.353	S	S	*	.				0	-53.3	0	-166.2	-179.8	-70.6	0	0	111.2	D3 A4 V5	M1-D3 PolarHBondContact O-N 3.27Å; M1-A4 WeakPolarHBondContact O-CB 3.27Å; M1-A4 PolarHBondContact O-N 3.12Å; M1-A4 VanDerWaalsContact O-N 3.17Å; M1-V5 PolarHBondContact O-N 2.85Å
2	Y	93.6	Very high	91.7	Very high	126 Å²	126	64.5 Å²	64.5	49%	0.494	36%	0.362	S	S	.	.	H	α-helix	trans	-49.3	-54.7	175.7	-177.8	-92.6	0	0	0	113.4	A4 V5 H6 L49	Y2-A4 VanDerWaalsContact C-N 3.3Å; Y2-A4 PolarHBondContact O-N 2.89Å; Y2-V5 PolarHBondContact O-N 3.2Å; Y2-H6 AromaticContact CD1-ND1 3.93Å; Y2-H6 AromaticContact CD2-CE1 3.92Å; Y2-H6 AromaticContact CE1-CE1 3.62Å; Y2-H6 AromaticContact CE1-ND1 3.81Å; Y2-H6 AromaticContact CE2-CE1 3.45Å; Y2-H6 VanDerWaalsContact CE2-CE1 3.45Å; Y2-H6 WeakPolarHBondContact CE2-CE1 3.28Å; Y2-H6 AromaticContact CZ-CE1 3.29Å; Y2-H6 AromaticContact CZ-ND1 3.95Å; Y2-H6 AromaticContact CZ-NE2 3.84Å; Y2-H6 PolarHBondContact O-N 3.49Å; Y2-H6 PolarHBondContact O-ND1 3.37Å; Y2-L49 HydrophobicContact CD1-CD1 3.62Å; Y2-L49 HydrophobicContact CD1-CG 3.67Å; Y2-L49 HydrophobicContact CE1-CD1 4.37Å; Y2-L49 HydrophobicContact CE1-CG 4.08Å; Y2-L49 HydrophobicContact CG-CD1 3.8Å; Y2-L49 HydrophobicContact CG-CG 4.36Å
3	D	92.9	Very high	91.4	Very high	16 Å²	16	72.4 Å²	72.4	9%	0.086	39%	0.394	C	S	.	.	H	α-helix	trans	-60.6	-37.8	179.9	-69.3	-13.4	0	0	0	112.9	M1 V5 H6 V7 G48 L49 T50 I53	M1-D3 PolarHBondContact O-N 3.27Å; D3-V5 VanDerWaalsContact C-N 3.35Å; D3-V5 PolarHBondContact O-N 2.87Å; D3-H6 PolarHBondContact O-N 3.44Å; D3-V7 WeakPolarHBondContact O-CG2 3.38Å; D3-V7 PolarHBondContact O-N 2.86Å; D3-G48 VanDerWaalsContact OD1-CA 3.3Å; D3-G48 WeakPolarHBondContact OD1-CA 3.49Å; D3-L49 PolarHBondContact OD1-N 3.33Å; D3-L49 PolarHBondContact OD2-N 3.39Å; D3-T50 PolarHBondContact OD2-N 2.92Å; D3-T50 VanDerWaalsContact OD2-N 3.11Å; D3-T50 PolarHBondContact OD2-OG1 3.1Å; D3-I53 HydrophobicContact CB-CD1 3.57Å
4	A	92.5	Very high	91	Very high	60 Å²	60	74.3 Å²	74.3	50%	0.496	40%	0.399	S	S	.	.	H	α-helix	trans	-64.6	-39.1	-179.3	0	0	0	0	0	112.2	M1 Y2 H6 V8	M1-A4 WeakPolarHBondContact O-CB 3.27Å; M1-A4 PolarHBondContact O-N 3.12Å; M1-A4 VanDerWaalsContact O-N 3.17Å; Y2-A4 VanDerWaalsContact C-N 3.3Å; Y2-A4 PolarHBondContact O-N 2.89Å; A4-H6 VanDerWaalsContact C-N 3.34Å; A4-V8 WeakPolarHBondContact O-CG2 3.28Å; A4-V8 PolarHBondContact O-N 3.26Å; A4-V8 VanDerWaalsContact O-N 3.14Å
5	V	94.4	Very high	90.5	Very high	93 Å²	93	71.1 Å²	71.1	56%	0.564	39%	0.385	S	S	*	.	H	α-helix	trans	-64.4	-41.5	176.4	176	0	0	0	0	110.6	M1 Y2 D3 V8 A9	M1-V5 PolarHBondContact O-N 2.85Å; Y2-V5 PolarHBondContact O-N 3.2Å; D3-V5 VanDerWaalsContact C-N 3.35Å; D3-V5 PolarHBondContact O-N 2.87Å; V5-V8 PolarHBondContact O-N 3.07Å; V5-A9 WeakPolarHBondContact O-CB 3.39Å; V5-A9 PolarHBondContact O-N 2.72Å
6	H	92.4	Very high	89.4	Confident	53 Å²	53	76.8 Å²	76.8	25%	0.245	41%	0.408	C	S	.	.	H	α-helix	trans	-68.1	-41.9	179.6	-71.8	78.3	0	0	0	112.2	Y2 D3 A4 V8 A9 V10 W46	Y2-H6 AromaticContact CD1-ND1 3.93Å; Y2-H6 AromaticContact CD2-CE1 3.92Å; Y2-H6 AromaticContact CE1-CE1 3.62Å; Y2-H6 AromaticContact CE1-ND1 3.81Å; Y2-H6 AromaticContact CE2-CE1 3.45Å; Y2-H6 VanDerWaalsContact CE2-CE1 3.45Å; Y2-H6 WeakPolarHBondContact CE2-CE1 3.28Å; Y2-H6 AromaticContact CZ-CE1 3.29Å; Y2-H6 AromaticContact CZ-ND1 3.95Å; Y2-H6 AromaticContact CZ-NE2 3.84Å; Y2-H6 PolarHBondContact O-N 3.49Å; Y2-H6 PolarHBondContact O-ND1 3.37Å; D3-H6 PolarHBondContact O-N 3.44Å; A4-H6 VanDerWaalsContact C-N 3.34Å; H6-V8 VanDerWaalsContact C-N 3.31Å; H6-V8 PolarHBondContact O-N 3.42Å; H6-A9 PolarHBondContact O-N 3.22Å; H6-A9 VanDerWaalsContact O-N 3.17Å; H6-V10 VanDerWaalsContact O-CG2 3.31Å; H6-V10 WeakPolarHBondContact O-CG2 3.45Å; H6-V10 PolarHBondContact O-N 3.41Å; H6-W46 HydrophobicContact CB-CD2 4Å; H6-W46 HydrophobicContact CB-CG 4.31Å; H6-W46 HydrophobicContact CB-CZ2 3.88Å; H6-W46 AromaticContact CD2-CH2 3.85Å; H6-W46 AromaticContact CD2-CZ2 3.46Å; H6-W46 VanDerWaalsContact CD2-CZ2 3.46Å; H6-W46 WeakPolarHBondContact CD2-CZ2 3.43Å; H6-W46 AromaticContact CG-CE2 3.93Å; H6-W46 AromaticContact CG-CZ2 3.77Å
7	V	91.9	Very high	88.4	Confident	8 Å²	8	83.5 Å²	83.5	5%	0.048	44%	0.437	C	S	.	.	H	α-helix	trans	-58	-44.9	174.5	169.3	0	0	0	0	111.1	D3 V10 A11 I41 A44 W46 I53 F55	D3-V7 WeakPolarHBondContact O-CG2 3.38Å; D3-V7 PolarHBondContact O-N 2.86Å; V7-V10 PolarHBondContact O-N 3.16Å; V7-A11 PolarHBondContact O-N 3.2Å; V7-A11 VanDerWaalsContact O-N 3.09Å; V7-I41 HydrophobicContact CG1-CG2 4.41Å; V7-A44 HydrophobicContact CG1-CB 4.09Å; V7-W46 HydrophobicContact CG2-CB 4.09Å; V7-I53 HydrophobicContact CG2-CD1 4.32Å; V7-I53 HydrophobicContact CG2-CG2 4.25Å; V7-F55 HydrophobicContact CG1-CE2 3.76Å; V7-F55 HydrophobicContact CG1-CZ 4.11Å
8	V	92.1	Very high	88	Confident	66 Å²	66	81.4 Å²	81.4	40%	0.4	43%	0.426	S	S	.	.	H	α-helix	trans	-66.9	-41	176.5	175.6	0	0	0	0	111.1	A4 V5 H6 V10 A11 V12 F37	A4-V8 WeakPolarHBondContact O-CG2 3.28Å; A4-V8 PolarHBondContact O-N 3.26Å; A4-V8 VanDerWaalsContact O-N 3.14Å; V5-V8 PolarHBondContact O-N 3.07Å; H6-V8 VanDerWaalsContact C-N 3.31Å; H6-V8 PolarHBondContact O-N 3.42Å; V8-V10 PolarHBondContact O-N 2.69Å; V8-A11 PolarHBondContact O-N 3.44Å; V8-V12 HydrophobicContact CG1-CG2 4.37Å; V8-V12 WeakPolarHBondContact O-CG2 3.46Å; V8-V12 PolarHBondContact O-N 3.04Å; V8-F37 HydrophobicContact CG1-CZ 4.5Å
9	A	91.7	Very high	87.7	Confident	50 Å²	50	81.5 Å²	81.5	41%	0.413	43%	0.43	S	S	.	.	H	α-helix	trans	-61.7	-41.8	177.6	0	0	0	0	0	112.3	V5 H6 V12 Q13	V5-A9 WeakPolarHBondContact O-CB 3.39Å; V5-A9 PolarHBondContact O-N 2.72Å; H6-A9 PolarHBondContact O-N 3.22Å; H6-A9 VanDerWaalsContact O-N 3.17Å; A9-V12 PolarHBondContact O-N 3.14Å; A9-Q13 WeakPolarHBondContact O-CB 3.45Å; A9-Q13 PolarHBondContact O-N 2.78Å
10	V	90.8	Very high	87.5	Confident	24 Å²	24	84.5 Å²	84.5	15%	0.145	45%	0.451	C	S	.	.	H	α-helix	trans	-61.2	-44.5	173.8	170.8	0	0	0	0	110.6	H6 V7 V8 V12 Q13 Q14 A44 W46	H6-V10 VanDerWaalsContact O-CG2 3.31Å; H6-V10 WeakPolarHBondContact O-CG2 3.45Å; H6-V10 PolarHBondContact O-N 3.41Å; V7-V10 PolarHBondContact O-N 3.16Å; V8-V10 PolarHBondContact O-N 2.69Å; V10-V12 VanDerWaalsContact C-N 3.35Å; V10-V12 PolarHBondContact O-N 3.37Å; V10-Q13 PolarHBondContact O-N 3.22Å; V10-Q14 WeakPolarHBondContact O-CG 3.33Å; V10-Q14 PolarHBondContact O-N 3.43Å; V10-A44 HydrophobicContact CG1-CB 4.3Å; V10-W46 HydrophobicContact CG2-CE3 4Å
11	A	89.9	Confident	87.3	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	45%	0.452	C	S	.	.	H	α-helix	trans	-64.2	-37.1	176.5	0	0	0	0	0	112.8	V7 V8 S15 F37 L40 I41	V7-A11 PolarHBondContact O-N 3.2Å; V7-A11 VanDerWaalsContact O-N 3.09Å; V8-A11 PolarHBondContact O-N 3.44Å; A11-S15 PolarHBondContact O-N 3.24Å; A11-F37 HydrophobicContact CB-CE2 4.29Å; A11-F37 HydrophobicContact CB-CZ 4.36Å; A11-L40 HydrophobicContact CB-CB 4.27Å; A11-I41 HydrophobicContact CB-CB 4.42Å; A11-I41 HydrophobicContact CB-CG1 3.61Å
12	V	89.7	Confident	87.2	Confident	76 Å²	76	80 Å²	80	46%	0.461	45%	0.446	S	S	.	.	H	α-helix	trans	-65.1	-44.3	173	174	0	0	0	0	110.9	V8 A9 V10 Q14 S15 F37	V8-V12 HydrophobicContact CG1-CG2 4.37Å; V8-V12 WeakPolarHBondContact O-CG2 3.46Å; V8-V12 PolarHBondContact O-N 3.04Å; A9-V12 PolarHBondContact O-N 3.14Å; V10-V12 VanDerWaalsContact C-N 3.35Å; V10-V12 PolarHBondContact O-N 3.37Å; V12-Q14 VanDerWaalsContact C-N 3.31Å; V12-Q14 PolarHBondContact O-N 2.99Å; V12-S15 WeakPolarHBondContact O-CB 3.44Å; V12-S15 PolarHBondContact O-N 3.44Å; V12-S15 PolarHBondContact O-OG 3.27Å; V12-F37 HydrophobicContact CB-CE2 4.5Å; V12-F37 HydrophobicContact CG2-CE2 3.82Å; V12-F37 HydrophobicContact CG2-CZ 3.58Å
13	Q	88.1	Confident	86.9	Confident	167 Å²	167	78 Å²	78	78%	0.78	44%	0.444	S	S	*	.	H	α-helix	trans	-63.9	-36.5	179.1	-173.3	179.3	0.9	0	0	112.4	A9 V10 S15	A9-Q13 WeakPolarHBondContact O-CB 3.45Å; A9-Q13 PolarHBondContact O-N 2.78Å; V10-Q13 PolarHBondContact O-N 3.22Å; Q13-S15 PolarHBondContact O-N 3.06Å
14	Q	85.8	Confident	86.6	Confident	99 Å²	99	83.4 Å²	83.4	46%	0.463	47%	0.468	S	S	.	.	H	α-helix	trans	-74	-14.6	175.1	-70.7	178.1	-4.8	0	0	113.1	V10 V12 L40	V10-Q14 WeakPolarHBondContact O-CG 3.33Å; V10-Q14 PolarHBondContact O-N 3.43Å; V12-Q14 VanDerWaalsContact C-N 3.31Å; V12-Q14 PolarHBondContact O-N 2.99Å; Q14-L40 HydrophobicContact CB-CD2 4.3Å
15	S	83.9	Confident	86.2	Confident	26 Å²	26	86.1 Å²	86.1	18%	0.182	48%	0.483	C	S	.	.			trans	-84.4	126.5	178.8	79.6	0	0	0	0	112.2	A11 V12 Q13 I18	A11-S15 PolarHBondContact O-N 3.24Å; V12-S15 WeakPolarHBondContact O-CB 3.44Å; V12-S15 PolarHBondContact O-N 3.44Å; V12-S15 PolarHBondContact O-OG 3.27Å; Q13-S15 PolarHBondContact O-N 3.06Å; S15-I18 WeakPolarHBondContact OG-CD1 3.39Å
16	Q	73.2	Confident	85.8	Confident	163 Å²	163	89 Å²	89	76%	0.762	50%	0.495	S	S	*	.			trans	-90.6	124	169.4	-70.7	-176.2	-10.3	0	0	110.2
17	Q	72.2	Confident	85.2	Confident	190 Å²	190	94.9 Å²	94.9	89%	0.888	52%	0.515	S	S	*	.	S	Bend	trans	42.1	75.1	167.6	-150.2	163.5	-0.5	0	0	115
18	I	81.7	Confident	84.7	Confident	47 Å²	47	102.8 Å²	102.8	24%	0.241	55%	0.551	C	S	.	*	P	Polyproline II helix	trans	-94	136.3	175.1	-66.2	-172.4	0	0	0	110.4	S15 W31 F33 F37	S15-I18 WeakPolarHBondContact OG-CD1 3.39Å; I18-W31 HydrophobicContact CD1-CH2 4.46Å; I18-W31 HydrophobicContact CG2-CH2 3.48Å; I18-W31 VanDerWaalsContact CG2-CH2 3.48Å; I18-W31 HydrophobicContact CG2-CZ2 3.09Å; I18-F33 HydrophobicContact CG2-CB 4.18Å; I18-F33 HydrophobicContact CG2-CD2 4.34Å; I18-F33 HydrophobicContact CG2-CG 4.39Å; I18-F37 HydrophobicContact CD1-CB 4.41Å; I18-F37 HydrophobicContact CD1-CD2 3.56Å; I18-F37 HydrophobicContact CD1-CE2 4.24Å; I18-F37 HydrophobicContact CD1-CG 4.3Å
19	T	82.1	Confident	84.3	Confident	82 Å²	82	107 Å²	107	50%	0.503	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-87.8	119.3	172.5	62.1	0	0	0	0	111.6	W31 F33	T19-W31 PolarHBondContact O-NE1 3.45Å; T19-F33 HydrophobicContact CG2-CE2 4.4Å; T19-F33 VanDerWaalsContact OG1-CE2 3.28Å; T19-F33 WeakPolarHBondContact OG1-CE2 3.46Å
20	V	83.7	Confident	84	Confident	141 Å²	141	110.2 Å²	110.2	86%	0.855	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-75.1	133.3	171.8	-175.7	0	0	0	0	109.1
21	S	83.3	Confident	83.9	Confident	66 Å²	66	112.4 Å²	112.4	46%	0.462	59%	0.586	S	S	.	*			trans	-143.5	137.1	-178.2	-50.3	0	0	0	0	110.7
22	S	84.6	Confident	83.7	Confident	126 Å²	126	123 Å²	123	88%	0.881	63%	0.626	S	S	*	*			trans	-80.8	133.8	172.1	-177.2	0	0	0	0	110.3
23	L	87.5	Confident	83.6	Confident	86 Å²	86	121.5 Å²	121.5	45%	0.45	61%	0.613	S	S	.	*			trans	-115.2	150.5	-178.7	-62.8	176.5	0	0	0	110.8	K29 W31	L23-K29 WeakPolarHBondContact CD1-O 3.33Å; L23-W31 HydrophobicContact CD1-CB 3.92Å
24	Q	86.4	Confident	83.6	Confident	128 Å²	128	114.4 Å²	114.4	60%	0.598	59%	0.585	S	S	*	*			trans	-101.6	124.8	174.6	-67.4	-173.8	-33.2	0	0	110.4	N26 R27	Q24-N26 PolarHBondContact O-N 2.88Å; Q24-R27 PolarHBondContact O-N 3.02Å; Q24-R27 VanDerWaalsContact O-N 3.12Å
25	C	84.7	Confident	83.6	Confident	118 Å²	118	113.8 Å²	113.8	80%	0.797	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-56.3	-35.7	-177.9	-58.9	0	0	0	0	113.1	R27	C25-R27 VanDerWaalsContact C-N 3.26Å; C25-R27 PolarHBondContact O-N 3.12Å
26	N	87.1	Confident	83.8	Confident	153 Å²	153	120 Å²	120	82%	0.818	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-71.9	-14.2	-177.4	-64.3	-0.8	0	0	0	114.3	Q24	Q24-N26 PolarHBondContact O-N 2.88Å
27	R	79.4	Confident	84.6	Confident	177 Å²	177	113.7 Å²	113.7	67%	0.668	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-105	1.6	-171.9	-73.9	-170.9	168.5	176.8	-4.8	114.4	Q24 C25 K29	Q24-R27 PolarHBondContact O-N 3.02Å; Q24-R27 VanDerWaalsContact O-N 3.12Å; C25-R27 VanDerWaalsContact C-N 3.26Å; C25-R27 PolarHBondContact O-N 3.12Å; R27-K29 PolarHBondContact O-N 3.32Å
28	H	81.4	Confident	85.4	Confident	174 Å²	174	109.3 Å²	109.3	81%	0.806	57%	0.567	S	S	*	*			trans	44.1	26.5	177.3	-60.6	-70	0	0	0	115.6	P30	H28-P30 VanDerWaalsContact O-CD 3.27Å; H28-P30 WeakPolarHBondContact O-CD 3.48Å
29	K	84.1	Confident	85.8	Confident	155 Å²	155	109.1 Å²	109.1	67%	0.674	57%	0.573	S	S	*	*			trans	-84.5	113.1	177.7	-75.1	-169.6	178.3	-174.9	0	109	L23 R27	L23-K29 WeakPolarHBondContact CD1-O 3.33Å; R27-K29 PolarHBondContact O-N 3.32Å
30	P	84.8	Confident	86.1	Confident	116 Å²	116	106.6 Å²	106.6	75%	0.753	56%	0.556	S	S	*	*			trans	-72.6	153.2	177.5	30.8	-34.7	0	0	0	110.7	H28 R32	H28-P30 VanDerWaalsContact O-CD 3.27Å; H28-P30 WeakPolarHBondContact O-CD 3.48Å; P30-R32 PolarHBondContact O-N 3Å
31	W	88.7	Confident	86.4	Confident	70 Å²	70	101.4 Å²	101.4	27%	0.265	52%	0.523	S	S	.	.			trans	-68.5	125.7	172.8	-179.1	47.7	0	0	0	110.3	I18 T19 L23 F33 G34 F37	I18-W31 HydrophobicContact CD1-CH2 4.46Å; I18-W31 HydrophobicContact CG2-CH2 3.48Å; I18-W31 VanDerWaalsContact CG2-CH2 3.48Å; I18-W31 HydrophobicContact CG2-CZ2 3.09Å; T19-W31 PolarHBondContact O-NE1 3.45Å; L23-W31 HydrophobicContact CD1-CB 3.92Å; W31-F33 HydrophobicContact CD2-CB 4.25Å; W31-F33 HydrophobicContact CH2-CB 4.23Å; W31-F33 HydrophobicContact CZ2-CB 4Å; W31-F33 HydrophobicContact CZ3-CB 4.48Å; W31-F33 PolarHBondContact O-N 3.4Å; W31-F33 VanDerWaalsContact O-N 3.1Å; W31-G34 VanDerWaalsContact CE3-N 3.29Å; W31-G34 PolarHBondContact O-N 3.33Å; W31-F37 HydrophobicContact CH2-CB 4.31Å; W31-F37 HydrophobicContact CH2-CG 4.35Å; W31-F37 HydrophobicContact CZ3-CB 3.89Å; W31-F37 HydrophobicContact CZ3-CD1 4.14Å; W31-F37 HydrophobicContact CZ3-CG 4.14Å
32	R	85.8	Confident	86.8	Confident	222 Å²	222	101 Å²	101	84%	0.838	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-36.2	-174.9	-175.2	-180	178.9	-176.5	-0.1	113.5	P30	P30-R32 PolarHBondContact O-N 3Å
33	F	87.6	Confident	87	Confident	45 Å²	45	99.7 Å²	99.7	20%	0.197	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-1.2	-178.9	-62.6	-73	0	0	0	113.9	I18 T19 W31 A35 R36 F37	I18-F33 HydrophobicContact CG2-CB 4.18Å; I18-F33 HydrophobicContact CG2-CD2 4.34Å; I18-F33 HydrophobicContact CG2-CG 4.39Å; T19-F33 HydrophobicContact CG2-CE2 4.4Å; T19-F33 VanDerWaalsContact OG1-CE2 3.28Å; T19-F33 WeakPolarHBondContact OG1-CE2 3.46Å; W31-F33 HydrophobicContact CD2-CB 4.25Å; W31-F33 HydrophobicContact CH2-CB 4.23Å; W31-F33 HydrophobicContact CZ2-CB 4Å; W31-F33 HydrophobicContact CZ3-CB 4.48Å; W31-F33 PolarHBondContact O-N 3.4Å; W31-F33 VanDerWaalsContact O-N 3.1Å; F33-A35 PolarHBondContact O-N 2.98Å; F33-R36 PolarHBondContact O-N 2.95Å; F33-F37 WeakPolarHBondContact O-CB 3.37Å; F33-F37 PolarHBondContact O-N 2.79Å
34	G	87.3	Confident	87	Confident	18 Å²	18	95.7 Å²	95.7	19%	0.186	47%	0.472	C	S	.	.	H	α-helix	trans	-59.6	-46.8	-173.7	0	0	0	0	0	113.8	W31 R36 F37 M38	W31-G34 VanDerWaalsContact CE3-N 3.29Å; W31-G34 PolarHBondContact O-N 3.33Å; G34-R36 PolarHBondContact O-N 3.25Å; G34-F37 PolarHBondContact O-N 3.28Å; G34-M38 WeakPolarHBondContact O-CB 3.48Å; G34-M38 VanDerWaalsContact O-CG 3.28Å; G34-M38 WeakPolarHBondContact O-CG 3.34Å; G34-M38 PolarHBondContact O-N 3.21Å
35	A	87	Confident	87.1	Confident	86 Å²	86	95.7 Å²	95.7	71%	0.711	47%	0.472	S	S	*	.	H	α-helix	trans	-63.7	-39.8	178.6	0	0	0	0	0	112.6	F33 M38 A39	F33-A35 PolarHBondContact O-N 2.98Å; A35-M38 PolarHBondContact O-N 2.89Å; A35-A39 PolarHBondContact O-N 2.95Å; A35-A39 VanDerWaalsContact O-N 3.07Å
36	R	87.4	Confident	87.4	Confident	157 Å²	157	93.9 Å²	93.9	59%	0.592	45%	0.449	S	S	*	.	H	α-helix	trans	-68.6	-42	177.6	-175.4	177.8	176.6	-170.5	-2.1	111.6	F33 G34 A39 L40	F33-R36 PolarHBondContact O-N 2.95Å; G34-R36 PolarHBondContact O-N 3.25Å; R36-A39 WeakPolarHBondContact O-CB 3.48Å; R36-A39 PolarHBondContact O-N 3.3Å; R36-L40 PolarHBondContact O-N 3.21Å; R36-L40 VanDerWaalsContact O-N 3.16Å
37	F	89.4	Confident	87.6	Confident	31 Å²	31	92.5 Å²	92.5	14%	0.136	44%	0.441	C	S	.	.	H	α-helix	trans	-66.8	-38.5	176.7	-170.6	-110	0	0	0	111.8	V8 A11 V12 I18 W31 F33 G34 A39 L40 I41	V8-F37 HydrophobicContact CG1-CZ 4.5Å; A11-F37 HydrophobicContact CB-CE2 4.29Å; A11-F37 HydrophobicContact CB-CZ 4.36Å; V12-F37 HydrophobicContact CB-CE2 4.5Å; V12-F37 HydrophobicContact CG2-CE2 3.82Å; V12-F37 HydrophobicContact CG2-CZ 3.58Å; I18-F37 HydrophobicContact CD1-CB 4.41Å; I18-F37 HydrophobicContact CD1-CD2 3.56Å; I18-F37 HydrophobicContact CD1-CE2 4.24Å; I18-F37 HydrophobicContact CD1-CG 4.3Å; W31-F37 HydrophobicContact CH2-CB 4.31Å; W31-F37 HydrophobicContact CH2-CG 4.35Å; W31-F37 HydrophobicContact CZ3-CB 3.89Å; W31-F37 HydrophobicContact CZ3-CD1 4.14Å; W31-F37 HydrophobicContact CZ3-CG 4.14Å; F33-F37 WeakPolarHBondContact O-CB 3.37Å; F33-F37 PolarHBondContact O-N 2.79Å; G34-F37 PolarHBondContact O-N 3.28Å; F37-A39 VanDerWaalsContact C-N 3.3Å; F37-A39 PolarHBondContact O-N 3.41Å; F37-L40 WeakPolarHBondContact O-CB 3.33Å; F37-L40 PolarHBondContact O-N 3.47Å; F37-I41 HydrophobicContact CD1-CD1 3.86Å; F37-I41 HydrophobicContact CD1-CG1 4.49Å; F37-I41 HydrophobicContact CE1-CD1 3.65Å; F37-I41 HydrophobicContact CE1-CG1 4.26Å; F37-I41 HydrophobicContact CZ-CD1 4.39Å; F37-I41 WeakPolarHBondContact O-CG1 3.26Å; F37-I41 PolarHBondContact O-N 3.4Å
38	M	89.7	Confident	88.1	Confident	97 Å²	97	85 Å²	85	48%	0.478	42%	0.419	S	S	.	.	H	α-helix	trans	-62.4	-35.5	172.1	-76.1	-57.5	-56.4	0	0	112.7	G34 A35 I41 K42	G34-M38 WeakPolarHBondContact O-CB 3.48Å; G34-M38 VanDerWaalsContact O-CG 3.28Å; G34-M38 WeakPolarHBondContact O-CG 3.34Å; G34-M38 PolarHBondContact O-N 3.21Å; A35-M38 PolarHBondContact O-N 2.89Å; M38-I41 PolarHBondContact O-N 3.14Å; M38-I41 HydrophobicContact SD-CD1 4.01Å; M38-K42 WeakPolarHBondContact O-CG 3.38Å; M38-K42 PolarHBondContact O-N 2.86Å
39	A	88.8	Confident	88.6	Confident	44 Å²	44	83.2 Å²	83.2	36%	0.364	42%	0.415	S	S	.	.	H	α-helix	trans	-64.4	-41.9	173.6	0	0	0	0	0	111.6	A35 R36 F37 I41 K42 E43	A35-A39 PolarHBondContact O-N 2.95Å; A35-A39 VanDerWaalsContact O-N 3.07Å; R36-A39 WeakPolarHBondContact O-CB 3.48Å; R36-A39 PolarHBondContact O-N 3.3Å; F37-A39 VanDerWaalsContact C-N 3.3Å; F37-A39 PolarHBondContact O-N 3.41Å; A39-I41 VanDerWaalsContact C-N 3.33Å; A39-I41 PolarHBondContact O-N 3.39Å; A39-K42 PolarHBondContact O-N 3.17Å; A39-K42 VanDerWaalsContact O-N 3.14Å; A39-E43 WeakPolarHBondContact O-CG 3.31Å; A39-E43 PolarHBondContact O-N 2.87Å
40	L	89.6	Confident	88.9	Confident	28 Å²	28	79.4 Å²	79.4	15%	0.147	41%	0.405	C	S	.	.	H	α-helix	trans	-62	-38.7	174.2	-67.5	172.4	0	0	0	112.3	A11 Q14 R36 F37 K42 E43 A44	A11-L40 HydrophobicContact CB-CB 4.27Å; Q14-L40 HydrophobicContact CB-CD2 4.3Å; R36-L40 PolarHBondContact O-N 3.21Å; R36-L40 VanDerWaalsContact O-N 3.16Å; F37-L40 WeakPolarHBondContact O-CB 3.33Å; F37-L40 PolarHBondContact O-N 3.47Å; L40-K42 VanDerWaalsContact C-N 3.34Å; L40-E43 PolarHBondContact O-N 2.87Å; L40-A44 PolarHBondContact O-N 3.43Å
41	I	90.3	Very high	89.1	Confident	33 Å²	33	75.5 Å²	75.5	17%	0.169	39%	0.385	C	S	.	.	H	α-helix	trans	-63.2	-41.8	173.9	-66.8	169.8	0	0	0	110.9	V7 A11 F37 M38 A39 E43 A44	V7-I41 HydrophobicContact CG1-CG2 4.41Å; A11-I41 HydrophobicContact CB-CB 4.42Å; A11-I41 HydrophobicContact CB-CG1 3.61Å; F37-I41 HydrophobicContact CD1-CD1 3.86Å; F37-I41 HydrophobicContact CD1-CG1 4.49Å; F37-I41 HydrophobicContact CE1-CD1 3.65Å; F37-I41 HydrophobicContact CE1-CG1 4.26Å; F37-I41 HydrophobicContact CZ-CD1 4.39Å; F37-I41 WeakPolarHBondContact O-CG1 3.26Å; F37-I41 PolarHBondContact O-N 3.4Å; M38-I41 PolarHBondContact O-N 3.14Å; M38-I41 HydrophobicContact SD-CD1 4.01Å; A39-I41 VanDerWaalsContact C-N 3.33Å; A39-I41 PolarHBondContact O-N 3.39Å; I41-E43 VanDerWaalsContact C-N 3.27Å; I41-E43 PolarHBondContact O-N 3.09Å; I41-A44 WeakPolarHBondContact O-CB 3.41Å; I41-A44 PolarHBondContact O-N 3.49Å
42	K	90.3	Very high	89.2	Confident	57 Å²	57	79.2 Å²	79.2	25%	0.248	40%	0.399	C	S	.	.	H	α-helix	trans	-68.7	-23.9	177.7	-69.7	-177	-179.9	-170.1	0	113.3	M38 A39 L40 T58	M38-K42 WeakPolarHBondContact O-CG 3.38Å; M38-K42 PolarHBondContact O-N 2.86Å; A39-K42 PolarHBondContact O-N 3.17Å; A39-K42 VanDerWaalsContact O-N 3.14Å; L40-K42 VanDerWaalsContact C-N 3.34Å; K42-T58 PolarHBondContact NZ-O 2.76Å
43	E	88.9	Confident	89.4	Confident	99 Å²	99	69.1 Å²	69.1	46%	0.463	36%	0.362	S	S	.	.	H	α-helix	trans	-94	-5.9	176.9	-71.2	178	176.8	0	0	113.2	A39 L40 I41 H45	A39-E43 WeakPolarHBondContact O-CG 3.31Å; A39-E43 PolarHBondContact O-N 2.87Å; L40-E43 PolarHBondContact O-N 2.87Å; I41-E43 VanDerWaalsContact C-N 3.27Å; I41-E43 PolarHBondContact O-N 3.09Å; E43-H45 PolarHBondContact O-CE1 3.34Å; E43-H45 PolarHBondContact O-N 2.96Å; E43-H45 PolarHBondContact O-ND1 3.24Å
44	A	88.2	Confident	89.5	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.008	36%	0.358	C	S	.	.			trans	-66.2	129.4	178.1	0	0	0	0	0	110.5	V7 V10 L40 I41	V7-A44 HydrophobicContact CG1-CB 4.09Å; V10-A44 HydrophobicContact CG1-CB 4.3Å; L40-A44 PolarHBondContact O-N 3.43Å; I41-A44 WeakPolarHBondContact O-CB 3.41Å; I41-A44 PolarHBondContact O-N 3.49Å
45	H	87.9	Confident	89.6	Confident	128 Å²	128	69.3 Å²	69.3	59%	0.593	36%	0.359	S	S	*	.			trans	-115	128.2	171.9	-65.1	72.6	0	0	0	107.7	E43	E43-H45 PolarHBondContact O-CE1 3.34Å; E43-H45 PolarHBondContact O-N 2.96Å; E43-H45 PolarHBondContact O-ND1 3.24Å
46	W	91	Very high	89.7	Confident	81 Å²	81	67.9 Å²	67.9	31%	0.307	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	133.1	-179.1	178.3	-105.6	0	0	0	110	H6 V7 V10 I53	H6-W46 HydrophobicContact CB-CD2 4Å; H6-W46 HydrophobicContact CB-CG 4.31Å; H6-W46 HydrophobicContact CB-CZ2 3.88Å; H6-W46 AromaticContact CD2-CH2 3.85Å; H6-W46 AromaticContact CD2-CZ2 3.46Å; H6-W46 VanDerWaalsContact CD2-CZ2 3.46Å; H6-W46 WeakPolarHBondContact CD2-CZ2 3.43Å; H6-W46 AromaticContact CG-CE2 3.93Å; H6-W46 AromaticContact CG-CZ2 3.77Å; V7-W46 HydrophobicContact CG2-CB 4.09Å; V10-W46 HydrophobicContact CG2-CE3 4Å; W46-I53 PolarHBondContact N-O 3.41Å; W46-I53 WeakPolarHBondContact O-CB 3.46Å; W46-I53 PolarHBondContact O-N 2.9Å
47	D	91.6	Very high	89.6	Confident	123 Å²	123	69.1 Å²	69.1	66%	0.658	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	103.9	170.5	-70.6	-39.2	0	0	0	108.3	R52	D47-R52 VanDerWaalsContact OD1-CA 3.29Å; D47-R52 WeakPolarHBondContact OD1-CA 3.34Å
48	G	90.8	Very high	89.3	Confident	21 Å²	21	72.9 Å²	72.9	22%	0.216	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-162.8	-173.3	0	0	0	0	0	113.9	D3 T50 G51	D3-G48 VanDerWaalsContact OD1-CA 3.3Å; D3-G48 WeakPolarHBondContact OD1-CA 3.49Å; G48-T50 PolarHBondContact O-N 3.27Å; G48-G51 PolarHBondContact N-O 3.44Å; G48-G51 PolarHBondContact O-N 2.88Å
49	L	92.1	Very high	89.2	Confident	135 Å²	135	72 Å²	72	71%	0.707	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-32.6	177	-63.9	176.6	0	0	0	112	Y2 D3 G51	Y2-L49 HydrophobicContact CD1-CD1 3.62Å; Y2-L49 HydrophobicContact CD1-CG 3.67Å; Y2-L49 HydrophobicContact CE1-CD1 4.37Å; Y2-L49 HydrophobicContact CE1-CG 4.08Å; Y2-L49 HydrophobicContact CG-CD1 3.8Å; Y2-L49 HydrophobicContact CG-CG 4.36Å; D3-L49 PolarHBondContact OD1-N 3.33Å; D3-L49 PolarHBondContact OD2-N 3.39Å; L49-G51 PolarHBondContact O-N 3.44Å
50	T	89.8	Confident	89.1	Confident	76 Å²	76	70.9 Å²	70.9	47%	0.466	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	18.1	176.6	56.8	0	0	0	0	112.9	D3 G48 R62	D3-T50 PolarHBondContact OD2-N 2.92Å; D3-T50 VanDerWaalsContact OD2-N 3.11Å; D3-T50 PolarHBondContact OD2-OG1 3.1Å; G48-T50 PolarHBondContact O-N 3.27Å; T50-R62 PolarHBondContact O-NH2 3.06Å; T50-R62 PolarHBondContact OG1-NH1 3.43Å
51	G	89.6	Confident	89.1	Confident	33 Å²	33	74.7 Å²	74.7	34%	0.34	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	76.3	-146.8	-175.5	0	0	0	0	0	112.7	G48 L49 I53	G48-G51 PolarHBondContact N-O 3.44Å; G48-G51 PolarHBondContact O-N 2.88Å; L49-G51 PolarHBondContact O-N 3.44Å; G51-I53 PolarHBondContact O-N 3.04Å
52	R	89.6	Confident	89.1	Confident	149 Å²	149	76.5 Å²	76.5	56%	0.562	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	128.1	-178.3	171.5	-177.4	-68.5	-178.6	1.9	112	D47 R62	D47-R52 VanDerWaalsContact OD1-CA 3.29Å; D47-R52 WeakPolarHBondContact OD1-CA 3.34Å; R52-R62 PolarHBondContact O-NH2 2.83Å
53	I	91.1	Very high	88.9	Confident	9 Å²	9	77 Å²	77	5%	0.046	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	114.9	173.2	-51	-177	0	0	0	109.1	D3 V7 W46 G51 F55	D3-I53 HydrophobicContact CB-CD1 3.57Å; V7-I53 HydrophobicContact CG2-CD1 4.32Å; V7-I53 HydrophobicContact CG2-CG2 4.25Å; W46-I53 PolarHBondContact N-O 3.41Å; W46-I53 WeakPolarHBondContact O-CB 3.46Å; W46-I53 PolarHBondContact O-N 2.9Å; G51-I53 PolarHBondContact O-N 3.04Å; I53-F55 HydrophobicContact CG2-CE1 4.4Å; I53-F55 HydrophobicContact CG2-CE2 3.86Å; I53-F55 HydrophobicContact CG2-CZ 3.7Å
54	S	88.6	Confident	88.8	Confident	17 Å²	17	75.1 Å²	75.1	12%	0.119	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-133.8	147.7	171.1	70	0	0	0	0	109.5	R62 D64	S54-R62 WeakPolarHBondContact O-CA 3.29Å; S54-D64 WeakPolarHBondContact OG-CB 3.45Å; S54-D64 PolarHBondContact OG-OD2 3.34Å; S54-D64 VanDerWaalsContact OG-OD2 3.04Å
55	F	90.7	Very high	88.9	Confident	50 Å²	50	78 Å²	78	22%	0.219	40%	0.399	C	S	.	.			trans	-114	142.1	-179.9	-58.6	-80.6	0	0	0	110.4	V7 I53 R57 G60 L61 R62	V7-F55 HydrophobicContact CG1-CE2 3.76Å; V7-F55 HydrophobicContact CG1-CZ 4.11Å; I53-F55 HydrophobicContact CG2-CE1 4.4Å; I53-F55 HydrophobicContact CG2-CE2 3.86Å; I53-F55 HydrophobicContact CG2-CZ 3.7Å; F55-R57 PolarHBondContact O-N 3.23Å; F55-G60 WeakPolarHBondContact CD1-O 3.33Å; F55-L61 WeakPolarHBondContact CA-O 3.34Å; F55-R62 HydrophobicContact CD1-CB 4.22Å; F55-R62 HydrophobicContact CE1-CB 4.21Å
56	N	88.6	Confident	89	Confident	57 Å²	57	76.5 Å²	76.5	31%	0.305	40%	0.395	S	S	.	.			trans	-68.9	124.2	170.4	178	-21.3	0	0	0	109.2	T58 N59 G60 L61 T63	N56-T58 PolarHBondContact O-N 3.17Å; N56-T58 VanDerWaalsContact O-N 3.12Å; N56-T58 PolarHBondContact OD1-N 3.11Å; N56-T58 PolarHBondContact OD1-OG1 3.37Å; N56-N59 WeakPolarHBondContact CB-OD1 3.34Å; N56-G60 VanDerWaalsContact O-CA 3.26Å; N56-G60 WeakPolarHBondContact O-CA 3.41Å; N56-G60 PolarHBondContact O-N 2.74Å; N56-L61 PolarHBondContact N-O 2.84Å; N56-T63 HydrophobicContact CB-CG2 4.25Å
57	R	84.3	Confident	89	Confident	182 Å²	182	76.8 Å²	76.8	69%	0.687	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.8	-174.7	-66.7	-177.6	179.3	175.9	-1.2	113.3	F55	F55-R57 PolarHBondContact O-N 3.23Å
58	T	84.4	Confident	89	Confident	111 Å²	111	75.4 Å²	75.4	68%	0.681	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-57.8	-177.5	60.1	0	0	0	0	111.9	K42 N56	K42-T58 PolarHBondContact NZ-O 2.76Å; N56-T58 PolarHBondContact O-N 3.17Å; N56-T58 VanDerWaalsContact O-N 3.12Å; N56-T58 PolarHBondContact OD1-N 3.11Å; N56-T58 PolarHBondContact OD1-OG1 3.37Å
59	N	87	Confident	89	Confident	77 Å²	77	76.5 Å²	76.5	41%	0.412	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-16	-173	62.5	14.1	0	0	0	114.1	N56 L61	N56-N59 WeakPolarHBondContact CB-OD1 3.34Å; N59-L61 VanDerWaalsContact C-N 3.31Å; N59-L61 HydrophobicContact CB-CD1 4.39Å; N59-L61 HydrophobicContact CB-CG 4.25Å; N59-L61 WeakPolarHBondContact OD1-CB 3.46Å; N59-L61 PolarHBondContact OD1-N 2.92Å
60	G	86.8	Confident	88.9	Confident	22 Å²	22	75.1 Å²	75.1	23%	0.227	39%	0.39	C	S	.	.			trans	73.6	18	-176.4	0	0	0	0	0	114.6	F55 N56	F55-G60 WeakPolarHBondContact CD1-O 3.33Å; N56-G60 VanDerWaalsContact O-CA 3.26Å; N56-G60 WeakPolarHBondContact O-CA 3.41Å; N56-G60 PolarHBondContact O-N 2.74Å
61	L	90.5	Very high	88.7	Confident	107 Å²	107	73.8 Å²	73.8	56%	0.56	38%	0.383	S	S	*	.			trans	-93.5	146.3	178.7	-59.6	178.2	0	0	0	110.6	F55 N56 N59 T63	F55-L61 WeakPolarHBondContact CA-O 3.34Å; N56-L61 PolarHBondContact N-O 2.84Å; N59-L61 VanDerWaalsContact C-N 3.31Å; N59-L61 HydrophobicContact CB-CD1 4.39Å; N59-L61 HydrophobicContact CB-CG 4.25Å; N59-L61 WeakPolarHBondContact OD1-CB 3.46Å; N59-L61 PolarHBondContact OD1-N 2.92Å; L61-T63 HydrophobicContact CB-CG2 4.44Å; L61-T63 PolarHBondContact O-N 2.92Å
62	R	89.1	Confident	88.4	Confident	72 Å²	72	78.5 Å²	78.5	27%	0.272	40%	0.4	S	S	.	.			trans	-76.1	103.3	172.4	-174.7	-177.1	-178	-176	-2.5	108.7	T50 R52 S54 F55 F65	T50-R62 PolarHBondContact O-NH2 3.06Å; T50-R62 PolarHBondContact OG1-NH1 3.43Å; R52-R62 PolarHBondContact O-NH2 2.83Å; S54-R62 WeakPolarHBondContact O-CA 3.29Å; F55-R62 HydrophobicContact CD1-CB 4.22Å; F55-R62 HydrophobicContact CE1-CB 4.21Å; R62-F65 HydrophobicContact CG-CD1 4.42Å
63	T	85.8	Confident	87.9	Confident	66 Å²	66	76.3 Å²	76.3	41%	0.405	40%	0.395	S	S	.	.			trans	-107.4	-9.7	-178.9	54.3	0	0	0	0	113.3	N56 L61 P85	N56-T63 HydrophobicContact CB-CG2 4.25Å; L61-T63 HydrophobicContact CB-CG2 4.44Å; L61-T63 PolarHBondContact O-N 2.92Å; T63-P85 WeakPolarHBondContact O-CG 3.46Å
64	D	87.6	Confident	87	Confident	60 Å²	60	85.9 Å²	85.9	32%	0.321	44%	0.439	S	S	.	.	B	Isolated β-bridge	trans	-119.3	111.4	-178.9	171.8	38.8	0	0	0	107.9	S54	S54-D64 WeakPolarHBondContact OG-CB 3.45Å; S54-D64 PolarHBondContact OG-OD2 3.34Å; S54-D64 VanDerWaalsContact OG-OD2 3.04Å
65	F	89.6	Confident	86.6	Confident	61 Å²	61	93.9 Å²	93.9	27%	0.268	48%	0.475	S	S	.	.			trans	-163.4	151.7	-176.1	57.8	-92.7	0	0	0	109.9	R62 L67 W83 P85	R62-F65 HydrophobicContact CG-CD1 4.42Å; F65-L67 HydrophobicContact CD2-CD2 4.15Å; F65-L67 HydrophobicContact CD2-CG 3.95Å; F65-L67 HydrophobicContact CE2-CD1 3.95Å; F65-L67 HydrophobicContact CE2-CD2 4.16Å; F65-L67 HydrophobicContact CE2-CG 3.81Å; F65-W83 AromaticContact CE2-CZ3 3.83Å; F65-W83 HydrophobicContact CE2-CZ3 3.83Å; F65-W83 HydrophobicContact CZ-CZ3 4.21Å; F65-P85 WeakPolarHBondContact O-CD 3.47Å
66	D	90.1	Very high	86.4	Confident	97 Å²	97	92.7 Å²	92.7	52%	0.519	48%	0.476	S	S	.	.			trans	-101	142	174.5	-54.8	-41	0	0	0	109.8	W83	D66-W83 CarbonylContact C-O 3.58Å; D66-W83 WeakPolarHBondContact CA-O 3.34Å
67	L	92.1	Very high	86.4	Confident	88 Å²	88	95.9 Å²	95.9	46%	0.461	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.7	172.4	-69.4	178.4	0	0	0	110.4	F65 T82 W83	F65-L67 HydrophobicContact CD2-CD2 4.15Å; F65-L67 HydrophobicContact CD2-CG 3.95Å; F65-L67 HydrophobicContact CE2-CD1 3.95Å; F65-L67 HydrophobicContact CE2-CD2 4.16Å; F65-L67 HydrophobicContact CE2-CG 3.81Å; L67-T82 CarbonylContact O-C 3.51Å; L67-T82 WeakPolarHBondContact O-CA 3.3Å; L67-W83 HydrophobicContact CB-CB 4.31Å; L67-W83 HydrophobicContact CB-CE3 4.23Å; L67-W83 HydrophobicContact CD1-CE3 3.72Å; L67-W83 HydrophobicContact CD1-CZ3 4.06Å; L67-W83 HydrophobicContact CG-CE3 4.06Å; L67-W83 PolarHBondContact N-O 3.32Å; L67-W83 PolarHBondContact O-N 3.23Å
68	D	91.3	Very high	86.5	Confident	94 Å²	94	90.8 Å²	90.8	50%	0.503	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	126.1	174.2	-73.2	-3.6	0	0	0	110.3	K79	D68-K79 HydrophobicContact CB-CD 4.16Å; D68-K79 HydrophobicContact CB-CG 4.41Å; D68-K79 WeakPolarHBondContact OD1-CE 3.34Å; D68-K79 IonicContact OD1-NZ 2.65Å; D68-K79 PolarHBondContact OD1-NZ 2.79Å; D68-K79 WeakPolarHBondContact OD2-CD 3.26Å; D68-K79 WeakPolarHBondContact OD2-CE 3.47Å; D68-K79 IonicContact OD2-NZ 2.8Å; D68-K79 PolarHBondContact OD2-NZ 2.78Å
69	V	90.8	Very high	86.6	Confident	44 Å²	44	90.5 Å²	90.5	27%	0.267	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	118.9	173.7	-175.8	0	0	0	0	108.3	K79 I80 G81 L89	V69-K79 CarbonylContact O-C 3.41Å; V69-I80 HydrophobicContact CB-CG1 4.26Å; V69-I80 HydrophobicContact CG1-CD1 3.96Å; V69-I80 HydrophobicContact CG1-CG1 3.81Å; V69-I80 WeakPolarHBondContact O-CG1 3.35Å; V69-I80 PolarHBondContact O-N 2.79Å; V69-G81 PolarHBondContact N-O 2.8Å; V69-G81 PolarHBondContact O-N 2.87Å; V69-L89 HydrophobicContact CG2-CD1 3.56Å
70	I	90.3	Very high	86.6	Confident	106 Å²	106	89.2 Å²	89.2	54%	0.544	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146	-178.7	62.1	179.4	0	0	0	110.6	L77 E78 K79	I70-L77 HydrophobicContact CD1-CD2 4.22Å; I70-L77 HydrophobicContact CG1-CD2 4.45Å; I70-E78 CarbonylContact C-O 3.58Å; I70-E78 VanDerWaalsContact CA-O 3.26Å; I70-E78 WeakPolarHBondContact CA-O 3.5Å; I70-K79 HydrophobicContact CG2-CB 4.39Å
71	S	85.8	Confident	86.7	Confident	48 Å²	48	88.1 Å²	88.1	34%	0.336	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	142.2	175.9	-175.7	0	0	0	0	110.4	E78	S71-E78 PolarHBondContact N-O 3.18Å; S71-E78 PolarHBondContact O-N 3.07Å
72	L	83	Confident	86.8	Confident	131 Å²	131	84.7 Å²	84.7	69%	0.686	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	119.1	176	-178.3	67.6	0	0	0	109.2	L77	L72-L77 HydrophobicContact CB-CD2 4.19Å; L72-L77 HydrophobicContact CD1-CD2 4.35Å; L72-L77 HydrophobicContact CD1-CG 4.04Å
73	K	79.2	Confident	86.9	Confident	104 Å²	104	85.5 Å²	85.5	45%	0.452	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	176.2	171.1	-62.3	-169.5	-173.7	167.2	0	110.2	E75 G76 E78	K73-E75 VanDerWaalsContact C-N 3.27Å; K73-E75 PolarHBondContact O-N 2.76Å; K73-G76 PolarHBondContact N-O 2.87Å; K73-G76 PolarHBondContact O-N 2.48Å; K73-E78 WeakPolarHBondContact CD-OE2 3.13Å; K73-E78 VanDerWaalsContact CE-OE2 3.28Å; K73-E78 WeakPolarHBondContact CE-OE2 3.3Å; K73-E78 IonicContact NZ-OE2 2.77Å; K73-E78 PolarHBondContact NZ-OE2 3.15Å
74	E	72.5	Confident	87.2	Confident	209 Å²	209	83.8 Å²	83.8	98%	0.977	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-37.3	178.5	-65.4	-176.8	174.4	0	0	112.8	G76	E74-G76 VanDerWaalsContact C-N 3.31Å
75	E	78.9	Confident	87.2	Confident	186 Å²	186	83.9 Å²	83.9	87%	0.869	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-8.5	177.6	-60.4	-158.2	177.1	0	0	113.7	K73	K73-E75 VanDerWaalsContact C-N 3.27Å; K73-E75 PolarHBondContact O-N 2.76Å
76	G	86.6	Confident	87.1	Confident	25 Å²	25	85.9 Å²	85.9	26%	0.258	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	130.7	-163.2	178.2	0	0	0	0	0	114.3	K73 E74 E78	K73-G76 PolarHBondContact N-O 2.87Å; K73-G76 PolarHBondContact O-N 2.48Å; E74-G76 VanDerWaalsContact C-N 3.31Å; G76-E78 PolarHBondContact O-N 3.33Å
77	L	87.9	Confident	86.9	Confident	124 Å²	124	85.1 Å²	85.1	65%	0.649	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	118.6	178.7	-78.2	156.4	0	0	0	110.4	I70 L72	I70-L77 HydrophobicContact CD1-CD2 4.22Å; I70-L77 HydrophobicContact CG1-CD2 4.45Å; L72-L77 HydrophobicContact CB-CD2 4.19Å; L72-L77 HydrophobicContact CD1-CD2 4.35Å; L72-L77 HydrophobicContact CD1-CG 4.04Å
78	E	86.8	Confident	86.7	Confident	74 Å²	74	82 Å²	82	35%	0.346	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.7	177.1	-72	-176.4	-171.5	0	0	111.5	I70 S71 K73 G76 I80	I70-E78 CarbonylContact C-O 3.58Å; I70-E78 VanDerWaalsContact CA-O 3.26Å; I70-E78 WeakPolarHBondContact CA-O 3.5Å; S71-E78 PolarHBondContact N-O 3.18Å; S71-E78 PolarHBondContact O-N 3.07Å; K73-E78 WeakPolarHBondContact CD-OE2 3.13Å; K73-E78 VanDerWaalsContact CE-OE2 3.28Å; K73-E78 WeakPolarHBondContact CE-OE2 3.3Å; K73-E78 IonicContact NZ-OE2 2.77Å; K73-E78 PolarHBondContact NZ-OE2 3.15Å; G76-E78 PolarHBondContact O-N 3.33Å; E78-I80 PolarHBondContact O-N 2.89Å
79	K	86.6	Confident	86.5	Confident	105 Å²	105	82.2 Å²	82.2	46%	0.457	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	121.2	170.7	-179	179.1	176.7	167.9	0	109.9	D68 V69 I70 G81	D68-K79 HydrophobicContact CB-CD 4.16Å; D68-K79 HydrophobicContact CB-CG 4.41Å; D68-K79 WeakPolarHBondContact OD1-CE 3.34Å; D68-K79 IonicContact OD1-NZ 2.65Å; D68-K79 PolarHBondContact OD1-NZ 2.79Å; D68-K79 WeakPolarHBondContact OD2-CD 3.26Å; D68-K79 WeakPolarHBondContact OD2-CE 3.47Å; D68-K79 IonicContact OD2-NZ 2.8Å; D68-K79 PolarHBondContact OD2-NZ 2.78Å; V69-K79 CarbonylContact O-C 3.41Å; I70-K79 HydrophobicContact CG2-CB 4.39Å; K79-G81 WeakPolarHBondContact CE-O 3.49Å
80	I	87.4	Confident	86.3	Confident	50 Å²	50	83.8 Å²	83.8	26%	0.256	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-12.5	-177.9	59.4	162.9	0	0	0	113.2	V69 E78 M91 T92	V69-I80 HydrophobicContact CB-CG1 4.26Å; V69-I80 HydrophobicContact CG1-CD1 3.96Å; V69-I80 HydrophobicContact CG1-CG1 3.81Å; V69-I80 WeakPolarHBondContact O-CG1 3.35Å; V69-I80 PolarHBondContact O-N 2.79Å; E78-I80 PolarHBondContact O-N 2.89Å; I80-M91 HydrophobicContact CD1-CE 3.79Å; I80-M91 HydrophobicContact CD1-SD 4.37Å; I80-M91 HydrophobicContact CG1-CE 4.46Å; I80-M91 HydrophobicContact CG1-SD 4.41Å; I80-T92 PolarHBondContact O-N 2.84Å; I80-T92 PolarHBondContact O-OG1 2.9Å
81	G	89.9	Confident	85.8	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	176.8	179.9	0	0	0	0	0	114.4	V69 K79 T92	V69-G81 PolarHBondContact N-O 2.8Å; V69-G81 PolarHBondContact O-N 2.87Å; K79-G81 WeakPolarHBondContact CE-O 3.49Å; G81-T92 WeakPolarHBondContact CA-OG1 3.42Å
82	T	91.6	Very high	84.9	Confident	34 Å²	34	84.2 Å²	84.2	21%	0.209	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	141.7	173.9	50.1	0	0	0	0	109.2	L67 N90	L67-T82 CarbonylContact O-C 3.51Å; L67-T82 WeakPolarHBondContact O-CA 3.3Å; T82-N90 PolarHBondContact N-O 2.65Å; T82-N90 CarbonylContact O-C 3.49Å; T82-N90 WeakPolarHBondContact O-CA 3.46Å; T82-N90 PolarHBondContact O-N 2.74Å; T82-N90 PolarHBondContact OG1-O 2.91Å
83	W	91.8	Very high	83.5	Confident	90 Å²	90	81.5 Å²	81.5	34%	0.341	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.4	174.2	178.2	95.4	0	0	0	109.7	F65 D66 L67 P85 G88 L89	F65-W83 AromaticContact CE2-CZ3 3.83Å; F65-W83 HydrophobicContact CE2-CZ3 3.83Å; F65-W83 HydrophobicContact CZ-CZ3 4.21Å; D66-W83 CarbonylContact C-O 3.58Å; D66-W83 WeakPolarHBondContact CA-O 3.34Å; L67-W83 HydrophobicContact CB-CB 4.31Å; L67-W83 HydrophobicContact CB-CE3 4.23Å; L67-W83 HydrophobicContact CD1-CE3 3.72Å; L67-W83 HydrophobicContact CD1-CZ3 4.06Å; L67-W83 HydrophobicContact CG-CE3 4.06Å; L67-W83 PolarHBondContact N-O 3.32Å; L67-W83 PolarHBondContact O-N 3.23Å; W83-P85 HydrophobicContact CH2-CB 4.43Å; W83-P85 HydrophobicContact CH2-CG 4.12Å; W83-P85 HydrophobicContact CZ3-CG 4Å; W83-G88 WeakPolarHBondContact CA-O 3.35Å; W83-L89 HydrophobicContact CB-CD1 4.18Å; W83-L89 VanDerWaalsContact CD1-N 3.28Å
84	D	91	Very high	82.1	Confident	30 Å²	30	84.8 Å²	84.8	16%	0.16	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	154	172.1	71.9	-75.1	0	0	0	111.3	A86 S87 G88	D84-A86 PolarHBondContact O-N 2.79Å; D84-A86 WeakPolarHBondContact OD2-CA 3.26Å; D84-A86 WeakPolarHBondContact OD2-CB 3.34Å; D84-A86 PolarHBondContact OD2-N 3.49Å; D84-S87 VanDerWaalsContact OD1-CB 3.26Å; D84-S87 WeakPolarHBondContact OD1-CB 3.28Å; D84-S87 PolarHBondContact OD1-OG 3.26Å; D84-S87 PolarHBondContact OD2-N 3.48Å; D84-G88 PolarHBondContact N-O 2.95Å; D84-G88 VanDerWaalsContact N-O 3.15Å; D84-G88 VanDerWaalsContact O-CA 3.3Å; D84-G88 WeakPolarHBondContact O-CA 3.15Å; D84-G88 PolarHBondContact O-N 3.36Å
85	P	87.6	Confident	81	Confident	62 Å²	62	79.7 Å²	79.7	40%	0.403	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.9	-178.6	-27	33.8	0	0	0	115.3	T63 F65 W83	T63-P85 WeakPolarHBondContact O-CG 3.46Å; F65-P85 WeakPolarHBondContact O-CD 3.47Å; W83-P85 HydrophobicContact CH2-CB 4.43Å; W83-P85 HydrophobicContact CH2-CG 4.12Å; W83-P85 HydrophobicContact CZ3-CG 4Å
86	A	87.3	Confident	79.1	Confident	102 Å²	102	79.1 Å²	79.1	84%	0.843	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-41.3	-175	0	0	0	0	0	112.6	D84	D84-A86 PolarHBondContact O-N 2.79Å; D84-A86 WeakPolarHBondContact OD2-CA 3.26Å; D84-A86 WeakPolarHBondContact OD2-CB 3.34Å; D84-A86 PolarHBondContact OD2-N 3.49Å
87	S	86	Confident	76.8	Confident	81 Å²	81	81.2 Å²	81.2	57%	0.566	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-12.1	-175.5	100.2	0	0	0	0	113.9	D84	D84-S87 VanDerWaalsContact OD1-CB 3.26Å; D84-S87 WeakPolarHBondContact OD1-CB 3.28Å; D84-S87 PolarHBondContact OD1-OG 3.26Å; D84-S87 PolarHBondContact OD2-N 3.48Å
88	G	88.1	Confident	74.6	Confident	23 Å²	23	79.8 Å²	79.8	24%	0.237	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	77.5	-150.4	179.9	0	0	0	0	0	112.1	W83 D84 N90	W83-G88 WeakPolarHBondContact CA-O 3.35Å; D84-G88 PolarHBondContact N-O 2.95Å; D84-G88 VanDerWaalsContact N-O 3.15Å; D84-G88 VanDerWaalsContact O-CA 3.3Å; D84-G88 WeakPolarHBondContact O-CA 3.15Å; D84-G88 PolarHBondContact O-N 3.36Å; G88-N90 PolarHBondContact O-N 2.93Å
89	L	88.6	Confident	72	Confident	98 Å²	98	80.8 Å²	80.8	51%	0.513	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	113	-179.1	-178.7	63.1	0	0	0	110.1	V69 W83 M91	V69-L89 HydrophobicContact CG2-CD1 3.56Å; W83-L89 HydrophobicContact CB-CD1 4.18Å; W83-L89 VanDerWaalsContact CD1-N 3.28Å; L89-M91 HydrophobicContact CD1-SD 4.12Å; L89-M91 HydrophobicContact CD2-CE 4.35Å; L89-M91 HydrophobicContact CD2-CG 4.32Å; L89-M91 HydrophobicContact CD2-SD 4.19Å; L89-M91 HydrophobicContact CG-CG 4.27Å; L89-M91 HydrophobicContact CG-SD 4.27Å
90	N	85.6	Confident	69.6	Low	78 Å²	78	82 Å²	82	42%	0.417	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	99.1	170	-168.1	9.3	0	0	0	109.4	T82 G88 T92	T82-N90 PolarHBondContact N-O 2.65Å; T82-N90 CarbonylContact O-C 3.49Å; T82-N90 WeakPolarHBondContact O-CA 3.46Å; T82-N90 PolarHBondContact O-N 2.74Å; T82-N90 PolarHBondContact OG1-O 2.91Å; G88-N90 PolarHBondContact O-N 2.93Å; N90-T92 PolarHBondContact O-N 2.68Å
91	M	80.7	Confident	67.2	Low	82 Å²	82	84.3 Å²	84.3	40%	0.404	48%	0.484	S	S	.	.			trans	-67.5	119.6	171.5	-65.2	-65.1	-133.1	0	0	108.1	I80 L89 D93	I80-M91 HydrophobicContact CD1-CE 3.79Å; I80-M91 HydrophobicContact CD1-SD 4.37Å; I80-M91 HydrophobicContact CG1-CE 4.46Å; I80-M91 HydrophobicContact CG1-SD 4.41Å; L89-M91 HydrophobicContact CD1-SD 4.12Å; L89-M91 HydrophobicContact CD2-CE 4.35Å; L89-M91 HydrophobicContact CD2-CG 4.32Å; L89-M91 HydrophobicContact CD2-SD 4.19Å; L89-M91 HydrophobicContact CG-CG 4.27Å; L89-M91 HydrophobicContact CG-SD 4.27Å; M91-D93 PolarHBondContact O-N 2.92Å
92	T	66.6	Low	64.9	Low	80 Å²	80	91.3 Å²	91.3	49%	0.491	53%	0.526	S	S	.	.			trans	-69.6	75.4	166.6	29.6	0	0	0	0	107.2	I80 G81 N90 N94	I80-T92 PolarHBondContact O-N 2.84Å; I80-T92 PolarHBondContact O-OG1 2.9Å; G81-T92 WeakPolarHBondContact CA-OG1 3.42Å; N90-T92 PolarHBondContact O-N 2.68Å; T92-N94 VanDerWaalsContact C-N 3.27Å; T92-N94 PolarHBondContact O-N 3.22Å
93	D	53.8	Low	62.5	Low	75 Å²	75	93.6 Å²	93.6	40%	0.401	54%	0.544	S	S	.	.			trans	-77.2	91.9	176.2	-150.9	11.5	0	0	0	106.1	M91 Q95 K96	M91-D93 PolarHBondContact O-N 2.92Å; D93-Q95 VanDerWaalsContact CG-CB 3.46Å; D93-Q95 PolarHBondContact O-N 2.62Å; D93-Q95 WeakPolarHBondContact OD1-CB 3.16Å; D93-Q95 WeakPolarHBondContact OD1-CG 3.04Å; D93-Q95 PolarHBondContact OD1-N 2.78Å; D93-K96 PolarHBondContact O-N 3.2Å
94	N	48.2	Very low	60.5	Low	173 Å²	173	93.1 Å²	93.1	93%	0.925	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	10.9	153.8	-100.1	-7.5	0	0	0	111.4	T92	T92-N94 VanDerWaalsContact C-N 3.27Å; T92-N94 PolarHBondContact O-N 3.22Å
95	Q	49.5	Very low	58.9	Low	101 Å²	101	94.6 Å²	94.6	47%	0.472	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.2	15.7	158.9	-46.7	-171.2	3.1	0	0	115.2	D93 G97 K98	D93-Q95 VanDerWaalsContact CG-CB 3.46Å; D93-Q95 PolarHBondContact O-N 2.62Å; D93-Q95 WeakPolarHBondContact OD1-CB 3.16Å; D93-Q95 WeakPolarHBondContact OD1-CG 3.04Å; D93-Q95 PolarHBondContact OD1-N 2.78Å; Q95-G97 PolarHBondContact O-N 3.27Å; Q95-K98 HydrophobicContact CB-CB 3.65Å; Q95-K98 HydrophobicContact CB-CD 4.37Å; Q95-K98 HydrophobicContact CG-CB 4.4Å; Q95-K98 HydrophobicContact CG-CD 4.23Å; Q95-K98 CarbonylContact O-C 3.24Å; Q95-K98 VanDerWaalsContact O-C 3.24Å; Q95-K98 VanDerWaalsContact O-CA 3.24Å; Q95-K98 WeakPolarHBondContact O-CA 3.32Å; Q95-K98 WeakPolarHBondContact O-CB 3.24Å; Q95-K98 PolarHBondContact O-N 2.86Å
96	K	39.8	Very low	57.8	Low	175 Å²	175	92 Å²	92	76%	0.761	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-3	165.3	-92.2	-179.8	178.4	170.8	0	114.7	D93	D93-K96 PolarHBondContact O-N 3.2Å
97	G	38.3	Very low	56.6	Low	68 Å²	68	89.5 Å²	89.5	70%	0.701	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	2.4	157.3	0	0	0	0	0	114.1	Q95	Q95-G97 PolarHBondContact O-N 3.27Å
98	K	40.7	Very low	55.9	Low	95 Å²	95	92.9 Å²	92.9	41%	0.413	53%	0.532	S	S	.	.			trans	-111.1	53.4	171.9	-116.8	-172	-171.1	-164.7	0	107.4	Q95 T100 D104	Q95-K98 HydrophobicContact CB-CB 3.65Å; Q95-K98 HydrophobicContact CB-CD 4.37Å; Q95-K98 HydrophobicContact CG-CB 4.4Å; Q95-K98 HydrophobicContact CG-CD 4.23Å; Q95-K98 CarbonylContact O-C 3.24Å; Q95-K98 VanDerWaalsContact O-C 3.24Å; Q95-K98 VanDerWaalsContact O-CA 3.24Å; Q95-K98 WeakPolarHBondContact O-CA 3.32Å; Q95-K98 WeakPolarHBondContact O-CB 3.24Å; Q95-K98 PolarHBondContact O-N 2.86Å; K98-T100 VanDerWaalsContact C-N 3.32Å; K98-T100 PolarHBondContact O-N 3.11Å; K98-D104 IonicContact NZ-OD1 2.68Å; K98-D104 PolarHBondContact NZ-OD1 3.22Å
99	T	32.6	Very low	55.6	Low	95 Å²	95	97.7 Å²	97.7	58%	0.583	54%	0.543	S	S	*	.	S	Bend	trans	-47.9	109.6	147.4	44.3	0	0	0	0	106.1	N101	T99-N101 PolarHBondContact O-N 3.02Å; T99-N101 PolarHBondContact O-OD1 2.93Å
100	T	37.3	Very low	55.6	Low	131 Å²	131	96.5 Å²	96.5	80%	0.804	54%	0.543	S	S	*	.	S	Bend	trans	34.3	46.5	148.6	49.8	0	0	0	0	114.7	K98 V102	K98-T100 VanDerWaalsContact C-N 3.32Å; K98-T100 PolarHBondContact O-N 3.11Å; T100-V102 VanDerWaalsContact C-N 3.33Å; T100-V102 PolarHBondContact O-N 2.99Å; T100-V102 VanDerWaalsContact O-N 3.09Å
101	N	35.8	Very low	56	Low	97 Å²	97	93 Å²	93	52%	0.519	52%	0.524	S	S	.	.			trans	-85	98.5	173.2	-78.8	-17.5	0	0	0	102.6	T99 S103	T99-N101 PolarHBondContact O-N 3.02Å; T99-N101 PolarHBondContact O-OD1 2.93Å; N101-S103 PolarHBondContact O-N 3.48Å
102	V	41.4	Very low	56.8	Low	147 Å²	147	91 Å²	91	89%	0.891	51%	0.514	S	S	*	.	S	Bend	trans	-11.2	7.9	148.3	179.2	0	0	0	0	118	T100	T100-V102 VanDerWaalsContact C-N 3.33Å; T100-V102 PolarHBondContact O-N 2.99Å; T100-V102 VanDerWaalsContact O-N 3.09Å
103	S	42.7	Very low	58.2	Low	83 Å²	83	87.2 Å²	87.2	58%	0.58	49%	0.491	S	S	*	.			trans	-139.7	36	-171.5	71.8	0	0	0	0	113.9	N101 S105	N101-S103 PolarHBondContact O-N 3.48Å; S103-S105 PolarHBondContact O-N 3.5Å
104	D	49.3	Very low	60.3	Low	80 Å²	80	83.7 Å²	83.7	43%	0.428	47%	0.472	S	S	.	.			trans	-70.1	71.9	145.1	-110	37.4	0	0	0	105.1	K98 L106 R109 K455	K98-D104 IonicContact NZ-OD1 2.68Å; K98-D104 PolarHBondContact NZ-OD1 3.22Å; D104-L106 PolarHBondContact O-N 2.82Å; D104-R109 IonicContact OD2-NH2 3.35Å; D104-K455 PolarHBondContact O-NZ 3.21Å
105	S	57.1	Low	62.5	Low	61 Å²	61	75.5 Å²	75.5	43%	0.427	43%	0.429	S	S	.	.			trans	-56.3	129.4	-177.7	172.7	0	0	0	0	106.3	S103 S107	S103-S105 PolarHBondContact O-N 3.5Å; S105-S107 WeakPolarHBondContact CB-OG 3.49Å; S105-S107 PolarHBondContact O-N 3.34Å; S105-S107 WeakPolarHBondContact OG-CB 3.2Å; S105-S107 PolarHBondContact OG-N 3.43Å; S105-S107 VanDerWaalsContact OG-N 3.13Å; S105-S107 PolarHBondContact OG-OG 3.03Å
106	L	64.1	Low	64.6	Low	6 Å²	6	71.4 Å²	71.4	3%	0.031	41%	0.41	C	S	.	.	S	Bend	trans	-57.3	-10.5	169.8	-93.5	160.9	0	0	0	110.7	D104 N108 R109 L111 L152 F154 Y452 K455	D104-L106 PolarHBondContact O-N 2.82Å; L106-N108 PolarHBondContact O-N 3.05Å; L106-R109 PolarHBondContact O-N 2.9Å; L106-L111 HydrophobicContact CD2-CD1 4.01Å; L106-L152 HydrophobicContact CB-CB 4.22Å; L106-L152 WeakPolarHBondContact CB-O 2.98Å; L106-L152 HydrophobicContact CD1-CB 3.85Å; L106-L152 HydrophobicContact CD1-CD1 3.89Å; L106-L152 HydrophobicContact CD1-CD2 4.41Å; L106-L152 HydrophobicContact CD1-CG 4.27Å; L106-F154 HydrophobicContact CB-CB 4.06Å; L106-F154 HydrophobicContact CB-CD1 4.28Å; L106-F154 HydrophobicContact CD1-CD1 4.27Å; L106-F154 HydrophobicContact CD2-CB 4.14Å; L106-F154 HydrophobicContact CD2-CD1 4.45Å; L106-F154 VanDerWaalsContact O-CA 3.3Å; L106-F154 WeakPolarHBondContact O-CA 3.44Å; L106-F154 WeakPolarHBondContact O-CB 3.35Å; L106-Y452 HydrophobicContact CD1-CD1 4.44Å; L106-Y452 HydrophobicContact CD2-CD1 3.66Å; L106-Y452 HydrophobicContact CD2-CE1 3.67Å; L106-Y452 HydrophobicContact CD2-CG 4.46Å; L106-Y452 HydrophobicContact CG-CD1 4.3Å; L106-K455 HydrophobicContact CD1-CB 4.25Å; L106-K455 HydrophobicContact CD1-CD 3.86Å; L106-K455 HydrophobicContact CG-CD 4.39Å
107	S	62.9	Low	67.2	Low	51 Å²	51	66.8 Å²	66.8	36%	0.357	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.7	121.5	166.7	64.9	0	0	0	0	112.9	S105 G153	S105-S107 WeakPolarHBondContact CB-OG 3.49Å; S105-S107 PolarHBondContact O-N 3.34Å; S105-S107 WeakPolarHBondContact OG-CB 3.2Å; S105-S107 PolarHBondContact OG-N 3.43Å; S105-S107 VanDerWaalsContact OG-N 3.13Å; S105-S107 PolarHBondContact OG-OG 3.03Å; S107-G153 VanDerWaalsContact CA-O 3.23Å; S107-G153 WeakPolarHBondContact CA-O 3.39Å
108	N	70.6	Confident	69.7	Low	152 Å²	152	65.1 Å²	65.1	81%	0.813	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	16.1	175.1	-53.3	-21.6	0	0	0	116.5	L106	L106-N108 PolarHBondContact O-N 3.05Å
109	R	81.4	Confident	72.1	Confident	123 Å²	123	66.5 Å²	66.5	46%	0.464	38%	0.375	S	S	.	.			trans	-101.2	138.8	163.5	-64.6	-164.8	-174.4	-167.3	7.3	110.6	D104 L106 T155 Y452	D104-R109 IonicContact OD2-NH2 3.35Å; L106-R109 PolarHBondContact O-N 2.9Å; R109-T155 PolarHBondContact O-N 3.39Å; R109-T155 VanDerWaalsContact O-O 3.09Å; R109-T155 PolarHBondContact O-OG1 3.09Å; R109-Y452 PolarHBondContact NH1-OH 3.37Å
110	S	89.8	Confident	75	Confident	74 Å²	74	62.1 Å²	62.1	52%	0.517	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	112.6	171.4	-170.6	0	0	0	0	109.7	T155	S110-T155 CarbonylContact C-O 3.24Å; S110-T155 VanDerWaalsContact CA-O 3.27Å; S110-T155 WeakPolarHBondContact CA-O 3.38Å; S110-T155 VanDerWaalsContact CA-OG1 3.25Å; S110-T155 WeakPolarHBondContact CA-OG1 3.47Å; S110-T155 WeakPolarHBondContact CB-OG1 3.43Å; S110-T155 PolarHBondContact N-OG1 3.43Å
111	L	93.8	Very high	77.7	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	137.7	177.7	-60	-176.7	0	0	0	111.2	L106 F154 T155 Y156 E157 D189 Y452	L106-L111 HydrophobicContact CD2-CD1 4.01Å; L111-F154 HydrophobicContact CB-CD2 4.4Å; L111-F154 HydrophobicContact CD1-CB 4.35Å; L111-F154 HydrophobicContact CD1-CD1 4.48Å; L111-F154 HydrophobicContact CD1-CD2 3.79Å; L111-F154 HydrophobicContact CD1-CE2 4.19Å; L111-F154 HydrophobicContact CD1-CG 3.96Å; L111-F154 HydrophobicContact CG-CB 4.44Å; L111-F154 HydrophobicContact CG-CD2 4.15Å; L111-F154 HydrophobicContact CG-CG 4.44Å; L111-T155 PolarHBondContact N-O 3.23Å; L111-Y156 CarbonylContact O-C 3.46Å; L111-Y156 WeakPolarHBondContact O-CA 3.3Å; L111-E157 PolarHBondContact O-N 3.34Å; L111-D189 HydrophobicContact CB-CB 4.27Å; L111-D189 HydrophobicContact CD2-CB 4.08Å; L111-Y452 HydrophobicContact CD2-CD2 4.43Å; L111-Y452 HydrophobicContact CD2-CE2 3.84Å
112	I	96.1	Very high	80.6	Confident	40 Å²	40	51.3 Å²	51.3	21%	0.205	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	117.4	171	-60.5	169.8	0	0	0	108.1	R159 A188 D189 L190	I112-R159 HydrophobicContact CG2-CG 4.21Å; I112-A188 HydrophobicContact CG2-CB 4.37Å; I112-D189 PolarHBondContact N-OD2 3.45Å; I112-D189 PolarHBondContact O-N 3.28Å; I112-L190 PolarHBondContact O-N 3.35Å
113	V	97.1	Very high	83.1	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.006	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.2	-178.6	-174.7	0	0	0	0	109.3	L145 E157 R159 L190 V192	V113-L145 HydrophobicContact CB-CD2 4.26Å; V113-L145 HydrophobicContact CG1-CD1 4.4Å; V113-L145 HydrophobicContact CG1-CD2 4.01Å; V113-L145 HydrophobicContact CG2-CD1 3.96Å; V113-L145 HydrophobicContact CG2-CD2 4.12Å; V113-E157 PolarHBondContact N-O 2.83Å; V113-R159 PolarHBondContact O-N 3.09Å; V113-L190 CarbonylContact C-O 3.59Å; V113-L190 VanDerWaalsContact CA-O 3.31Å; V113-L190 WeakPolarHBondContact CA-O 3.08Å; V113-L190 HydrophobicContact CG2-CB 4.27Å; V113-L190 HydrophobicContact CG2-CD2 4.45Å; V113-V192 HydrophobicContact CG1-CB 3.99Å; V113-V192 HydrophobicContact CG1-CG2 3.92Å
114	S	96.8	Very high	85.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	134.5	172.5	-176.1	0	0	0	0	110.7	R159 E182 L190 A191 V192	S114-R159 WeakPolarHBondContact CA-O 3.09Å; S114-E182 VanDerWaalsContact CB-OE2 3.25Å; S114-E182 WeakPolarHBondContact CB-OE2 3.17Å; S114-E182 PolarHBondContact OG-OE2 3.35Å; S114-L190 PolarHBondContact N-O 3.11Å; S114-A191 WeakPolarHBondContact O-CA 3.29Å; S114-V192 PolarHBondContact O-N 2.64Å
115	S	96.1	Very high	87.6	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.014	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	170.3	175.2	-169	0	0	0	0	111.5	V122 R159 L160 V161 V192	S115-V122 VanDerWaalsContact OG-CG2 3.27Å; S115-V122 WeakPolarHBondContact OG-CG2 3.39Å; S115-R159 PolarHBondContact N-O 3.29Å; S115-L160 WeakPolarHBondContact O-CA 3.42Å; S115-V161 PolarHBondContact O-N 2.98Å; S115-V192 PolarHBondContact OG-O 3.02Å
116	I	93.9	Very high	89.1	Confident	15 Å²	15	54.9 Å²	54.9	8%	0.077	27%	0.268	C	S	.	.			trans	-120.3	152.3	174.6	-169.1	167.1	0	0	0	110	E118 V122 V161 G164 Y166 I179 A193	I116-E118 PolarHBondContact O-N 3.05Å; I116-V122 WeakPolarHBondContact O-CB 3.25Å; I116-V161 HydrophobicContact CB-CG1 4.13Å; I116-V161 HydrophobicContact CD1-CG1 4.43Å; I116-V161 HydrophobicContact CG1-CG1 4.16Å; I116-G164 VanDerWaalsContact CD1-O 3.24Å; I116-G164 WeakPolarHBondContact CD1-O 3.39Å; I116-Y166 HydrophobicContact CD1-CD2 4.38Å; I116-Y166 HydrophobicContact CD1-CE2 4.13Å; I116-Y166 HydrophobicContact CG2-CE1 3.73Å; I116-I179 HydrophobicContact CB-CD1 4.18Å; I116-I179 HydrophobicContact CG2-CD1 4.35Å; I116-A193 HydrophobicContact CG2-CB 4.28Å
117	L	93.1	Very high	90.2	Very high	78 Å²	78	57.5 Å²	57.5	41%	0.408	29%	0.287	S	S	.	.			trans	-78	115.5	172.6	-68.8	172	0	0	0	109.6	V122 F124 F137 L160	L117-V122 HydrophobicContact CD2-CG1 4.29Å; L117-F124 HydrophobicContact CD1-CD2 4.32Å; L117-F124 HydrophobicContact CD1-CE2 3.42Å; L117-F124 VanDerWaalsContact CD1-CE2 3.42Å; L117-F124 HydrophobicContact CD1-CZ 3.85Å; L117-F124 HydrophobicContact CD2-CD2 4.2Å; L117-F124 HydrophobicContact CD2-CE2 3.88Å; L117-F124 HydrophobicContact CD2-CZ 4.14Å; L117-F124 HydrophobicContact CG-CE2 4.32Å; L117-F137 HydrophobicContact CD2-CD1 4.32Å; L117-F137 HydrophobicContact CD2-CE1 4.08Å; L117-L160 HydrophobicContact CD1-CD1 3.9Å; L117-L160 HydrophobicContact CD2-CD1 4.13Å; L117-L160 HydrophobicContact CD2-CD2 4.02Å; L117-L160 HydrophobicContact CG-CD1 3.88Å; L117-L160 HydrophobicContact CG-CD2 3.95Å
118	E	90.5	Very high	91.4	Very high	32 Å²	32	63.4 Å²	63.4	15%	0.15	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-157.2	128.7	176	-170	161.2	143.5	0	0	110.1	I116 Y121 V122 Y166	I116-E118 PolarHBondContact O-N 3.05Å; E118-Y121 HydrophobicContact CB-CD2 4.46Å; E118-Y121 HydrophobicContact CG-CD2 4.24Å; E118-Y121 WeakPolarHBondContact O-CA 2.96Å; E118-Y121 WeakPolarHBondContact O-CB 3.34Å; E118-Y121 PolarHBondContact O-N 3.36Å; E118-V122 CarbonylContact C-O 3.54Å; E118-V122 PolarHBondContact N-O 2.7Å; E118-V122 PolarHBondContact O-N 3.48Å; E118-Y166 VanDerWaalsContact CD-OH 3.24Å; E118-Y166 PolarHBondContact OE2-OH 3.29Å
119	E	91.3	Very high	92.2	Very high	125 Å²	125	60.4 Å²	60.4	58%	0.584	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	136.7	178.9	-51.7	-164.5	163.1	0	0	111	M123 F422	E119-M123 HydrophobicContact CB-CG 4.22Å; E119-M123 HydrophobicContact CB-SD 3.79Å; E119-M123 HydrophobicContact CG-CG 3.88Å; E119-M123 HydrophobicContact CG-SD 3.69Å; E119-F422 HydrophobicContact CB-CE1 4.1Å; E119-F422 HydrophobicContact CB-CZ 4.14Å
120	P	93.2	Very high	92.5	Very high	2 Å²	2	59 Å²	59	1%	0.013	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	cis	-95.4	20.1	-4.4	38	-35.5	0	0	0	114.2	M123 G139 Y140 F422 W476 W477	P120-M123 HydrophobicContact CB-CE 4.38Å; P120-G139 CarbonylContact O-C 3.53Å; P120-G139 VanDerWaalsContact O-CA 3.27Å; P120-G139 WeakPolarHBondContact O-CA 3.46Å; P120-Y140 PolarHBondContact O-N 3.11Å; P120-F422 HydrophobicContact CB-CD2 3.96Å; P120-F422 HydrophobicContact CB-CE2 3.37Å; P120-F422 HydrophobicContact CB-CZ 3.9Å; P120-F422 HydrophobicContact CG-CD2 3.45Å; P120-F422 VanDerWaalsContact CG-CD2 3.45Å; P120-F422 HydrophobicContact CG-CE2 3.44Å; P120-F422 VanDerWaalsContact CG-CE2 3.44Å; P120-F422 HydrophobicContact CG-CG 4.18Å; P120-F422 HydrophobicContact CG-CZ 4.19Å; P120-W476 HydrophobicContact CB-CB 4.4Å; P120-W476 HydrophobicContact CB-CE3 4.42Å; P120-W477 HydrophobicContact CG-CD2 4.27Å; P120-W477 HydrophobicContact CG-CE3 4.09Å; P120-W477 HydrophobicContact CG-CH2 3.6Å; P120-W477 HydrophobicContact CG-CZ2 3.8Å; P120-W477 HydrophobicContact CG-CZ3 3.77Å
121	Y	95.1	Very high	92.6	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-52.6	-173.9	-61.1	-82.2	0	0	0	112.3	E118 G139 Y140 C141 P194 M212 T418 Y442 W477	E118-Y121 HydrophobicContact CB-CD2 4.46Å; E118-Y121 HydrophobicContact CG-CD2 4.24Å; E118-Y121 WeakPolarHBondContact O-CA 2.96Å; E118-Y121 WeakPolarHBondContact O-CB 3.34Å; E118-Y121 PolarHBondContact O-N 3.36Å; Y121-G139 CarbonylContact O-C 3.4Å; Y121-G139 VanDerWaalsContact O-C 3.24Å; Y121-G139 VanDerWaalsContact O-CA 3.29Å; Y121-G139 WeakPolarHBondContact O-CA 3.49Å; Y121-Y140 HydrophobicContact CD1-CD1 4.35Å; Y121-Y140 PolarHBondContact O-N 2.93Å; Y121-Y140 VanDerWaalsContact O-N 3.12Å; Y121-C141 WeakPolarHBondContact O-CB 3.47Å; Y121-C141 PolarHBondContact O-N 3Å; Y121-P194 HydrophobicContact CD1-CB 3.85Å; Y121-P194 HydrophobicContact CD1-CG 4.12Å; Y121-P194 HydrophobicContact CD2-CB 3.96Å; Y121-P194 HydrophobicContact CD2-CG 3.71Å; Y121-P194 HydrophobicContact CE1-CB 3.82Å; Y121-P194 HydrophobicContact CE2-CB 3.95Å; Y121-P194 HydrophobicContact CE2-CG 4.14Å; Y121-P194 HydrophobicContact CG-CB 3.92Å; Y121-P194 HydrophobicContact CG-CG 3.7Å; Y121-M212 HydrophobicContact CE1-SD 4.42Å; Y121-T418 WeakPolarHBondContact OH-CB 3.19Å; Y121-T418 PolarHBondContact OH-OG1 3.3Å; Y121-Y442 HydrophobicContact CE1-CD2 4.27Å; Y121-Y442 HydrophobicContact CE1-CE2 4.01Å; Y121-Y442 AromaticContact CZ-CE2 3.83Å; Y121-Y442 WeakPolarHBondContact OH-CE2 3.36Å; Y121-W477 HydrophobicContact CD1-CH2 4.11Å; Y121-W477 AromaticContact CE1-CH2 3.5Å; Y121-W477 HydrophobicContact CE1-CH2 3.5Å; Y121-W477 HydrophobicContact CE1-CZ2 4.06Å; Y121-W477 HydrophobicContact CE2-CH2 4.33Å; Y121-W477 HydrophobicContact CE2-CZ2 4.31Å; Y121-W477 AromaticContact CZ-CH2 3.61Å; Y121-W477 AromaticContact CZ-CZ2 3.68Å; Y121-W477 WeakPolarHBondContact OH-CZ2 3.46Å
122	V	95.9	Very high	92.4	Very high	1 Å²	1	66 Å²	66	1%	0.006	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-144.3	119.4	176.5	-179.3	0	0	0	0	109.6	S115 I116 L117 E118 F137 C141 I142	S115-V122 VanDerWaalsContact OG-CG2 3.27Å; S115-V122 WeakPolarHBondContact OG-CG2 3.39Å; I116-V122 WeakPolarHBondContact O-CB 3.25Å; L117-V122 HydrophobicContact CD2-CG1 4.29Å; E118-V122 CarbonylContact C-O 3.54Å; E118-V122 PolarHBondContact N-O 2.7Å; E118-V122 PolarHBondContact O-N 3.48Å; V122-F137 HydrophobicContact CG1-CB 4.25Å; V122-F137 HydrophobicContact CG1-CD1 4.03Å; V122-F137 HydrophobicContact CG1-CG 4.31Å; V122-C141 HydrophobicContact CG2-CB 3.75Å; V122-I142 HydrophobicContact CG1-CD1 4.06Å; V122-I142 HydrophobicContact CG1-CG1 4.41Å; V122-I142 HydrophobicContact CG2-CD1 3.85Å; V122-I142 HydrophobicContact CG2-CG1 4.21Å
123	M	94.6	Very high	92.1	Very high	32 Å²	32	66 Å²	66	16%	0.158	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	158	-175.9	-55.9	-177.1	-70.3	0	0	109.6	E119 P120 K125 F137 E138 W476	E119-M123 HydrophobicContact CB-CG 4.22Å; E119-M123 HydrophobicContact CB-SD 3.79Å; E119-M123 HydrophobicContact CG-CG 3.88Å; E119-M123 HydrophobicContact CG-SD 3.69Å; P120-M123 HydrophobicContact CB-CE 4.38Å; M123-K125 PolarHBondContact O-N 2.67Å; M123-F137 CarbonylContact O-C 3.53Å; M123-F137 VanDerWaalsContact O-CA 3.28Å; M123-F137 WeakPolarHBondContact O-CA 3.31Å; M123-E138 HydrophobicContact CB-CG 4.43Å; M123-E138 HydrophobicContact CE-CG 4.49Å; M123-E138 PolarHBondContact N-O 3.38Å; M123-E138 PolarHBondContact O-N 2.94Å; M123-W476 HydrophobicContact CE-CE3 3.98Å; M123-W476 HydrophobicContact CE-CH2 4.44Å; M123-W476 HydrophobicContact CE-CZ3 3.49Å; M123-W476 VanDerWaalsContact CE-CZ3 3.49Å
124	F	93.6	Very high	91.9	Very high	120 Å²	120	68.1 Å²	68.1	53%	0.526	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	128.7	168	-72.2	-69.6	0	0	0	110.2	L117 K126 F137 L160	L117-F124 HydrophobicContact CD1-CD2 4.32Å; L117-F124 HydrophobicContact CD1-CE2 3.42Å; L117-F124 VanDerWaalsContact CD1-CE2 3.42Å; L117-F124 HydrophobicContact CD1-CZ 3.85Å; L117-F124 HydrophobicContact CD2-CD2 4.2Å; L117-F124 HydrophobicContact CD2-CE2 3.88Å; L117-F124 HydrophobicContact CD2-CZ 4.14Å; L117-F124 HydrophobicContact CG-CE2 4.32Å; F124-K126 PolarHBondContact O-N 3.01Å; F124-F137 HydrophobicContact CD1-CD1 4.14Å; F124-F137 AromaticContact CD1-CE1 3.84Å; F124-F137 HydrophobicContact CD1-CE1 3.84Å; F124-F137 HydrophobicContact CE1-CD1 4.19Å; F124-F137 AromaticContact CE1-CE1 3.43Å; F124-F137 HydrophobicContact CE1-CE1 3.43Å; F124-F137 VanDerWaalsContact CE1-CE1 3.43Å; F124-F137 HydrophobicContact CE1-CZ 4.13Å; F124-F137 HydrophobicContact CZ-CE1 4.08Å; F124-L160 HydrophobicContact CZ-CD1 4.28Å
125	K	92.8	Very high	91.7	Very high	97 Å²	97	73.1 Å²	73.1	42%	0.422	38%	0.376	S	S	.	.			trans	-68.5	123	176	-176.9	168.5	-178.7	-174.9	0	110.1	M123 S127 L131 R136 E138	M123-K125 PolarHBondContact O-N 2.67Å; K125-S127 PolarHBondContact O-N 2.69Å; K125-L131 HydrophobicContact CB-CD1 4.17Å; K125-L131 HydrophobicContact CD-CD1 3.78Å; K125-L131 HydrophobicContact CG-CD1 4.02Å; K125-R136 PolarHBondContact N-O 3.05Å; K125-E138 HydrophobicContact CB-CB 4.24Å; K125-E138 HydrophobicContact CB-CG 4.1Å
126	K	88.6	Confident	91.6	Very high	197 Å²	197	78 Å²	78	86%	0.857	39%	0.394	S	S	*	.			trans	-73.6	114.6	174.3	-66.3	179.4	-177	173.6	0	109	F124	F124-K126 PolarHBondContact O-N 3.01Å
127	S	88.1	Confident	91.6	Very high	61 Å²	61	77.7 Å²	77.7	43%	0.427	39%	0.392	S	S	.	.			trans	-146	144.6	177.1	-166.5	0	0	0	0	110.3	K125 T129	K125-S127 PolarHBondContact O-N 2.69Å; S127-T129 PolarHBondContact O-N 2.96Å; S127-T129 PolarHBondContact OG-OG1 3.48Å
128	D	86.3	Confident	91.7	Very high	176 Å²	176	76.9 Å²	76.9	94%	0.941	39%	0.386	S	S	*	.	S	Bend	trans	-70.6	-19.6	176.3	-60.5	-38.6	0	0	0	112
129	T	88.9	Confident	92	Very high	88 Å²	88	75.4 Å²	75.4	54%	0.54	38%	0.379	S	S	.	.	S	Bend	trans	-104	145	177.5	56.4	0	0	0	0	111.5	S127 L131	S127-T129 PolarHBondContact O-N 2.96Å; S127-T129 PolarHBondContact OG-OG1 3.48Å; T129-L131 PolarHBondContact O-N 3.48Å; T129-L131 VanDerWaalsContact O-N 3.12Å
130	P	86.8	Confident	92.2	Very high	95 Å²	95	69.5 Å²	69.5	62%	0.617	35%	0.352	S	S	*	.			trans	-67.8	114.1	175.2	27.6	-32.5	0	0	0	109.4	Y132	P130-Y132 HydrophobicContact CB-CE2 4.16Å; P130-Y132 HydrophobicContact CG-CE2 4.29Å; P130-Y132 WeakPolarHBondContact O-CD2 3.24Å; P130-Y132 VanDerWaalsContact O-CE2 3.25Å; P130-Y132 WeakPolarHBondContact O-CE2 3.23Å
131	L	91.4	Very high	92.4	Very high	48 Å²	48	69.4 Å²	69.4	25%	0.251	35%	0.351	S	S	.	.			trans	-85.1	150.3	174	-60.1	175	0	0	0	109.8	K125 T129 D135 R136	K125-L131 HydrophobicContact CB-CD1 4.17Å; K125-L131 HydrophobicContact CD-CD1 3.78Å; K125-L131 HydrophobicContact CG-CD1 4.02Å; T129-L131 PolarHBondContact O-N 3.48Å; T129-L131 VanDerWaalsContact O-N 3.12Å; L131-D135 VanDerWaalsContact CD1-O 3.3Å; L131-D135 WeakPolarHBondContact CD1-O 3.5Å; L131-R136 VanDerWaalsContact C-CG 3.41Å; L131-R136 HydrophobicContact CB-CG 3.89Å; L131-R136 VanDerWaalsContact O-CD 3.25Å; L131-R136 WeakPolarHBondContact O-CD 3.3Å; L131-R136 WeakPolarHBondContact O-CG 3.46Å
132	Y	89.9	Confident	92.5	Very high	177 Å²	177	69.7 Å²	69.7	69%	0.694	35%	0.352	S	S	*	.			trans	-128.4	156	-179.5	-61.5	-86.3	0	0	0	110.7	P130	P130-Y132 HydrophobicContact CB-CE2 4.16Å; P130-Y132 HydrophobicContact CG-CE2 4.29Å; P130-Y132 WeakPolarHBondContact O-CD2 3.24Å; P130-Y132 VanDerWaalsContact O-CE2 3.25Å; P130-Y132 WeakPolarHBondContact O-CE2 3.23Å
133	G	91.2	Very high	92.6	Very high	39 Å²	39	70.3 Å²	70.3	40%	0.402	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	66.8	-133.5	178.7	0	0	0	0	0	113.1	R136	G133-R136 PolarHBondContact O-NE 3.44Å; G133-R136 PolarHBondContact O-NH2 3.4Å
134	N	92.7	Very high	92.7	Very high	46 Å²	46	68.8 Å²	68.8	25%	0.246	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-75.3	-28.4	-175.2	-64.2	-20.5	0	0	0	113.3	R136 F137 Y156 I158	N134-R136 PolarHBondContact O-N 3.27Å; N134-R136 VanDerWaalsContact O-N 3.08Å; N134-F137 PolarHBondContact O-N 3.29Å; N134-Y156 HydrophobicContact CB-CE2 4.34Å; N134-Y156 PolarHBondContact ND2-O 2.94Å; N134-I158 HydrophobicContact CB-CD1 4.05Å; N134-I158 PolarHBondContact OD1-N 3.41Å
135	D	91.4	Very high	92.8	Very high	105 Å²	105	63.2 Å²	63.2	56%	0.561	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-69	-10.8	-174.4	-66.8	-32.7	0	0	0	113.6	L131 F137	L131-D135 VanDerWaalsContact CD1-O 3.3Å; L131-D135 WeakPolarHBondContact CD1-O 3.5Å; D135-F137 PolarHBondContact O-N 3.27Å
136	R	93.9	Very high	93	Very high	103 Å²	103	63.5 Å²	63.5	39%	0.389	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-65.9	-20.9	174.2	-68	179.6	-64.7	172.7	4.1	113.3	K125 L131 G133 N134	K125-R136 PolarHBondContact N-O 3.05Å; L131-R136 VanDerWaalsContact C-CG 3.41Å; L131-R136 HydrophobicContact CB-CG 3.89Å; L131-R136 VanDerWaalsContact O-CD 3.25Å; L131-R136 WeakPolarHBondContact O-CD 3.3Å; L131-R136 WeakPolarHBondContact O-CG 3.46Å; G133-R136 PolarHBondContact O-NE 3.44Å; G133-R136 PolarHBondContact O-NH2 3.4Å; N134-R136 PolarHBondContact O-N 3.27Å; N134-R136 VanDerWaalsContact O-N 3.08Å
137	F	95.3	Very high	93.3	Very high	10 Å²	10	56.4 Å²	56.4	4%	0.044	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	145.4	-174	-57	-68.9	0	0	0	111.5	L117 V122 M123 F124 N134 D135 I142 I158 L160	L117-F137 HydrophobicContact CD2-CD1 4.32Å; L117-F137 HydrophobicContact CD2-CE1 4.08Å; V122-F137 HydrophobicContact CG1-CB 4.25Å; V122-F137 HydrophobicContact CG1-CD1 4.03Å; V122-F137 HydrophobicContact CG1-CG 4.31Å; M123-F137 CarbonylContact O-C 3.53Å; M123-F137 VanDerWaalsContact O-CA 3.28Å; M123-F137 WeakPolarHBondContact O-CA 3.31Å; F124-F137 HydrophobicContact CD1-CD1 4.14Å; F124-F137 AromaticContact CD1-CE1 3.84Å; F124-F137 HydrophobicContact CD1-CE1 3.84Å; F124-F137 HydrophobicContact CE1-CD1 4.19Å; F124-F137 AromaticContact CE1-CE1 3.43Å; F124-F137 HydrophobicContact CE1-CE1 3.43Å; F124-F137 VanDerWaalsContact CE1-CE1 3.43Å; F124-F137 HydrophobicContact CE1-CZ 4.13Å; F124-F137 HydrophobicContact CZ-CE1 4.08Å; N134-F137 PolarHBondContact O-N 3.29Å; D135-F137 PolarHBondContact O-N 3.27Å; F137-I142 HydrophobicContact CB-CD1 3.96Å; F137-I142 HydrophobicContact CB-CG1 4.03Å; F137-I158 HydrophobicContact CD2-CB 4.2Å; F137-I158 HydrophobicContact CD2-CD1 4.24Å; F137-I158 HydrophobicContact CD2-CG2 3.87Å; F137-I158 HydrophobicContact CE2-CB 4.37Å; F137-I158 HydrophobicContact CE2-CG2 3.98Å; F137-L160 HydrophobicContact CE1-CD1 3.88Å; F137-L160 HydrophobicContact CE1-CD2 4.03Å; F137-L160 HydrophobicContact CE1-CG 4.13Å; F137-L160 HydrophobicContact CZ-CD1 3.85Å; F137-L160 HydrophobicContact CZ-CD2 4.1Å; F137-L160 HydrophobicContact CZ-CG 3.84Å
138	E	95.4	Very high	93.7	Very high	61 Å²	61	53.6 Å²	53.6	29%	0.285	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	157.5	170.6	69.6	-175.9	174.1	0	0	110.1	M123 K125 W476	M123-E138 HydrophobicContact CB-CG 4.43Å; M123-E138 HydrophobicContact CE-CG 4.49Å; M123-E138 PolarHBondContact N-O 3.38Å; M123-E138 PolarHBondContact O-N 2.94Å; K125-E138 HydrophobicContact CB-CB 4.24Å; K125-E138 HydrophobicContact CB-CG 4.1Å; E138-W476 HydrophobicContact CB-CH2 4.06Å; E138-W476 HydrophobicContact CG-CH2 4.21Å
139	G	95.6	Very high	94	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	144.6	176.8	178.9	0	0	0	0	0	112.8	P120 Y121 C141 I142 D143 W476	P120-G139 CarbonylContact O-C 3.53Å; P120-G139 VanDerWaalsContact O-CA 3.27Å; P120-G139 WeakPolarHBondContact O-CA 3.46Å; Y121-G139 CarbonylContact O-C 3.4Å; Y121-G139 VanDerWaalsContact O-C 3.24Å; Y121-G139 VanDerWaalsContact O-CA 3.29Å; Y121-G139 WeakPolarHBondContact O-CA 3.49Å; G139-C141 PolarHBondContact O-N 3.04Å; G139-I142 PolarHBondContact O-N 2.78Å; G139-D143 PolarHBondContact O-N 3.14Å; G139-W476 VanDerWaalsContact C-CZ2 3.45Å; G139-W476 VanDerWaalsContact CA-CH2 3.42Å; G139-W476 VanDerWaalsContact CA-CZ2 3.4Å; G139-W476 VanDerWaalsContact N-CZ2 3.34Å
140	Y	96.7	Very high	94.3	Very high	1 Å²	1	46.8 Å²	46.8	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-45.2	-178.9	179.2	-87.9	0	0	0	112.7	P120 Y121 I142 D143 L144 F211 M212 M472 K473 W476 W477	P120-Y140 PolarHBondContact O-N 3.11Å; Y121-Y140 HydrophobicContact CD1-CD1 4.35Å; Y121-Y140 PolarHBondContact O-N 2.93Å; Y121-Y140 VanDerWaalsContact O-N 3.12Å; Y140-I142 VanDerWaalsContact C-N 3.27Å; Y140-I142 PolarHBondContact O-N 2.98Å; Y140-D143 PolarHBondContact O-N 2.94Å; Y140-L144 HydrophobicContact CE1-CD2 4.4Å; Y140-L144 WeakPolarHBondContact O-CB 3.1Å; Y140-L144 PolarHBondContact O-N 3.41Å; Y140-F211 HydrophobicContact CD1-CE2 4.42Å; Y140-F211 AromaticContact CE1-CD2 3.81Å; Y140-F211 HydrophobicContact CE1-CD2 3.81Å; Y140-F211 AromaticContact CE1-CE2 3.66Å; Y140-F211 HydrophobicContact CE1-CE2 3.66Å; Y140-M212 HydrophobicContact CD1-CE 4.37Å; Y140-M212 HydrophobicContact CD2-CE 4.47Å; Y140-M212 HydrophobicContact CE1-CE 3.81Å; Y140-M212 HydrophobicContact CE2-CE 3.91Å; Y140-M472 HydrophobicContact CD2-CB 3.95Å; Y140-M472 HydrophobicContact CE2-CB 3.64Å; Y140-K473 HydrophobicContact CE2-CB 4.23Å; Y140-W476 AromaticContact CD2-CD1 3.99Å; Y140-W477 AromaticContact CD2-CZ3 3.82Å; Y140-W477 HydrophobicContact CD2-CZ3 3.82Å; Y140-W477 HydrophobicContact CG-CH2 4.47Å; Y140-W477 AromaticContact CG-CZ3 3.89Å; Y140-W477 HydrophobicContact CG-CZ3 3.89Å
141	C	96.9	Very high	94.5	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.007	22%	0.218	C	C	.	.	H	α-helix	trans	-68.4	-29	179.6	-75	0	0	0	0	112	Y121 V122 G139 L145 V192	Y121-C141 WeakPolarHBondContact O-CB 3.47Å; Y121-C141 PolarHBondContact O-N 3Å; V122-C141 HydrophobicContact CG2-CB 3.75Å; G139-C141 PolarHBondContact O-N 3.04Å; C141-L145 VanDerWaalsContact O-CB 3.24Å; C141-L145 WeakPolarHBondContact O-CB 3.13Å; C141-L145 PolarHBondContact O-N 3.43Å; C141-V192 HydrophobicContact CB-CG1 4.06Å
142	I	96.9	Very high	94.5	Very high	5 Å²	5	43.9 Å²	43.9	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-71.6	-44.1	176.1	-54.4	-50.5	0	0	0	111	V122 F137 G139 Y140 L145 R146 I158	V122-I142 HydrophobicContact CG1-CD1 4.06Å; V122-I142 HydrophobicContact CG1-CG1 4.41Å; V122-I142 HydrophobicContact CG2-CD1 3.85Å; V122-I142 HydrophobicContact CG2-CG1 4.21Å; F137-I142 HydrophobicContact CB-CD1 3.96Å; F137-I142 HydrophobicContact CB-CG1 4.03Å; G139-I142 PolarHBondContact O-N 2.78Å; Y140-I142 VanDerWaalsContact C-N 3.27Å; Y140-I142 PolarHBondContact O-N 2.98Å; I142-L145 PolarHBondContact O-N 2.62Å; I142-R146 WeakPolarHBondContact O-CB 3.29Å; I142-R146 PolarHBondContact O-N 3.12Å; I142-I158 HydrophobicContact CD1-CD1 3.74Å
143	D	96.8	Very high	94.5	Very high	14 Å²	14	37.2 Å²	37.2	8%	0.075	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-41.6	175.4	-76.3	-12.9	0	0	0	111.3	G139 Y140 R146 E147 M472 K475 W476	G139-D143 PolarHBondContact O-N 3.14Å; Y140-D143 PolarHBondContact O-N 2.94Å; D143-R146 PolarHBondContact O-N 3.42Å; D143-R146 IonicContact OD1-CZ 2.7Å; D143-R146 IonicContact OD1-NH1 3.22Å; D143-R146 PolarHBondContact OD1-NH1 3.31Å; D143-E147 PolarHBondContact O-N 3.24Å; D143-M472 HydrophobicContact CB-SD 3.82Å; D143-K475 IonicContact OD2-NZ 3.22Å; D143-K475 PolarHBondContact OD2-NZ 3.26Å; D143-W476 WeakPolarHBondContact OD2-CZ2 3.45Å; D143-W476 PolarHBondContact OD2-NE1 3.49Å
144	L	97.1	Very high	94.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-48.6	173.2	175.5	62.2	0	0	0	111.6	Y140 R146 E147 L148 V192 F211 L463 L469 M472	Y140-L144 HydrophobicContact CE1-CD2 4.4Å; Y140-L144 WeakPolarHBondContact O-CB 3.1Å; Y140-L144 PolarHBondContact O-N 3.41Å; L144-R146 VanDerWaalsContact C-N 3.29Å; L144-R146 PolarHBondContact O-N 3.13Å; L144-E147 PolarHBondContact O-N 2.97Å; L144-L148 HydrophobicContact CD1-CD1 4.28Å; L144-L148 HydrophobicContact CD1-CG 4.26Å; L144-L148 HydrophobicContact CG-CD1 4.13Å; L144-L148 WeakPolarHBondContact O-CG 3.39Å; L144-L148 PolarHBondContact O-N 3.35Å; L144-V192 HydrophobicContact CD2-CG1 4.3Å; L144-F211 HydrophobicContact CD2-CB 4.38Å; L144-F211 HydrophobicContact CD2-CD1 4.02Å; L144-F211 HydrophobicContact CD2-CD2 3.91Å; L144-F211 HydrophobicContact CD2-CE1 4.25Å; L144-F211 HydrophobicContact CD2-CE2 4.17Å; L144-F211 HydrophobicContact CD2-CG 3.84Å; L144-F211 HydrophobicContact CD2-CZ 4.32Å; L144-L463 HydrophobicContact CD1-CD1 3.83Å; L144-L469 HydrophobicContact CD1-CD2 3.67Å; L144-M472 HydrophobicContact CD1-CE 4.26Å
145	L	96.5	Very high	94.6	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-60.8	-39.4	178.4	177.1	61.9	0	0	0	111.6	V113 C141 I142 L148 A149 F154 Y156 I158 L190 V192	V113-L145 HydrophobicContact CB-CD2 4.26Å; V113-L145 HydrophobicContact CG1-CD1 4.4Å; V113-L145 HydrophobicContact CG1-CD2 4.01Å; V113-L145 HydrophobicContact CG2-CD1 3.96Å; V113-L145 HydrophobicContact CG2-CD2 4.12Å; C141-L145 VanDerWaalsContact O-CB 3.24Å; C141-L145 WeakPolarHBondContact O-CB 3.13Å; C141-L145 PolarHBondContact O-N 3.43Å; I142-L145 PolarHBondContact O-N 2.62Å; L145-L148 PolarHBondContact O-N 3.24Å; L145-A149 VanDerWaalsContact O-CB 3.31Å; L145-A149 WeakPolarHBondContact O-CB 3.28Å; L145-A149 PolarHBondContact O-N 2.81Å; L145-F154 HydrophobicContact CD1-CE2 4.01Å; L145-F154 HydrophobicContact CD1-CZ 4.13Å; L145-Y156 HydrophobicContact CD1-CD1 4.38Å; L145-Y156 HydrophobicContact CD1-CG 4.33Å; L145-Y156 HydrophobicContact CD2-CD2 3.49Å; L145-Y156 VanDerWaalsContact CD2-CD2 3.49Å; L145-Y156 HydrophobicContact CD2-CE2 3.48Å; L145-Y156 VanDerWaalsContact CD2-CE2 3.48Å; L145-Y156 HydrophobicContact CD2-CG 4.03Å; L145-Y156 HydrophobicContact CG-CD1 4.19Å; L145-Y156 HydrophobicContact CG-CD2 4.05Å; L145-Y156 HydrophobicContact CG-CE1 4.08Å; L145-Y156 HydrophobicContact CG-CE2 3.93Å; L145-Y156 HydrophobicContact CG-CG 4.17Å; L145-I158 HydrophobicContact CD2-CD1 4.28Å; L145-I158 HydrophobicContact CD2-CG1 3.92Å; L145-L190 HydrophobicContact CD1-CD2 4.46Å; L145-V192 HydrophobicContact CB-CG1 4.39Å; L145-V192 HydrophobicContact CD1-CG2 4.06Å
146	R	96.1	Very high	94.8	Very high	104 Å²	104	34 Å²	34	39%	0.392	17%	0.172	S	C	.	.	H	α-helix	trans	-63.1	-44.7	175.7	-169.1	-174.8	-63.3	122.3	3.7	111.8	I142 D143 L144 A149 N150	I142-R146 WeakPolarHBondContact O-CB 3.29Å; I142-R146 PolarHBondContact O-N 3.12Å; D143-R146 PolarHBondContact O-N 3.42Å; D143-R146 IonicContact OD1-CZ 2.7Å; D143-R146 IonicContact OD1-NH1 3.22Å; D143-R146 PolarHBondContact OD1-NH1 3.31Å; L144-R146 VanDerWaalsContact C-N 3.29Å; L144-R146 PolarHBondContact O-N 3.13Å; R146-A149 PolarHBondContact O-N 3.06Å; R146-N150 WeakPolarHBondContact O-CB 3.44Å; R146-N150 PolarHBondContact O-N 2.84Å; R146-N150 PolarHBondContact O-ND2 2.86Å; R146-N150 PolarHBondContact O-OD1 2.93Å
147	E	96.1	Very high	94.9	Very high	48 Å²	48	32.9 Å²	32.9	22%	0.224	17%	0.171	C	C	.	.	H	α-helix	trans	-64.2	-42.4	176	-74.6	-63.2	128.6	0	0	112	D143 L144 A149 N150 I151 L463 K468 M472	D143-E147 PolarHBondContact O-N 3.24Å; L144-E147 PolarHBondContact O-N 2.97Å; E147-A149 VanDerWaalsContact C-N 3.33Å; E147-A149 PolarHBondContact O-N 3.37Å; E147-N150 PolarHBondContact O-N 3.32Å; E147-I151 WeakPolarHBondContact O-CG1 3.47Å; E147-I151 PolarHBondContact O-N 2.89Å; E147-L463 HydrophobicContact CB-CD1 4.09Å; E147-L463 HydrophobicContact CB-CD2 4.02Å; E147-L463 HydrophobicContact CG-CD2 4.43Å; E147-K468 IonicContact OE2-NZ 3.91Å; E147-K468 PolarHBondContact OE2-NZ 2.95Å; E147-M472 HydrophobicContact CG-SD 4.32Å
148	L	95.1	Very high	94.9	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-61	-43	175.3	-69.8	174.5	0	0	0	111.7	L144 L145 I151 L152 F154 V444 I456 A459 I460 L463	L144-L148 HydrophobicContact CD1-CD1 4.28Å; L144-L148 HydrophobicContact CD1-CG 4.26Å; L144-L148 HydrophobicContact CG-CD1 4.13Å; L144-L148 WeakPolarHBondContact O-CG 3.39Å; L144-L148 PolarHBondContact O-N 3.35Å; L145-L148 PolarHBondContact O-N 3.24Å; L148-I151 PolarHBondContact O-N 3.15Å; L148-L152 VanDerWaalsContact O-CB 3.31Å; L148-L152 WeakPolarHBondContact O-CB 3.49Å; L148-L152 WeakPolarHBondContact O-CG 3.42Å; L148-L152 PolarHBondContact O-N 3.47Å; L148-F154 HydrophobicContact CB-CE1 4.34Å; L148-F154 HydrophobicContact CB-CZ 4.16Å; L148-F154 WeakPolarHBondContact O-CE1 3.39Å; L148-V444 HydrophobicContact CD1-CG2 4.48Å; L148-I456 HydrophobicContact CD1-CG2 4.45Å; L148-A459 HydrophobicContact CD2-CB 3.7Å; L148-I460 HydrophobicContact CD2-CG1 4.08Å; L148-L463 HydrophobicContact CD2-CD1 4.03Å; L148-L463 HydrophobicContact CG-CD1 4.43Å
149	A	94.3	Very high	94.9	Very high	9 Å²	9	35 Å²	35	7%	0.074	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-39.2	176	0	0	0	0	0	112.2	L145 R146 E147 G153 F154 Y156	L145-A149 VanDerWaalsContact O-CB 3.31Å; L145-A149 WeakPolarHBondContact O-CB 3.28Å; L145-A149 PolarHBondContact O-N 2.81Å; R146-A149 PolarHBondContact O-N 3.06Å; E147-A149 VanDerWaalsContact C-N 3.33Å; E147-A149 PolarHBondContact O-N 3.37Å; A149-G153 WeakPolarHBondContact O-CA 3.35Å; A149-G153 PolarHBondContact O-N 2.93Å; A149-F154 HydrophobicContact CB-CD2 4.29Å; A149-F154 HydrophobicContact CB-CE1 4.27Å; A149-F154 HydrophobicContact CB-CE2 3.93Å; A149-F154 HydrophobicContact CB-CZ 3.91Å; A149-Y156 HydrophobicContact CB-CD1 3.7Å; A149-Y156 HydrophobicContact CB-CE1 3.54Å
150	N	93.5	Very high	94.9	Very high	112 Å²	112	37.9 Å²	37.9	60%	0.599	19%	0.191	S	C	*	.	H	α-helix	trans	-65.9	-40.1	177	-71.7	-18	0	0	0	112.5	R146 E147	R146-N150 WeakPolarHBondContact O-CB 3.44Å; R146-N150 PolarHBondContact O-N 2.84Å; R146-N150 PolarHBondContact O-ND2 2.86Å; R146-N150 PolarHBondContact O-OD1 2.93Å; E147-N150 PolarHBondContact O-N 3.32Å
151	I	92.1	Very high	94.8	Very high	54 Å²	54	38.4 Å²	38.4	28%	0.277	19%	0.194	S	C	.	.	H	α-helix	trans	-73.2	-44.2	179.9	-66.9	167.5	0	0	0	111.1	E147 L148 A459 L463	E147-I151 WeakPolarHBondContact O-CG1 3.47Å; E147-I151 PolarHBondContact O-N 2.89Å; L148-I151 PolarHBondContact O-N 3.15Å; I151-A459 HydrophobicContact CG2-CB 4.13Å; I151-L463 HydrophobicContact CD1-CD1 4.42Å; I151-L463 HydrophobicContact CD1-CD2 3.65Å; I151-L463 HydrophobicContact CD1-CG 3.87Å
152	L	91.4	Very high	94.5	Very high	28 Å²	28	45.9 Å²	45.9	15%	0.147	23%	0.229	C	C	.	.	H	α-helix	trans	-93.4	-14.9	-172.3	-63.4	175.3	0	0	0	113.6	L106 L148 F154 K455 I456 A459	L106-L152 HydrophobicContact CB-CB 4.22Å; L106-L152 WeakPolarHBondContact CB-O 2.98Å; L106-L152 HydrophobicContact CD1-CB 3.85Å; L106-L152 HydrophobicContact CD1-CD1 3.89Å; L106-L152 HydrophobicContact CD1-CD2 4.41Å; L106-L152 HydrophobicContact CD1-CG 4.27Å; L148-L152 VanDerWaalsContact O-CB 3.31Å; L148-L152 WeakPolarHBondContact O-CB 3.49Å; L148-L152 WeakPolarHBondContact O-CG 3.42Å; L148-L152 PolarHBondContact O-N 3.47Å; L152-F154 HydrophobicContact CB-CD1 3.67Å; L152-F154 HydrophobicContact CB-CE1 3.84Å; L152-F154 HydrophobicContact CD1-CD1 4.46Å; L152-F154 HydrophobicContact CD1-CE1 3.98Å; L152-F154 HydrophobicContact CG-CE1 4.45Å; L152-K455 HydrophobicContact CD1-CB 4.44Å; L152-K455 HydrophobicContact CD2-CB 4.05Å; L152-I456 HydrophobicContact CD1-CG1 3.91Å; L152-A459 HydrophobicContact CD1-CB 4.09Å; L152-A459 HydrophobicContact CD2-CB 4.25Å; L152-A459 HydrophobicContact CG-CB 4.14Å
153	G	89.8	Confident	94.2	Very high	37 Å²	37	49.1 Å²	49.1	38%	0.381	25%	0.247	S	C	.	.			trans	80.3	7.8	175.2	0	0	0	0	0	116.3	S107 A149	S107-G153 VanDerWaalsContact CA-O 3.23Å; S107-G153 WeakPolarHBondContact CA-O 3.39Å; A149-G153 WeakPolarHBondContact O-CA 3.35Å; A149-G153 PolarHBondContact O-N 2.93Å
154	F	92.2	Very high	93.8	Very high	7 Å²	7	50.7 Å²	50.7	3%	0.031	27%	0.266	C	S	.	.			trans	-80	152.4	179.2	61.7	-86.4	0	0	0	112.8	L106 L111 L145 L148 A149 L152 Y156	L106-F154 HydrophobicContact CB-CB 4.06Å; L106-F154 HydrophobicContact CB-CD1 4.28Å; L106-F154 HydrophobicContact CD1-CD1 4.27Å; L106-F154 HydrophobicContact CD2-CB 4.14Å; L106-F154 HydrophobicContact CD2-CD1 4.45Å; L106-F154 VanDerWaalsContact O-CA 3.3Å; L106-F154 WeakPolarHBondContact O-CA 3.44Å; L106-F154 WeakPolarHBondContact O-CB 3.35Å; L111-F154 HydrophobicContact CB-CD2 4.4Å; L111-F154 HydrophobicContact CD1-CB 4.35Å; L111-F154 HydrophobicContact CD1-CD1 4.48Å; L111-F154 HydrophobicContact CD1-CD2 3.79Å; L111-F154 HydrophobicContact CD1-CE2 4.19Å; L111-F154 HydrophobicContact CD1-CG 3.96Å; L111-F154 HydrophobicContact CG-CB 4.44Å; L111-F154 HydrophobicContact CG-CD2 4.15Å; L111-F154 HydrophobicContact CG-CG 4.44Å; L145-F154 HydrophobicContact CD1-CE2 4.01Å; L145-F154 HydrophobicContact CD1-CZ 4.13Å; L148-F154 HydrophobicContact CB-CE1 4.34Å; L148-F154 HydrophobicContact CB-CZ 4.16Å; L148-F154 WeakPolarHBondContact O-CE1 3.39Å; A149-F154 HydrophobicContact CB-CD2 4.29Å; A149-F154 HydrophobicContact CB-CE1 4.27Å; A149-F154 HydrophobicContact CB-CE2 3.93Å; A149-F154 HydrophobicContact CB-CZ 3.91Å; L152-F154 HydrophobicContact CB-CD1 3.67Å; L152-F154 HydrophobicContact CB-CE1 3.84Å; L152-F154 HydrophobicContact CD1-CD1 4.46Å; L152-F154 HydrophobicContact CD1-CE1 3.98Å; L152-F154 HydrophobicContact CG-CE1 4.45Å; F154-Y156 HydrophobicContact CD2-CD1 4.29Å; F154-Y156 AromaticContact CE2-CD1 3.97Å; F154-Y156 HydrophobicContact CE2-CD1 3.97Å; F154-Y156 HydrophobicContact CE2-CG 4.41Å
155	T	93.6	Very high	93.3	Very high	78 Å²	78	55.7 Å²	55.7	48%	0.479	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	157.6	163.3	55	0	0	0	0	109.4	R109 S110 L111	R109-T155 PolarHBondContact O-N 3.39Å; R109-T155 VanDerWaalsContact O-O 3.09Å; R109-T155 PolarHBondContact O-OG1 3.09Å; S110-T155 CarbonylContact C-O 3.24Å; S110-T155 VanDerWaalsContact CA-O 3.27Å; S110-T155 WeakPolarHBondContact CA-O 3.38Å; S110-T155 VanDerWaalsContact CA-OG1 3.25Å; S110-T155 WeakPolarHBondContact CA-OG1 3.47Å; S110-T155 WeakPolarHBondContact CB-OG1 3.43Å; S110-T155 PolarHBondContact N-OG1 3.43Å; L111-T155 PolarHBondContact N-O 3.23Å
156	Y	94.9	Very high	92.9	Very high	38 Å²	38	58.1 Å²	58.1	15%	0.149	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	156.7	-178.1	59.7	-93.1	0	0	0	112.4	L111 N134 L145 A149 F154 I158	L111-Y156 CarbonylContact O-C 3.46Å; L111-Y156 WeakPolarHBondContact O-CA 3.3Å; N134-Y156 HydrophobicContact CB-CE2 4.34Å; N134-Y156 PolarHBondContact ND2-O 2.94Å; L145-Y156 HydrophobicContact CD1-CD1 4.38Å; L145-Y156 HydrophobicContact CD1-CG 4.33Å; L145-Y156 HydrophobicContact CD2-CD2 3.49Å; L145-Y156 VanDerWaalsContact CD2-CD2 3.49Å; L145-Y156 HydrophobicContact CD2-CE2 3.48Å; L145-Y156 VanDerWaalsContact CD2-CE2 3.48Å; L145-Y156 HydrophobicContact CD2-CG 4.03Å; L145-Y156 HydrophobicContact CG-CD1 4.19Å; L145-Y156 HydrophobicContact CG-CD2 4.05Å; L145-Y156 HydrophobicContact CG-CE1 4.08Å; L145-Y156 HydrophobicContact CG-CE2 3.93Å; L145-Y156 HydrophobicContact CG-CG 4.17Å; A149-Y156 HydrophobicContact CB-CD1 3.7Å; A149-Y156 HydrophobicContact CB-CE1 3.54Å; F154-Y156 HydrophobicContact CD2-CD1 4.29Å; F154-Y156 AromaticContact CE2-CD1 3.97Å; F154-Y156 HydrophobicContact CE2-CD1 3.97Å; F154-Y156 HydrophobicContact CE2-CG 4.41Å; Y156-I158 HydrophobicContact CD2-CD1 4.43Å; Y156-I158 HydrophobicContact CD2-CG1 3.94Å; Y156-I158 HydrophobicContact CE2-CD1 3.93Å; Y156-I158 HydrophobicContact CE2-CG1 3.95Å
157	E	95.9	Very high	92.5	Very high	79 Å²	79	53.4 Å²	53.4	37%	0.369	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121.4	169.8	-171.3	-164.9	148.6	0	0	108.6	L111 V113 R159	L111-E157 PolarHBondContact O-N 3.34Å; V113-E157 PolarHBondContact N-O 2.83Å; E157-R159 IonicContact OE1-CZ 4Å; E157-R159 IonicContact OE1-NE 3.45Å; E157-R159 PolarHBondContact OE1-NE 3.15Å; E157-R159 IonicContact OE1-NH2 3.97Å; E157-R159 PolarHBondContact OE1-NH2 3.39Å; E157-R159 IonicContact OE2-CZ 2.93Å; E157-R159 IonicContact OE2-NE 3.31Å; E157-R159 IonicContact OE2-NH2 3.74Å; E157-R159 PolarHBondContact OE2-NH2 3.27Å
158	I	95.9	Very high	91.9	Very high	6 Å²	6	52.5 Å²	52.5	3%	0.031	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	124.3	177.3	-59.4	162.1	0	0	0	109.2	N134 F137 I142 L145 Y156	N134-I158 HydrophobicContact CB-CD1 4.05Å; N134-I158 PolarHBondContact OD1-N 3.41Å; F137-I158 HydrophobicContact CD2-CB 4.2Å; F137-I158 HydrophobicContact CD2-CD1 4.24Å; F137-I158 HydrophobicContact CD2-CG2 3.87Å; F137-I158 HydrophobicContact CE2-CB 4.37Å; F137-I158 HydrophobicContact CE2-CG2 3.98Å; I142-I158 HydrophobicContact CD1-CD1 3.74Å; L145-I158 HydrophobicContact CD2-CD1 4.28Å; L145-I158 HydrophobicContact CD2-CG1 3.92Å; Y156-I158 HydrophobicContact CD2-CD1 4.43Å; Y156-I158 HydrophobicContact CD2-CG1 3.94Å; Y156-I158 HydrophobicContact CE2-CD1 3.93Å; Y156-I158 HydrophobicContact CE2-CG1 3.95Å
159	R	95.5	Very high	91.5	Very high	111 Å²	111	57 Å²	57	42%	0.419	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	137.6	170.9	-64.6	-169.4	-178.2	162.9	8.3	110.3	I112 V113 S114 S115 E157	I112-R159 HydrophobicContact CG2-CG 4.21Å; V113-R159 PolarHBondContact O-N 3.09Å; S114-R159 WeakPolarHBondContact CA-O 3.09Å; S115-R159 PolarHBondContact N-O 3.29Å; E157-R159 IonicContact OE1-CZ 4Å; E157-R159 IonicContact OE1-NE 3.45Å; E157-R159 PolarHBondContact OE1-NE 3.15Å; E157-R159 IonicContact OE1-NH2 3.97Å; E157-R159 PolarHBondContact OE1-NH2 3.39Å; E157-R159 IonicContact OE2-CZ 2.93Å; E157-R159 IonicContact OE2-NE 3.31Å; E157-R159 IonicContact OE2-NH2 3.74Å; E157-R159 PolarHBondContact OE2-NH2 3.27Å
160	L	95.8	Very high	91.1	Very high	59 Å²	59	59.7 Å²	59.7	31%	0.309	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	138.2	172.2	-63.1	177.7	0	0	0	108.9	S115 L117 F124 F137 E162	S115-L160 WeakPolarHBondContact O-CA 3.42Å; L117-L160 HydrophobicContact CD1-CD1 3.9Å; L117-L160 HydrophobicContact CD2-CD1 4.13Å; L117-L160 HydrophobicContact CD2-CD2 4.02Å; L117-L160 HydrophobicContact CG-CD1 3.88Å; L117-L160 HydrophobicContact CG-CD2 3.95Å; F124-L160 HydrophobicContact CZ-CD1 4.28Å; F137-L160 HydrophobicContact CE1-CD1 3.88Å; F137-L160 HydrophobicContact CE1-CD2 4.03Å; F137-L160 HydrophobicContact CE1-CG 4.13Å; F137-L160 HydrophobicContact CZ-CD1 3.85Å; F137-L160 HydrophobicContact CZ-CD2 4.1Å; F137-L160 HydrophobicContact CZ-CG 3.84Å; L160-E162 PolarHBondContact O-N 3.08Å
161	V	95.3	Very high	90.5	Very high	12 Å²	12	61.1 Å²	61.1	7%	0.073	32%	0.319	C	S	.	.			trans	-58	133.6	174	63.7	0	0	0	0	110.8	S115 I116 D163 G164 I179	S115-V161 PolarHBondContact O-N 2.98Å; I116-V161 HydrophobicContact CB-CG1 4.13Å; I116-V161 HydrophobicContact CD1-CG1 4.43Å; I116-V161 HydrophobicContact CG1-CG1 4.16Å; V161-D163 VanDerWaalsContact CG2-OD1 3.29Å; V161-D163 WeakPolarHBondContact CG2-OD1 3.41Å; V161-D163 PolarHBondContact O-N 3.37Å; V161-G164 PolarHBondContact O-N 3.23Å; V161-I179 HydrophobicContact CB-CG1 3.85Å; V161-I179 HydrophobicContact CG1-CG1 4.13Å; V161-I179 HydrophobicContact CG2-CG1 3.98Å
162	E	91	Very high	90.3	Very high	158 Å²	158	65.8 Å²	65.8	74%	0.738	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-37.6	-171	-66.2	177	151.5	0	0	113.5	L160 R187	L160-E162 PolarHBondContact O-N 3.08Å; E162-R187 IonicContact OE1-NH1 2.67Å; E162-R187 IonicContact OE2-CZ 2.83Å; E162-R187 IonicContact OE2-NH1 3.02Å; E162-R187 PolarHBondContact OE2-NH1 3.39Å
163	D	88.9	Confident	90.1	Very high	73 Å²	73	68.7 Å²	68.7	39%	0.39	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-2.3	-175.3	68.4	1.2	0	0	0	113.9	V161 K165 G178	V161-D163 VanDerWaalsContact CG2-OD1 3.29Å; V161-D163 WeakPolarHBondContact CG2-OD1 3.41Å; V161-D163 PolarHBondContact O-N 3.37Å; D163-K165 VanDerWaalsContact C-N 3.26Å; D163-K165 PolarHBondContact O-N 3.35Å; D163-K165 PolarHBondContact OD1-N 3.05Å; D163-G178 WeakPolarHBondContact OD1-CA 3.29Å; D163-G178 WeakPolarHBondContact OD2-CA 3.46Å; D163-G178 PolarHBondContact OD2-N 2.83Å
164	G	88.3	Confident	90	Very high	47 Å²	47	68.6 Å²	68.6	49%	0.485	36%	0.363	S	S	.	.	S	Bend	trans	65.1	23.3	-177.2	0	0	0	0	0	114.2	I116 V161	I116-G164 VanDerWaalsContact CD1-O 3.24Å; I116-G164 WeakPolarHBondContact CD1-O 3.39Å; V161-G164 PolarHBondContact O-N 3.23Å
165	K	87.7	Confident	89.9	Confident	106 Å²	106	74.8 Å²	74.8	46%	0.461	39%	0.392	S	S	.	.			trans	-118	148.4	-177.6	-63.7	-178.7	-178.3	-172.4	0	112.4	D163 G167 G178 I179	D163-K165 VanDerWaalsContact C-N 3.26Å; D163-K165 PolarHBondContact O-N 3.35Å; D163-K165 PolarHBondContact OD1-N 3.05Å; K165-G167 VanDerWaalsContact C-N 3.33Å; K165-G167 PolarHBondContact O-N 3.27Å; K165-G178 WeakPolarHBondContact O-CA 3.2Å; K165-I179 PolarHBondContact O-N 3.02Å; K165-I179 VanDerWaalsContact O-N 3.15Å
166	Y	87.8	Confident	89.8	Confident	53 Å²	53	72.3 Å²	72.3	21%	0.208	37%	0.374	C	S	.	.			trans	-65.2	-36.4	173.5	-75.1	-76.5	0	0	0	113.5	I116 E118 I179 V180 P194 L195	I116-Y166 HydrophobicContact CD1-CD2 4.38Å; I116-Y166 HydrophobicContact CD1-CE2 4.13Å; I116-Y166 HydrophobicContact CG2-CE1 3.73Å; E118-Y166 VanDerWaalsContact CD-OH 3.24Å; E118-Y166 PolarHBondContact OE2-OH 3.29Å; Y166-I179 WeakPolarHBondContact O-CB 3.04Å; Y166-I179 PolarHBondContact O-N 2.96Å; Y166-V180 PolarHBondContact O-N 3.24Å; Y166-P194 HydrophobicContact CE1-CG 4.15Å; Y166-P194 WeakPolarHBondContact CE1-O 3.49Å; Y166-P194 VanDerWaalsContact OH-CG 3.26Å; Y166-P194 WeakPolarHBondContact OH-CG 3.44Å; Y166-L195 HydrophobicContact CD1-CD1 3.91Å
167	G	86.7	Confident	89.7	Confident	5 Å²	5	72.9 Å²	72.9	5%	0.052	38%	0.379	C	S	.	.			trans	117.2	112.4	-173.2	0	0	0	0	0	111.9	K165 N177 R201	K165-G167 VanDerWaalsContact C-N 3.33Å; K165-G167 PolarHBondContact O-N 3.27Å; G167-N177 WeakPolarHBondContact CA-O 3.34Å; G167-N177 WeakPolarHBondContact CA-OD1 3.27Å; G167-R201 PolarHBondContact O-NE 3.09Å; G167-R201 PolarHBondContact O-NH2 3.21Å; G167-R201 VanDerWaalsContact O-NH2 3.08Å
168	A	84.9	Confident	89.5	Confident	30 Å²	30	69.3 Å²	69.3	25%	0.248	36%	0.364	C	S	.	.			trans	-129.3	149.3	173.9	0	0	0	0	0	109	N177	A168-N177 PolarHBondContact N-OD1 2.97Å; A168-N177 PolarHBondContact O-N 3.17Å; A168-N177 PolarHBondContact O-OD1 3.29Å; A168-N177 VanDerWaalsContact O-OD1 3.12Å
169	Q	86.2	Confident	89.5	Confident	95 Å²	95	69 Å²	69	44%	0.444	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-86.2	125.7	174.5	-169.8	174.9	30	0	0	109.1	E171 G174 Q175 W176	Q169-E171 PolarHBondContact O-N 2.86Å; Q169-G174 PolarHBondContact NE2-O 3.35Å; Q169-Q175 WeakPolarHBondContact CA-O 3.35Å; Q169-W176 HydrophobicContact CB-CD2 4.06Å; Q169-W176 HydrophobicContact CB-CE3 4.31Å; Q169-W176 HydrophobicContact CB-CH2 4.29Å; Q169-W176 HydrophobicContact CB-CZ2 4.02Å; Q169-W176 HydrophobicContact CB-CZ3 4.41Å
170	D	85.9	Confident	89.4	Confident	65 Å²	65	63.7 Å²	63.7	35%	0.348	34%	0.342	S	S	.	.			trans	-69.7	126.4	169.9	175.5	11.6	0	0	0	109.7	N172 T173 G174 Q175	D170-N172 VanDerWaalsContact C-N 3.26Å; D170-N172 PolarHBondContact O-N 3.41Å; D170-N172 PolarHBondContact OD1-N 2.98Å; D170-T173 WeakPolarHBondContact CB-OG1 3.49Å; D170-T173 VanDerWaalsContact CG-OG1 3.31Å; D170-T173 WeakPolarHBondContact OD2-CG2 3.23Å; D170-T173 PolarHBondContact OD2-OG1 2.9Å; D170-G174 WeakPolarHBondContact O-CA 3.46Å; D170-G174 PolarHBondContact O-N 3Å; D170-Q175 PolarHBondContact N-O 3Å
171	E	81.6	Confident	89.4	Confident	142 Å²	142	63.6 Å²	63.6	66%	0.664	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-26.2	-177.3	-65.3	-172.7	168.1	0	0	112.2	Q169 K373	Q169-E171 PolarHBondContact O-N 2.86Å; E171-K373 IonicContact OE1-NZ 2.82Å; E171-K373 PolarHBondContact OE1-NZ 3.19Å; E171-K373 IonicContact OE2-NZ 3.77Å; E171-K373 PolarHBondContact OE2-NZ 3.04Å
172	N	86.7	Confident	89.4	Confident	153 Å²	153	63.7 Å²	63.7	82%	0.818	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-44.6	-177.6	-62.1	-53.3	0	0	0	112.7	D170	D170-N172 VanDerWaalsContact C-N 3.26Å; D170-N172 PolarHBondContact O-N 3.41Å; D170-N172 PolarHBondContact OD1-N 2.98Å
173	T	88.3	Confident	89.7	Confident	88 Å²	88	56.2 Å²	56.2	54%	0.54	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-17.5	-174.8	61.7	0	0	0	0	113.2	D170 Q175	D170-T173 WeakPolarHBondContact CB-OG1 3.49Å; D170-T173 VanDerWaalsContact CG-OG1 3.31Å; D170-T173 WeakPolarHBondContact OD2-CG2 3.23Å; D170-T173 PolarHBondContact OD2-OG1 2.9Å; T173-Q175 PolarHBondContact O-N 3.38Å; T173-Q175 PolarHBondContact OG1-N 2.89Å
174	G	86.5	Confident	89.9	Confident	35 Å²	35	55.8 Å²	55.8	36%	0.361	30%	0.3	S	S	.	.			trans	69.2	3.6	-172.6	0	0	0	0	0	114.1	Q169 D170	Q169-G174 PolarHBondContact NE2-O 3.35Å; D170-G174 WeakPolarHBondContact O-CA 3.46Å; D170-G174 PolarHBondContact O-N 3Å
175	Q	91.4	Very high	90.3	Very high	137 Å²	137	57.1 Å²	57.1	64%	0.64	30%	0.296	S	S	*	.			trans	-81.1	147.8	-178.3	-65.3	-162.4	-2.4	0	0	112	Q169 D170 T173	Q169-Q175 WeakPolarHBondContact CA-O 3.35Å; D170-Q175 PolarHBondContact N-O 3Å; T173-Q175 PolarHBondContact O-N 3.38Å; T173-Q175 PolarHBondContact OG1-N 2.89Å
176	W	91.8	Very high	90.5	Very high	26 Å²	26	58.1 Å²	58.1	10%	0.098	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-96	148.9	174.5	-73.2	89.9	0	0	0	110.9	Q169 V180 K181 M184 V200 R201 V204	Q169-W176 HydrophobicContact CB-CD2 4.06Å; Q169-W176 HydrophobicContact CB-CE3 4.31Å; Q169-W176 HydrophobicContact CB-CH2 4.29Å; Q169-W176 HydrophobicContact CB-CZ2 4.02Å; Q169-W176 HydrophobicContact CB-CZ3 4.41Å; W176-V180 HydrophobicContact CD2-CG1 3.94Å; W176-V180 HydrophobicContact CE3-CB 4.02Å; W176-V180 HydrophobicContact CE3-CG1 3.6Å; W176-V180 HydrophobicContact CE3-CG2 4.47Å; W176-V180 HydrophobicContact CG-CG1 4.42Å; W176-V180 HydrophobicContact CZ3-CB 4.41Å; W176-V180 HydrophobicContact CZ3-CG1 3.98Å; W176-V180 HydrophobicContact CZ3-CG2 4.39Å; W176-K181 HydrophobicContact CB-CB 4.24Å; W176-K181 HydrophobicContact CB-CD 4.32Å; W176-K181 WeakPolarHBondContact O-CB 3.31Å; W176-K181 WeakPolarHBondContact O-CD 3.47Å; W176-K181 VanDerWaalsContact O-CG 3.25Å; W176-K181 WeakPolarHBondContact O-CG 3.5Å; W176-M184 HydrophobicContact CB-SD 3.92Å; W176-M184 HydrophobicContact CG-SD 3.8Å; W176-V200 HydrophobicContact CH2-CB 4.35Å; W176-V200 HydrophobicContact CH2-CG1 3.7Å; W176-V200 HydrophobicContact CZ2-CG1 3.72Å; W176-V200 WeakPolarHBondContact CZ2-O 3.3Å; W176-R201 HydrophobicContact CH2-CG 4.02Å; W176-R201 HydrophobicContact CZ3-CG 4.08Å; W176-V204 HydrophobicContact CD2-CG2 4.47Å; W176-V204 HydrophobicContact CH2-CG2 4.43Å; W176-V204 HydrophobicContact CZ2-CG1 4.39Å; W176-V204 HydrophobicContact CZ2-CG2 3.89Å
177	N	91.3	Very high	90.9	Very high	50 Å²	50	61 Å²	61	27%	0.267	31%	0.313	S	S	.	.			trans	-120.9	-172.2	171.3	62.5	15.2	0	0	0	111.3	G167 A168 K181	G167-N177 WeakPolarHBondContact CA-O 3.34Å; G167-N177 WeakPolarHBondContact CA-OD1 3.27Å; A168-N177 PolarHBondContact N-OD1 2.97Å; A168-N177 PolarHBondContact O-N 3.17Å; A168-N177 PolarHBondContact O-OD1 3.29Å; A168-N177 VanDerWaalsContact O-OD1 3.12Å; N177-K181 WeakPolarHBondContact O-CB 2.98Å; N177-K181 PolarHBondContact O-N 3.26Å
178	G	92.7	Very high	91.3	Very high	4 Å²	4	60.8 Å²	60.8	4%	0.041	31%	0.311	C	S	.	.	H	α-helix	trans	62.2	-158.2	173	0	0	0	0	0	116.2	D163 K165 V180 K181 E182	D163-G178 WeakPolarHBondContact OD1-CA 3.29Å; D163-G178 WeakPolarHBondContact OD2-CA 3.46Å; D163-G178 PolarHBondContact OD2-N 2.83Å; K165-G178 WeakPolarHBondContact O-CA 3.2Å; G178-V180 PolarHBondContact O-N 3.28Å; G178-K181 WeakPolarHBondContact O-CB 3.23Å; G178-K181 PolarHBondContact O-N 3.25Å; G178-E182 PolarHBondContact O-N 3.38Å; G178-E182 VanDerWaalsContact O-N 3.17Å
179	I	94.8	Very high	91.7	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-55.2	-40.8	179.5	-61	175.6	0	0	0	111.4	I116 V161 K165 Y166 K181 E182 L183 A191 A193	I116-I179 HydrophobicContact CB-CD1 4.18Å; I116-I179 HydrophobicContact CG2-CD1 4.35Å; V161-I179 HydrophobicContact CB-CG1 3.85Å; V161-I179 HydrophobicContact CG1-CG1 4.13Å; V161-I179 HydrophobicContact CG2-CG1 3.98Å; K165-I179 PolarHBondContact O-N 3.02Å; K165-I179 VanDerWaalsContact O-N 3.15Å; Y166-I179 WeakPolarHBondContact O-CB 3.04Å; Y166-I179 PolarHBondContact O-N 2.96Å; I179-K181 VanDerWaalsContact C-N 3.3Å; I179-K181 PolarHBondContact O-N 2.83Å; I179-E182 PolarHBondContact O-N 3.48Å; I179-L183 PolarHBondContact O-N 2.86Å; I179-L183 VanDerWaalsContact O-N 3.09Å; I179-A191 HydrophobicContact CG2-CB 3.37Å; I179-A193 HydrophobicContact CD1-CB 4.01Å
180	V	94.6	Very high	92.2	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.3	-43	178.4	177.1	0	0	0	0	111.1	Y166 W176 G178 L183 M184 R201 V204 I205	Y166-V180 PolarHBondContact O-N 3.24Å; W176-V180 HydrophobicContact CD2-CG1 3.94Å; W176-V180 HydrophobicContact CE3-CB 4.02Å; W176-V180 HydrophobicContact CE3-CG1 3.6Å; W176-V180 HydrophobicContact CE3-CG2 4.47Å; W176-V180 HydrophobicContact CG-CG1 4.42Å; W176-V180 HydrophobicContact CZ3-CB 4.41Å; W176-V180 HydrophobicContact CZ3-CG1 3.98Å; W176-V180 HydrophobicContact CZ3-CG2 4.39Å; G178-V180 PolarHBondContact O-N 3.28Å; V180-L183 PolarHBondContact O-N 3.24Å; V180-M184 HydrophobicContact CG1-SD 4.2Å; V180-M184 VanDerWaalsContact O-CG 3.31Å; V180-M184 WeakPolarHBondContact O-CG 3.4Å; V180-M184 PolarHBondContact O-N 2.86Å; V180-R201 HydrophobicContact CG2-CG 4.06Å; V180-V204 HydrophobicContact CG1-CG2 3.7Å; V180-I205 HydrophobicContact CG1-CD1 4.34Å; V180-I205 HydrophobicContact CG1-CG1 4.5Å; V180-I205 HydrophobicContact CG1-CG2 4.28Å; V180-I205 HydrophobicContact CG2-CD1 4.09Å
181	K	94.9	Very high	92.7	Very high	56 Å²	56	53.9 Å²	53.9	24%	0.243	27%	0.272	C	S	.	.	H	α-helix	trans	-67.7	-38.4	178.4	-176.3	55.5	169.1	151.5	0	112.4	W176 N177 G178 I179 L183 M184 D185	W176-K181 HydrophobicContact CB-CB 4.24Å; W176-K181 HydrophobicContact CB-CD 4.32Å; W176-K181 WeakPolarHBondContact O-CB 3.31Å; W176-K181 WeakPolarHBondContact O-CD 3.47Å; W176-K181 VanDerWaalsContact O-CG 3.25Å; W176-K181 WeakPolarHBondContact O-CG 3.5Å; N177-K181 WeakPolarHBondContact O-CB 2.98Å; N177-K181 PolarHBondContact O-N 3.26Å; G178-K181 WeakPolarHBondContact O-CB 3.23Å; G178-K181 PolarHBondContact O-N 3.25Å; I179-K181 VanDerWaalsContact C-N 3.3Å; I179-K181 PolarHBondContact O-N 2.83Å; K181-L183 VanDerWaalsContact C-N 3.31Å; K181-L183 PolarHBondContact O-N 3.05Å; K181-M184 PolarHBondContact O-N 3.28Å; K181-D185 WeakPolarHBondContact CD-OD2 3.42Å; K181-D185 WeakPolarHBondContact CE-OD2 3.37Å; K181-D185 IonicContact NZ-OD1 2.78Å; K181-D185 PolarHBondContact NZ-OD1 2.99Å; K181-D185 IonicContact NZ-OD2 2.72Å; K181-D185 PolarHBondContact NZ-OD2 2.95Å; K181-D185 WeakPolarHBondContact O-CB 3.32Å; K181-D185 PolarHBondContact O-N 2.96Å
182	E	95.9	Very high	93.5	Very high	15 Å²	15	47.2 Å²	47.2	7%	0.07	24%	0.241	C	C	.	.	H	α-helix	trans	-61	-38.6	175.7	-71.1	-178.8	178.8	0	0	112.7	S114 G178 I179 H186 R187 A188	S114-E182 VanDerWaalsContact CB-OE2 3.25Å; S114-E182 WeakPolarHBondContact CB-OE2 3.17Å; S114-E182 PolarHBondContact OG-OE2 3.35Å; G178-E182 PolarHBondContact O-N 3.38Å; G178-E182 VanDerWaalsContact O-N 3.17Å; I179-E182 PolarHBondContact O-N 3.48Å; E182-H186 PolarHBondContact O-N 3.26Å; E182-R187 HydrophobicContact CB-CB 4.37Å; E182-R187 PolarHBondContact O-N 3.31Å; E182-A188 HydrophobicContact CB-CB 4.32Å; E182-A188 PolarHBondContact O-N 2.93Å
183	L	95.9	Very high	93.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-70.8	-39.9	174.3	-66.8	178.5	0	0	0	112.6	I179 V180 K181 D185 H186 A188 A191 I205 P447	I179-L183 PolarHBondContact O-N 2.86Å; I179-L183 VanDerWaalsContact O-N 3.09Å; V180-L183 PolarHBondContact O-N 3.24Å; K181-L183 VanDerWaalsContact C-N 3.31Å; K181-L183 PolarHBondContact O-N 3.05Å; L183-D185 VanDerWaalsContact C-N 3.31Å; L183-D185 PolarHBondContact O-N 2.61Å; L183-H186 PolarHBondContact O-N 2.8Å; L183-A188 HydrophobicContact CD2-CB 4.21Å; L183-A191 HydrophobicContact CD1-CB 3.72Å; L183-A191 HydrophobicContact CD2-CB 4.15Å; L183-A191 HydrophobicContact CG-CB 4.2Å; L183-I205 HydrophobicContact CB-CG2 3.77Å; L183-I205 HydrophobicContact CD1-CB 4.47Å; L183-I205 HydrophobicContact CD1-CD1 3.82Å; L183-I205 HydrophobicContact CD1-CG2 4.24Å; L183-P447 HydrophobicContact CD2-CG 4.3Å
184	M	95	Very high	94.1	Very high	65 Å²	65	35.9 Å²	35.9	32%	0.32	18%	0.178	S	C	.	.	H	α-helix	trans	-62.8	-38.9	176.8	-72.8	176.8	72	0	0	112.3	W176 V180 K181 H186 V204 I205	W176-M184 HydrophobicContact CB-SD 3.92Å; W176-M184 HydrophobicContact CG-SD 3.8Å; V180-M184 HydrophobicContact CG1-SD 4.2Å; V180-M184 VanDerWaalsContact O-CG 3.31Å; V180-M184 WeakPolarHBondContact O-CG 3.4Å; V180-M184 PolarHBondContact O-N 2.86Å; K181-M184 PolarHBondContact O-N 3.28Å; M184-H186 VanDerWaalsContact C-N 3.26Å; M184-H186 PolarHBondContact O-N 3.48Å; M184-V204 HydrophobicContact CE-CB 4.08Å; M184-V204 HydrophobicContact CE-CG1 4.2Å; M184-V204 HydrophobicContact CG-CB 4.2Å; M184-V204 HydrophobicContact CG-CG2 4.46Å; M184-V204 HydrophobicContact SD-CB 3.84Å; M184-V204 HydrophobicContact SD-CG1 4.39Å; M184-V204 HydrophobicContact SD-CG2 4Å; M184-I205 HydrophobicContact CG-CG2 4Å
185	D	95	Very high	94.4	Very high	74 Å²	74	34.2 Å²	34.2	40%	0.396	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	4.3	-179.1	-65.3	-19.4	0	0	0	112.7	K181 L183 R187	K181-D185 WeakPolarHBondContact CD-OD2 3.42Å; K181-D185 WeakPolarHBondContact CE-OD2 3.37Å; K181-D185 IonicContact NZ-OD1 2.78Å; K181-D185 PolarHBondContact NZ-OD1 2.99Å; K181-D185 IonicContact NZ-OD2 2.72Å; K181-D185 PolarHBondContact NZ-OD2 2.95Å; K181-D185 WeakPolarHBondContact O-CB 3.32Å; K181-D185 PolarHBondContact O-N 2.96Å; L183-D185 VanDerWaalsContact C-N 3.31Å; L183-D185 PolarHBondContact O-N 2.61Å; D185-R187 HydrophobicContact CB-CG 4.09Å; D185-R187 PolarHBondContact O-N 3.13Å; D185-R187 VanDerWaalsContact O-N 3.14Å
186	H	93.6	Very high	94.4	Very high	128 Å²	128	27.8 Å²	27.8	59%	0.593	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.8	30.3	-174.4	-59.7	-80.9	0	0	0	113.5	E182 L183 M184 A188 P447	E182-H186 PolarHBondContact O-N 3.26Å; L183-H186 PolarHBondContact O-N 2.8Å; M184-H186 VanDerWaalsContact C-N 3.26Å; M184-H186 PolarHBondContact O-N 3.48Å; H186-A188 VanDerWaalsContact C-N 3.31Å; H186-P447 VanDerWaalsContact CE1-CB 3.44Å; H186-P447 WeakPolarHBondContact CE1-CB 3.33Å; H186-P447 WeakPolarHBondContact ND1-CB 3.22Å
187	R	94.6	Very high	94.4	Very high	113 Å²	113	28.5 Å²	28.5	43%	0.426	14%	0.136	S	C	.	.	S	Bend	trans	-75.6	-25.4	170.5	-67.2	-164.4	-70.8	157.4	1.2	111.7	E162 E182 D185	E162-R187 IonicContact OE1-NH1 2.67Å; E162-R187 IonicContact OE2-CZ 2.83Å; E162-R187 IonicContact OE2-NH1 3.02Å; E162-R187 PolarHBondContact OE2-NH1 3.39Å; E182-R187 HydrophobicContact CB-CB 4.37Å; E182-R187 PolarHBondContact O-N 3.31Å; D185-R187 HydrophobicContact CB-CG 4.09Å; D185-R187 PolarHBondContact O-N 3.13Å; D185-R187 VanDerWaalsContact O-N 3.14Å
188	A	95.4	Very high	94.3	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.008	14%	0.135	C	C	.	.			trans	-127.7	143.2	171.3	0	0	0	0	0	110.1	I112 E182 L183 H186	I112-A188 HydrophobicContact CG2-CB 4.37Å; E182-A188 HydrophobicContact CB-CB 4.32Å; E182-A188 PolarHBondContact O-N 2.93Å; L183-A188 HydrophobicContact CD2-CB 4.21Å; H186-A188 VanDerWaalsContact C-N 3.31Å
189	D	94.6	Very high	94.1	Very high	44 Å²	44	35.4 Å²	35.4	24%	0.235	16%	0.163	C	C	.	.	S	Bend	trans	-86.3	-26.7	178.9	-59.7	-55.5	0	0	0	111.9	L111 I112 P447	L111-D189 HydrophobicContact CB-CB 4.27Å; L111-D189 HydrophobicContact CD2-CB 4.08Å; I112-D189 PolarHBondContact N-OD2 3.45Å; I112-D189 PolarHBondContact O-N 3.28Å; D189-P447 WeakPolarHBondContact O-CD 3.26Å
190	L	95.6	Very high	93.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	147.8	-175.9	-162.8	66.7	0	0	0	111.1	I112 V113 S114 L145 V192 V444 T446 I456	I112-L190 PolarHBondContact O-N 3.35Å; V113-L190 CarbonylContact C-O 3.59Å; V113-L190 VanDerWaalsContact CA-O 3.31Å; V113-L190 WeakPolarHBondContact CA-O 3.08Å; V113-L190 HydrophobicContact CG2-CB 4.27Å; V113-L190 HydrophobicContact CG2-CD2 4.45Å; S114-L190 PolarHBondContact N-O 3.11Å; L145-L190 HydrophobicContact CD1-CD2 4.46Å; L190-V192 HydrophobicContact CD2-CG2 3.63Å; L190-V192 HydrophobicContact CG-CG2 3.99Å; L190-V444 HydrophobicContact CD1-CG1 3.37Å; L190-V444 HydrophobicContact CD2-CG1 4.06Å; L190-V444 HydrophobicContact CG-CG1 3.67Å; L190-T446 HydrophobicContact CD1-CG2 3.51Å; L190-I456 HydrophobicContact CD1-CD1 3.29Å; L190-I456 HydrophobicContact CD2-CD1 3.88Å; L190-I456 HydrophobicContact CG-CD1 4.23Å
191	A	97.3	Very high	93.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	111.2	168.8	0	0	0	0	0	110.6	S114 I179 L183 V444 G445	S114-A191 WeakPolarHBondContact O-CA 3.29Å; I179-A191 HydrophobicContact CG2-CB 3.37Å; L183-A191 HydrophobicContact CD1-CB 3.72Å; L183-A191 HydrophobicContact CD2-CB 4.15Å; L183-A191 HydrophobicContact CG-CB 4.2Å; A191-V444 WeakPolarHBondContact O-CG1 3.35Å; A191-G445 PolarHBondContact N-O 3.48Å; A191-G445 PolarHBondContact O-N 3.46Å
192	V	97.1	Very high	93.5	Very high	2 Å²	2	41 Å²	41	1%	0.012	19%	0.191	C	C	.	.			trans	-112.9	93.1	174.6	-174	0	0	0	0	108.3	V113 S114 S115 C141 L144 L145 L190 V444	V113-V192 HydrophobicContact CG1-CB 3.99Å; V113-V192 HydrophobicContact CG1-CG2 3.92Å; S114-V192 PolarHBondContact O-N 2.64Å; S115-V192 PolarHBondContact OG-O 3.02Å; C141-V192 HydrophobicContact CB-CG1 4.06Å; L144-V192 HydrophobicContact CD2-CG1 4.3Å; L145-V192 HydrophobicContact CB-CG1 4.39Å; L145-V192 HydrophobicContact CD1-CG2 4.06Å; L190-V192 HydrophobicContact CD2-CG2 3.63Å; L190-V192 HydrophobicContact CG-CG2 3.99Å; V192-V444 HydrophobicContact CG2-CG1 3.96Å; V192-V444 HydrophobicContact CG2-CG2 4.43Å
193	A	95.1	Very high	93.4	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	-149.3	170	-177.5	0	0	0	0	0	108.6	I116 I179 L195	I116-A193 HydrophobicContact CG2-CB 4.28Å; I179-A193 HydrophobicContact CD1-CB 4.01Å; A193-L195 PolarHBondContact O-N 3.4Å
194	P	93.1	Very high	93.3	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.019	22%	0.223	C	C	.	.	S	Bend	trans	-68.8	60.5	166.6	30.4	-37.3	0	0	0	111.5	Y121 Y166 A196 Y442	Y121-P194 HydrophobicContact CD1-CB 3.85Å; Y121-P194 HydrophobicContact CD1-CG 4.12Å; Y121-P194 HydrophobicContact CD2-CB 3.96Å; Y121-P194 HydrophobicContact CD2-CG 3.71Å; Y121-P194 HydrophobicContact CE1-CB 3.82Å; Y121-P194 HydrophobicContact CE2-CB 3.95Å; Y121-P194 HydrophobicContact CE2-CG 4.14Å; Y121-P194 HydrophobicContact CG-CB 3.92Å; Y121-P194 HydrophobicContact CG-CG 3.7Å; Y166-P194 HydrophobicContact CE1-CG 4.15Å; Y166-P194 WeakPolarHBondContact CE1-O 3.49Å; Y166-P194 VanDerWaalsContact OH-CG 3.26Å; Y166-P194 WeakPolarHBondContact OH-CG 3.44Å; P194-A196 PolarHBondContact O-N 3.45Å; P194-Y442 VanDerWaalsContact C-CD1 3.48Å; P194-Y442 HydrophobicContact CB-CD1 4.38Å; P194-Y442 HydrophobicContact CB-CD2 3.89Å; P194-Y442 HydrophobicContact CB-CE1 4.09Å; P194-Y442 HydrophobicContact CB-CE2 3.54Å; P194-Y442 HydrophobicContact CB-CG 4.31Å; P194-Y442 VanDerWaalsContact O-CE1 3.31Å; P194-Y442 WeakPolarHBondContact O-CE1 3.4Å
195	L	92.1	Very high	93.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.207	C	C	.	.			trans	-90.9	106.6	-177.1	-174.5	65.1	0	0	0	109.8	Y166 A193 I197 I205 F207 G443	Y166-L195 HydrophobicContact CD1-CD1 3.91Å; A193-L195 PolarHBondContact O-N 3.4Å; L195-I197 PolarHBondContact O-N 2.74Å; L195-I205 HydrophobicContact CD2-CD1 4.31Å; L195-F207 HydrophobicContact CD2-CE1 3.62Å; L195-F207 HydrophobicContact CD2-CZ 3.87Å; L195-F207 HydrophobicContact CG-CE1 3.89Å; L195-F207 HydrophobicContact CG-CZ 4.13Å; L195-G443 PolarHBondContact O-N 2.88Å
196	A	91.4	Very high	93.4	Very high	2 Å²	2	42 Å²	42	2%	0.017	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-62.3	126.6	176.5	0	0	0	0	0	111.9	P194 T198 R201 Y442	P194-A196 PolarHBondContact O-N 3.45Å; A196-T198 PolarHBondContact O-N 3.31Å; A196-R201 PolarHBondContact O-NH1 3.47Å; A196-Y442 HydrophobicContact CB-CD1 4.33Å; A196-Y442 HydrophobicContact CB-CE1 4.21Å
197	I	92.4	Very high	93.6	Very high	41 Å²	41	36.9 Å²	36.9	21%	0.21	17%	0.17	C	C	.	.			trans	-69.2	120.8	172.3	-58.5	163.3	0	0	0	107.9	L195 F207 P210 A441	L195-I197 PolarHBondContact O-N 2.74Å; I197-F207 HydrophobicContact CD1-CB 4.45Å; I197-F207 HydrophobicContact CG1-CB 4.16Å; I197-F207 HydrophobicContact CG1-CD1 3.7Å; I197-F207 HydrophobicContact CG1-CD2 4.46Å; I197-F207 HydrophobicContact CG1-CE1 4.14Å; I197-F207 HydrophobicContact CG1-CG 3.86Å; I197-F207 HydrophobicContact CG2-CD2 4.18Å; I197-F207 HydrophobicContact CG2-CG 4.3Å; I197-P210 HydrophobicContact CD1-CB 4.14Å; I197-A441 HydrophobicContact CD1-CB 4.48Å; I197-A441 PolarHBondContact N-O 3.42Å
198	T	89.1	Confident	93.6	Very high	38 Å²	38	31.9 Å²	31.9	23%	0.233	15%	0.153	C	C	.	.			trans	-136.7	150.5	176.9	67.5	0	0	0	0	110.2	A196 V200 R201 E202	A196-T198 PolarHBondContact O-N 3.31Å; T198-V200 PolarHBondContact O-N 3.2Å; T198-V200 VanDerWaalsContact O-N 3.11Å; T198-R201 PolarHBondContact O-N 2.95Å; T198-R201 WeakPolarHBondContact OG1-CG 3.46Å; T198-R201 PolarHBondContact OG1-N 3.39Å; T198-E202 PolarHBondContact O-N 3.05Å
199	Y	88.3	Confident	93.6	Very high	162 Å²	162	37.6 Å²	37.6	64%	0.635	18%	0.177	S	C	*	.	H	α-helix	trans	-52.6	-35.5	177.9	173.8	-105.2	0	0	0	113.6	K203	Y199-K203 HydrophobicContact CE1-CD 4.38Å; Y199-K203 PolarHBondContact O-N 2.87Å; Y199-K203 WeakPolarHBondContact OH-CE 3.47Å; Y199-K203 PolarHBondContact OH-NZ 2.94Å
200	V	88.8	Confident	93.7	Very high	44 Å²	44	38.1 Å²	38.1	27%	0.267	18%	0.183	S	C	.	.	H	α-helix	trans	-74	-35.3	-177.9	-169.5	0	0	0	0	111.2	W176 T198	W176-V200 HydrophobicContact CH2-CB 4.35Å; W176-V200 HydrophobicContact CH2-CG1 3.7Å; W176-V200 HydrophobicContact CZ2-CG1 3.72Å; W176-V200 WeakPolarHBondContact CZ2-O 3.3Å; T198-V200 PolarHBondContact O-N 3.2Å; T198-V200 VanDerWaalsContact O-N 3.11Å
201	R	91.4	Very high	93.7	Very high	22 Å²	22	38.4 Å²	38.4	8%	0.083	18%	0.184	C	C	.	.	H	α-helix	trans	-75.4	-40.1	176.2	-68.3	177.2	177.4	159.6	-4.8	111.8	G167 W176 V180 A196 T198 K203 V204 I205 F207	G167-R201 PolarHBondContact O-NE 3.09Å; G167-R201 PolarHBondContact O-NH2 3.21Å; G167-R201 VanDerWaalsContact O-NH2 3.08Å; W176-R201 HydrophobicContact CH2-CG 4.02Å; W176-R201 HydrophobicContact CZ3-CG 4.08Å; V180-R201 HydrophobicContact CG2-CG 4.06Å; A196-R201 PolarHBondContact O-NH1 3.47Å; T198-R201 PolarHBondContact O-N 2.95Å; T198-R201 WeakPolarHBondContact OG1-CG 3.46Å; T198-R201 PolarHBondContact OG1-N 3.39Å; R201-K203 PolarHBondContact O-N 3.39Å; R201-K203 VanDerWaalsContact O-N 3.11Å; R201-V204 VanDerWaalsContact O-CG2 3.23Å; R201-V204 WeakPolarHBondContact O-CG2 3.22Å; R201-V204 PolarHBondContact O-N 3.41Å; R201-I205 HydrophobicContact CB-CG1 4.44Å; R201-I205 VanDerWaalsContact O-CG1 3.24Å; R201-I205 WeakPolarHBondContact O-CG1 3.46Å; R201-I205 PolarHBondContact O-N 3.43Å; R201-F207 HydrophobicContact CB-CE2 3.78Å; R201-F207 HydrophobicContact CB-CZ 4.04Å
202	E	92	Very high	93.6	Very high	106 Å²	106	39.1 Å²	39.1	50%	0.495	19%	0.188	S	C	.	.	H	α-helix	trans	-63.3	-17.8	179.4	-165.2	172.5	-165.1	0	0	113.2	T198 V204 I205 F207	T198-E202 PolarHBondContact O-N 3.05Å; E202-V204 VanDerWaalsContact C-N 3.34Å; E202-I205 CarbonylContact C-O 3.6Å; E202-I205 VanDerWaalsContact CA-O 3.3Å; E202-I205 WeakPolarHBondContact CA-O 3.39Å; E202-F207 HydrophobicContact CB-CD2 4.48Å
203	K	92.8	Very high	93.5	Very high	121 Å²	121	44.2 Å²	44.2	53%	0.526	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-23.1	171.9	-78.7	-173.6	179.3	-176.2	0	114.7	Y199 R201	Y199-K203 HydrophobicContact CE1-CD 4.38Å; Y199-K203 PolarHBondContact O-N 2.87Å; Y199-K203 WeakPolarHBondContact OH-CE 3.47Å; Y199-K203 PolarHBondContact OH-NZ 2.94Å; R201-K203 PolarHBondContact O-N 3.39Å; R201-K203 VanDerWaalsContact O-N 3.11Å
204	V	94.8	Very high	93.4	Very high	33 Å²	33	44.3 Å²	44.3	20%	0.2	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.4	-21.8	-170.9	-63.7	0	0	0	0	113.2	W176 V180 M184 R201 E202	W176-V204 HydrophobicContact CD2-CG2 4.47Å; W176-V204 HydrophobicContact CH2-CG2 4.43Å; W176-V204 HydrophobicContact CZ2-CG1 4.39Å; W176-V204 HydrophobicContact CZ2-CG2 3.89Å; V180-V204 HydrophobicContact CG1-CG2 3.7Å; M184-V204 HydrophobicContact CE-CB 4.08Å; M184-V204 HydrophobicContact CE-CG1 4.2Å; M184-V204 HydrophobicContact CG-CB 4.2Å; M184-V204 HydrophobicContact CG-CG2 4.46Å; M184-V204 HydrophobicContact SD-CB 3.84Å; M184-V204 HydrophobicContact SD-CG1 4.39Å; M184-V204 HydrophobicContact SD-CG2 4Å; R201-V204 VanDerWaalsContact O-CG2 3.23Å; R201-V204 WeakPolarHBondContact O-CG2 3.22Å; R201-V204 PolarHBondContact O-N 3.41Å; E202-V204 VanDerWaalsContact C-N 3.34Å
205	I	96.1	Very high	93.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	156.3	175.7	58.6	166.3	0	0	0	109.3	V180 L183 M184 L195 R201 E202 F207	V180-I205 HydrophobicContact CG1-CD1 4.34Å; V180-I205 HydrophobicContact CG1-CG1 4.5Å; V180-I205 HydrophobicContact CG1-CG2 4.28Å; V180-I205 HydrophobicContact CG2-CD1 4.09Å; L183-I205 HydrophobicContact CB-CG2 3.77Å; L183-I205 HydrophobicContact CD1-CB 4.47Å; L183-I205 HydrophobicContact CD1-CD1 3.82Å; L183-I205 HydrophobicContact CD1-CG2 4.24Å; M184-I205 HydrophobicContact CG-CG2 4Å; L195-I205 HydrophobicContact CD2-CD1 4.31Å; R201-I205 HydrophobicContact CB-CG1 4.44Å; R201-I205 VanDerWaalsContact O-CG1 3.24Å; R201-I205 WeakPolarHBondContact O-CG1 3.46Å; R201-I205 PolarHBondContact O-N 3.43Å; E202-I205 CarbonylContact C-O 3.6Å; E202-I205 VanDerWaalsContact CA-O 3.3Å; E202-I205 WeakPolarHBondContact CA-O 3.39Å; I205-F207 HydrophobicContact CD1-CE1 4.41Å; I205-F207 HydrophobicContact CD1-CE2 3.86Å; I205-F207 HydrophobicContact CD1-CZ 3.68Å; I205-F207 HydrophobicContact CG1-CE2 3.9Å; I205-F207 HydrophobicContact CG1-CZ 4.25Å
206	D	96.3	Very high	93.5	Very high	23 Å²	23	44.1 Å²	44.1	12%	0.123	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	147.8	176.4	-79.1	-14.6	0	0	0	110.7	T446 G449 R453	D206-T446 WeakPolarHBondContact CB-OG1 3.25Å; D206-T446 PolarHBondContact N-O 2.92Å; D206-T446 PolarHBondContact O-N 3.37Å; D206-T446 VanDerWaalsContact O-O 3.1Å; D206-T446 PolarHBondContact O-OG1 3.41Å; D206-G449 PolarHBondContact OD2-N 3.48Å; D206-R453 IonicContact OD2-NH1 3.24Å; D206-R453 PolarHBondContact OD2-NH1 3.48Å
207	F	96.9	Very high	93.7	Very high	19 Å²	19	44 Å²	44	8%	0.083	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	149.7	175.1	-74.3	-86.8	0	0	0	111.9	L195 I197 R201 E202 I205 V444	L195-F207 HydrophobicContact CD2-CE1 3.62Å; L195-F207 HydrophobicContact CD2-CZ 3.87Å; L195-F207 HydrophobicContact CG-CE1 3.89Å; L195-F207 HydrophobicContact CG-CZ 4.13Å; I197-F207 HydrophobicContact CD1-CB 4.45Å; I197-F207 HydrophobicContact CG1-CB 4.16Å; I197-F207 HydrophobicContact CG1-CD1 3.7Å; I197-F207 HydrophobicContact CG1-CD2 4.46Å; I197-F207 HydrophobicContact CG1-CE1 4.14Å; I197-F207 HydrophobicContact CG1-CG 3.86Å; I197-F207 HydrophobicContact CG2-CD2 4.18Å; I197-F207 HydrophobicContact CG2-CG 4.3Å; R201-F207 HydrophobicContact CB-CE2 3.78Å; R201-F207 HydrophobicContact CB-CZ 4.04Å; E202-F207 HydrophobicContact CB-CD2 4.48Å; I205-F207 HydrophobicContact CD1-CE1 4.41Å; I205-F207 HydrophobicContact CD1-CE2 3.86Å; I205-F207 HydrophobicContact CD1-CZ 3.68Å; I205-F207 HydrophobicContact CG1-CE2 3.9Å; I205-F207 HydrophobicContact CG1-CZ 4.25Å; F207-V444 WeakPolarHBondContact CA-O 3.11Å
208	S	96	Very high	93.8	Very high	8 Å²	8	42.2 Å²	42.2	6%	0.056	21%	0.209	C	C	.	.			trans	-69.4	174.1	164	71.4	0	0	0	0	111.7	V444 T457 I460	S208-V444 PolarHBondContact N-O 3.5Å; S208-V444 WeakPolarHBondContact OG-CB 3.37Å; S208-V444 PolarHBondContact OG-N 3.49Å; S208-T457 WeakPolarHBondContact CA-OG1 2.95Å; S208-I460 VanDerWaalsContact OG-CD1 3.23Å; S208-I460 WeakPolarHBondContact OG-CD1 2.9Å
209	K	95.6	Very high	94.1	Very high	121 Å²	121	40.4 Å²	40.4	53%	0.526	20%	0.197	S	C	.	.	S	Bend	trans	-56.3	146.6	158.8	-71.5	-69.4	-179.6	-169.3	0	110.4	T457	K209-T457 HydrophobicContact CB-CG2 3.88Å; K209-T457 HydrophobicContact CG-CG2 3.34Å; K209-T457 PolarHBondContact N-OG1 2.73Å
210	P	96.3	Very high	94.3	Very high	55 Å²	55	33 Å²	33	36%	0.357	17%	0.168	S	C	.	.			trans	-66.7	140.5	-176.9	25.9	-33.8	0	0	0	111.8	I197 A441 Y442	I197-P210 HydrophobicContact CD1-CB 4.14Å; P210-A441 HydrophobicContact CB-CB 3.35Å; P210-A441 HydrophobicContact CG-CB 4.11Å; P210-Y442 CarbonylContact C-O 3.59Å; P210-Y442 WeakPolarHBondContact CA-O 3.32Å; P210-Y442 WeakPolarHBondContact CB-O 3.45Å
211	F	95.6	Very high	94.5	Very high	7 Å²	7	34.9 Å²	34.9	3%	0.031	17%	0.171	C	C	.	.	S	Bend	trans	-98.4	-16.2	175.4	65.7	-99	0	0	0	112.7	Y140 L144 Y442 V444 I460 L469	Y140-F211 HydrophobicContact CD1-CE2 4.42Å; Y140-F211 AromaticContact CE1-CD2 3.81Å; Y140-F211 HydrophobicContact CE1-CD2 3.81Å; Y140-F211 AromaticContact CE1-CE2 3.66Å; Y140-F211 HydrophobicContact CE1-CE2 3.66Å; L144-F211 HydrophobicContact CD2-CB 4.38Å; L144-F211 HydrophobicContact CD2-CD1 4.02Å; L144-F211 HydrophobicContact CD2-CD2 3.91Å; L144-F211 HydrophobicContact CD2-CE1 4.25Å; L144-F211 HydrophobicContact CD2-CE2 4.17Å; L144-F211 HydrophobicContact CD2-CG 3.84Å; L144-F211 HydrophobicContact CD2-CZ 4.32Å; F211-Y442 WeakPolarHBondContact CD1-O 3.24Å; F211-Y442 HydrophobicContact CZ-CD2 4.46Å; F211-Y442 HydrophobicContact CZ-CG 4.34Å; F211-Y442 PolarHBondContact N-O 3.43Å; F211-V444 HydrophobicContact CD1-CG2 4.17Å; F211-V444 HydrophobicContact CE1-CG2 4.37Å; F211-I460 HydrophobicContact CB-CD1 4.49Å; F211-I460 HydrophobicContact CB-CG2 3.95Å; F211-L469 HydrophobicContact CB-CD1 4.25Å; F211-L469 HydrophobicContact CB-CD2 4.32Å
212	M	95	Very high	94.3	Very high	14 Å²	14	36.7 Å²	36.7	7%	0.069	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	127.4	178.2	-175.8	175.1	-72.8	0	0	109.6	Y121 Y140 T418 A441 Y442 K473 W477	Y121-M212 HydrophobicContact CE1-SD 4.42Å; Y140-M212 HydrophobicContact CD1-CE 4.37Å; Y140-M212 HydrophobicContact CD2-CE 4.47Å; Y140-M212 HydrophobicContact CE1-CE 3.81Å; Y140-M212 HydrophobicContact CE2-CE 3.91Å; M212-T418 HydrophobicContact CG-CG2 4.23Å; M212-T418 HydrophobicContact SD-CG2 3.62Å; M212-A441 CarbonylContact O-C 3.53Å; M212-A441 VanDerWaalsContact O-CA 3.25Å; M212-A441 WeakPolarHBondContact O-CA 3.49Å; M212-A441 WeakPolarHBondContact O-CB 3.19Å; M212-Y442 HydrophobicContact CB-CD2 4.42Å; M212-Y442 PolarHBondContact O-N 2.93Å; M212-Y442 HydrophobicContact SD-CD2 4.27Å; M212-K473 HydrophobicContact CE-CD 4.47Å; M212-K473 HydrophobicContact CE-CG 4.23Å; M212-W477 HydrophobicContact CE-CH2 4.14Å; M212-W477 HydrophobicContact CE-CZ3 4.21Å; M212-W477 HydrophobicContact SD-CH2 4.48Å
213	T	93.9	Very high	93.6	Very high	109 Å²	109	33.1 Å²	33.1	67%	0.669	17%	0.165	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	141	173.4	51.1	0	0	0	0	110.2	A441	T213-A441 HydrophobicContact CG2-CB 4.34Å
214	L	93.4	Very high	92.4	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	179.9	-178.7	61.2	133	0	0	0	110.5	E416 T418 K440 Y442	L214-E416 HydrophobicContact CD1-CB 3.66Å; L214-E416 HydrophobicContact CD1-CG 3.57Å; L214-T418 HydrophobicContact CB-CG2 3.77Å; L214-K440 HydrophobicContact CG-CB 4.33Å; L214-K440 PolarHBondContact N-O 3.43Å; L214-K440 CarbonylContact O-C 3.42Å; L214-K440 WeakPolarHBondContact O-CA 3.5Å; L214-K440 PolarHBondContact O-N 2.91Å; L214-Y442 HydrophobicContact CD1-CE1 3.88Å; L214-Y442 HydrophobicContact CD1-CE2 4.26Å; L214-Y442 HydrophobicContact CD2-CD1 3.67Å; L214-Y442 HydrophobicContact CD2-CD2 3.49Å; L214-Y442 VanDerWaalsContact CD2-CD2 3.49Å; L214-Y442 HydrophobicContact CD2-CE1 3.67Å; L214-Y442 HydrophobicContact CD2-CE2 3.5Å; L214-Y442 HydrophobicContact CD2-CG 3.57Å; L214-Y442 HydrophobicContact CG-CE1 4.42Å
215	G	93.4	Very high	90.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.187	C	C	.	.			trans	-159.2	171.5	169.9	0	0	0	0	0	111	E416 S417 D438	G215-E416 CarbonylContact O-C 3.55Å; G215-S417 PolarHBondContact N-OG 2.89Å; G215-S417 WeakPolarHBondContact O-CB 3.49Å; G215-S417 PolarHBondContact O-N 2.95Å; G215-S417 PolarHBondContact O-OG 3.34Å; G215-D438 WeakPolarHBondContact CA-O 3.29Å; G215-D438 WeakPolarHBondContact CA-OD1 3.5Å
216	I	94.1	Very high	89	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	133.1	170.1	-55.9	161	0	0	0	107.5	T368 F371 F372 L414 M415 I437 D438	I216-T368 HydrophobicContact CD1-CG2 3.77Å; I216-T368 HydrophobicContact CG1-CG2 3.88Å; I216-T368 HydrophobicContact CG2-CG2 3.84Å; I216-F371 HydrophobicContact CD1-CB 4.21Å; I216-F371 HydrophobicContact CD1-CD1 3.39Å; I216-F371 HydrophobicContact CD1-CD2 4.48Å; I216-F371 HydrophobicContact CD1-CE1 3.8Å; I216-F371 HydrophobicContact CD1-CG 3.78Å; I216-F371 HydrophobicContact CD1-CZ 4.49Å; I216-F372 HydrophobicContact CD1-CE2 4.27Å; I216-F372 HydrophobicContact CG2-CE2 4.38Å; I216-L414 HydrophobicContact CG2-CB 4.16Å; I216-L414 HydrophobicContact CG2-CD2 4.38Å; I216-M415 WeakPolarHBondContact CA-O 3.28Å; I216-I437 HydrophobicContact CB-CB 4.17Å; I216-I437 HydrophobicContact CG2-CD1 4.09Å; I216-I437 WeakPolarHBondContact O-CB 3.27Å; I216-I437 PolarHBondContact O-N 3.23Å; I216-D438 VanDerWaalsContact CD1-OD2 3.29Å; I216-D438 WeakPolarHBondContact CD1-OD2 3.31Å; I216-D438 WeakPolarHBondContact CG1-OD1 3.35Å; I216-D438 PolarHBondContact N-OD1 2.76Å
217	S	94.9	Very high	87.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	177.4	173.7	-179.2	0	0	0	0	109.4	L414 M415 I420 Q432	S217-L414 WeakPolarHBondContact O-CA 3.25Å; S217-M415 PolarHBondContact N-O 3.01Å; S217-M415 PolarHBondContact O-N 2.98Å; S217-M415 VanDerWaalsContact O-N 3.16Å; S217-M415 VanDerWaalsContact O-O 3.13Å; S217-I420 VanDerWaalsContact C-CD1 3.5Å; S217-Q432 VanDerWaalsContact OG-CD 3.28Å; S217-Q432 WeakPolarHBondContact OG-CG 3.22Å; S217-Q432 PolarHBondContact OG-NE2 3.02Å
218	I	95.4	Very high	85.9	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.015	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	119.3	-170.9	-57.7	160.3	0	0	0	108.8	I346 A349 L352 A412 Q432 I433 I437	I218-I346 HydrophobicContact CG2-CD1 4.48Å; I218-A349 HydrophobicContact CD1-CB 4.16Å; I218-L352 HydrophobicContact CD1-CD1 3.7Å; I218-L352 HydrophobicContact CG1-CD1 4.24Å; I218-L352 HydrophobicContact CG2-CD1 4.15Å; I218-A412 HydrophobicContact CG2-CB 3.9Å; I218-Q432 WeakPolarHBondContact O-CA 3.38Å; I218-I433 HydrophobicContact CB-CB 4.24Å; I218-I433 HydrophobicContact CG2-CB 4.31Å; I218-I433 PolarHBondContact O-N 3.5Å; I218-I437 HydrophobicContact CG1-CD1 4.3Å
219	L	95.1	Very high	84.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	126	167.9	-174.6	75.5	0	0	0	108.9	I403 V406 F413 M415 I420 T424 L430	L219-I403 HydrophobicContact CD2-CG1 4.09Å; L219-V406 HydrophobicContact CD2-CG2 4.33Å; L219-V406 HydrophobicContact CG-CG1 4.47Å; L219-F413 HydrophobicContact CB-CB 4.37Å; L219-F413 PolarHBondContact N-O 3.46Å; L219-F413 PolarHBondContact O-N 3.13Å; L219-M415 HydrophobicContact CB-CE 4.08Å; L219-M415 HydrophobicContact CD2-CE 3.43Å; L219-M415 VanDerWaalsContact CD2-CE 3.43Å; L219-M415 HydrophobicContact CG-CE 4.31Å; L219-I420 HydrophobicContact CB-CD1 4.14Å; L219-I420 HydrophobicContact CB-CG1 4.16Å; L219-I420 HydrophobicContact CD1-CG1 4.41Å; L219-I420 HydrophobicContact CD1-CG2 3.85Å; L219-T424 HydrophobicContact CD1-CG2 3.99Å; L219-L430 HydrophobicContact CD1-CB 4Å; L219-L430 HydrophobicContact CD1-CD1 4.42Å; L219-L430 HydrophobicContact CD2-CD1 4.26Å; L219-L430 HydrophobicContact CD2-CD2 4.41Å; L219-L430 HydrophobicContact CG-CD2 4.39Å
220	F	93.8	Very high	83.8	Confident	5 Å²	5	45.9 Å²	45.9	2%	0.022	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	160.5	174.5	-163.4	-118.5	0	0	0	111	P345 I346 I358 V406 Y411 A412 L430 T431 I433	F220-P345 HydrophobicContact CE1-CG 3.97Å; F220-I346 HydrophobicContact CB-CD1 4.35Å; F220-I346 HydrophobicContact CD1-CD1 4.24Å; F220-I346 HydrophobicContact CD1-CG1 4.41Å; F220-I346 HydrophobicContact CD2-CD1 4.22Å; F220-I346 HydrophobicContact CG-CD1 4.01Å; F220-I358 HydrophobicContact CE2-CG2 3.91Å; F220-I358 HydrophobicContact CZ-CD1 4.33Å; F220-I358 HydrophobicContact CZ-CG2 4.45Å; F220-V406 VanDerWaalsContact C-CG1 3.5Å; F220-Y411 WeakPolarHBondContact CD2-O 3.47Å; F220-A412 HydrophobicContact CD2-CB 3.89Å; F220-A412 HydrophobicContact CE2-CB 4.43Å; F220-L430 WeakPolarHBondContact O-CA 3.22Å; F220-T431 PolarHBondContact N-O 3.4Å; F220-T431 PolarHBondContact O-N 3.21Å; F220-T431 VanDerWaalsContact O-O 3.1Å; F220-T431 PolarHBondContact O-OG1 3.16Å; F220-I433 HydrophobicContact CB-CG1 3.75Å
221	R	91.5	Very high	83.1	Confident	84 Å²	84	49 Å²	49	32%	0.317	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	136.5	172.7	68.9	-174.5	-173.8	102.7	-4.1	109.8	P223 V406 D410 N429	R221-P223 WeakPolarHBondContact O-CD 3.18Å; R221-V406 HydrophobicContact CB-CG1 4.4Å; R221-V406 VanDerWaalsContact N-CG1 3.34Å; R221-D410 IonicContact CZ-OD1 2.89Å; R221-D410 IonicContact NE-OD1 2.82Å; R221-D410 PolarHBondContact NE-OD1 3.44Å; R221-D410 IonicContact NH2-OD1 3.69Å; R221-D410 PolarHBondContact NH2-OD1 3.31Å; R221-D410 IonicContact NH2-OD2 2.71Å; R221-N429 CarbonylContact C-O 3.54Å; R221-N429 WeakPolarHBondContact CA-O 3.49Å
222	K	86.6	Confident	82.2	Confident	61 Å²	61	48.8 Å²	48.8	27%	0.265	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-57.9	121.5	172.3	-166.2	162.6	-173.4	168.8	0	107.3	N224 C428 N429 T431	K222-N224 PolarHBondContact O-N 3.3Å; K222-C428 WeakPolarHBondContact CD-O 3.41Å; K222-N429 PolarHBondContact N-O 3.36Å; K222-T431 HydrophobicContact CB-CG2 3.71Å; K222-T431 HydrophobicContact CD-CG2 3.79Å; K222-T431 HydrophobicContact CG-CG2 3.59Å
223	P	78	Confident	81.7	Confident	30 Å²	30	49.9 Å²	49.9	20%	0.195	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-62.3	126	174.6	24.8	-31	0	0	0	107.6	R221 G225	R221-P223 WeakPolarHBondContact O-CD 3.18Å; P223-G225 PolarHBondContact O-N 3.15Å
224	N	68.1	Low	81.3	Confident	131 Å²	131	47.8 Å²	47.8	70%	0.701	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-60.8	124.3	169.6	-68.7	-9.6	0	0	0	106.5	K222 T226	K222-N224 PolarHBondContact O-N 3.3Å; N224-T226 PolarHBondContact O-N 3.31Å; N224-T226 VanDerWaalsContact O-N 3.12Å
225	G	61	Low	80.9	Confident	48 Å²	48	52.3 Å²	52.3	50%	0.495	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-47.5	124.4	175.9	0	0	0	0	0	109	P223 N227	P223-G225 PolarHBondContact O-N 3.15Å; G225-N227 PolarHBondContact O-N 3.48Å
226	T	58.3	Low	80.6	Confident	124 Å²	124	53 Å²	53	76%	0.761	30%	0.301	S	S	*	.			trans	-62.2	114.8	176.2	40	0	0	0	0	107.5	N224 P228	N224-T226 PolarHBondContact O-N 3.31Å; N224-T226 VanDerWaalsContact O-N 3.12Å; T226-P228 VanDerWaalsContact O-N 3.16Å
227	N	60.4	Low	80.3	Confident	129 Å²	129	53.8 Å²	53.8	69%	0.69	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-53	126.2	173.6	-69.5	-37.6	0	0	0	107.9	G225 G229	G225-N227 PolarHBondContact O-N 3.48Å; N227-G229 PolarHBondContact O-N 2.56Å; N227-G229 VanDerWaalsContact O-N 3.16Å
228	P	66.8	Low	80.1	Confident	44 Å²	44	56.2 Å²	56.2	29%	0.286	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-55.9	126.6	179.1	18.8	-27.8	0	0	0	108.4	T226 Q496 N497	T226-P228 VanDerWaalsContact O-N 3.16Å; P228-Q496 HydrophobicContact CG-CB 4.38Å; P228-N497 VanDerWaalsContact CB-OD1 3.27Å; P228-N497 WeakPolarHBondContact CB-OD1 3.45Å; P228-N497 WeakPolarHBondContact CG-OD1 3.44Å
229	G	71.1	Confident	79.8	Confident	45 Å²	45	60.8 Å²	60.8	46%	0.464	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-60.1	159.2	179	0	0	0	0	0	111.1	N227 F231 S232	N227-G229 PolarHBondContact O-N 2.56Å; N227-G229 VanDerWaalsContact O-N 3.16Å; G229-F231 PolarHBondContact O-N 2.87Å; G229-S232 WeakPolarHBondContact O-CB 3.21Å; G229-S232 PolarHBondContact O-N 3.48Å; G229-S232 PolarHBondContact O-OG 3.2Å
230	V	77.8	Confident	79.8	Confident	73 Å²	73	66 Å²	66	44%	0.442	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-26.9	-178.6	178.3	0	0	0	0	113	G500 I503	V230-G500 WeakPolarHBondContact O-CA 3.27Å; V230-G500 PolarHBondContact O-N 2.94Å; V230-I503 HydrophobicContact CG1-CD1 3.57Å
231	F	80.1	Confident	79.7	Confident	119 Å²	119	68.8 Å²	68.8	52%	0.522	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	23	177.2	-59.6	-69.4	0	0	0	113.8	G229 F233 L234	G229-F231 PolarHBondContact O-N 2.87Å; F231-F233 AromaticContact CD1-CE1 3.95Å; F231-F233 HydrophobicContact CD1-CE1 3.95Å; F231-F233 HydrophobicContact CD1-CZ 4.15Å; F231-F233 PolarHBondContact O-N 2.77Å; F231-F233 VanDerWaalsContact O-N 3.1Å; F231-L234 HydrophobicContact CB-CD1 4.3Å; F231-L234 WeakPolarHBondContact O-CB 3.44Å; F231-L234 PolarHBondContact O-N 2.7Å
232	S	78.6	Confident	79.8	Confident	4 Å²	4	69.3 Å²	69.3	3%	0.028	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-57	-27	-179	59.1	0	0	0	0	113.6	G229 L234 N235 N497	G229-S232 WeakPolarHBondContact O-CB 3.21Å; G229-S232 PolarHBondContact O-N 3.48Å; G229-S232 PolarHBondContact O-OG 3.2Å; S232-L234 PolarHBondContact O-N 3.28Å; S232-N235 VanDerWaalsContact O-CB 3.28Å; S232-N235 WeakPolarHBondContact O-CB 3.4Å; S232-N235 PolarHBondContact O-N 2.88Å; S232-N235 VanDerWaalsContact O-N 3.09Å; S232-N497 PolarHBondContact OG-O 3.29Å
233	F	82.5	Confident	80.1	Confident	37 Å²	37	72.5 Å²	72.5	16%	0.162	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-62.5	-17.8	174.1	70.9	-91.1	0	0	0	114.1	F231 P236 Y329 I501 V504	F231-F233 AromaticContact CD1-CE1 3.95Å; F231-F233 HydrophobicContact CD1-CE1 3.95Å; F231-F233 HydrophobicContact CD1-CZ 4.15Å; F231-F233 PolarHBondContact O-N 2.77Å; F231-F233 VanDerWaalsContact O-N 3.1Å; F233-P236 VanDerWaalsContact O-CD 3.27Å; F233-P236 WeakPolarHBondContact O-CD 3.25Å; F233-Y329 WeakPolarHBondContact O-CE2 3.47Å; F233-Y329 PolarHBondContact O-OH 2.83Å; F233-I501 HydrophobicContact CD1-CG1 4.15Å; F233-I501 HydrophobicContact CE1-CG1 4.48Å; F233-I501 HydrophobicContact CG-CG1 4.24Å; F233-V504 HydrophobicContact CZ-CG2 4.39Å
234	L	86.4	Confident	80.8	Confident	65 Å²	65	78.9 Å²	78.9	34%	0.34	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-85	-20	174.5	-64.5	177.7	0	0	0	113.3	F231 S232 L237 W242	F231-L234 HydrophobicContact CB-CD1 4.3Å; F231-L234 WeakPolarHBondContact O-CB 3.44Å; F231-L234 PolarHBondContact O-N 2.7Å; S232-L234 PolarHBondContact O-N 3.28Å; L234-L237 PolarHBondContact O-N 2.84Å; L234-W242 HydrophobicContact CD2-CH2 4.16Å; L234-W242 HydrophobicContact CD2-CZ2 3.64Å; L234-W242 PolarHBondContact O-NE1 2.92Å; L234-W242 VanDerWaalsContact O-NE1 3.13Å
235	N	84.4	Confident	82	Confident	97 Å²	97	73.3 Å²	73.3	52%	0.519	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-25.5	-176.2	-65.4	-13.3	0	0	0	116.5	S232 L237 F336	S232-N235 VanDerWaalsContact O-CB 3.28Å; S232-N235 WeakPolarHBondContact O-CB 3.4Å; S232-N235 PolarHBondContact O-N 2.88Å; S232-N235 VanDerWaalsContact O-N 3.09Å; N235-L237 PolarHBondContact O-N 3.19Å; N235-L237 VanDerWaalsContact O-N 3.1Å; N235-F336 HydrophobicContact CB-CE2 4.39Å; N235-F336 HydrophobicContact CB-CZ 4.19Å
236	P	87.9	Confident	83.5	Confident	14 Å²	14	75.5 Å²	75.5	9%	0.091	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-16.7	178.7	-25.9	35.1	0	0	0	114.9	F233 Y329 N332 L333	F233-P236 VanDerWaalsContact O-CD 3.27Å; F233-P236 WeakPolarHBondContact O-CD 3.25Å; P236-Y329 HydrophobicContact CB-CD2 4.2Å; P236-Y329 HydrophobicContact CB-CE2 4.17Å; P236-Y329 HydrophobicContact CG-CE2 4.08Å; P236-N332 HydrophobicContact CB-CB 4.02Å; P236-N332 PolarHBondContact O-ND2 2.71Å; P236-L333 HydrophobicContact CB-CB 4.41Å; P236-L333 HydrophobicContact CG-CB 4.01Å; P236-L333 HydrophobicContact CG-CD1 3.72Å; P236-L333 HydrophobicContact CG-CG 4.47Å
237	L	88.8	Confident	85.1	Confident	17 Å²	17	75.2 Å²	75.2	9%	0.089	40%	0.398	C	S	.	.	S	Bend	trans	-126.1	144	173.7	-66.8	174.7	0	0	0	109.3	L234 N235 I241 W242 I245 Y329	L234-L237 PolarHBondContact O-N 2.84Å; N235-L237 PolarHBondContact O-N 3.19Å; N235-L237 VanDerWaalsContact O-N 3.1Å; L237-I241 HydrophobicContact CB-CB 4.49Å; L237-I241 HydrophobicContact CB-CG2 4.45Å; L237-I241 HydrophobicContact CD1-CG2 4.31Å; L237-I241 HydrophobicContact CD2-CD1 4.22Å; L237-I241 HydrophobicContact CD2-CG2 4.29Å; L237-W242 HydrophobicContact CD1-CZ2 4.34Å; L237-I245 HydrophobicContact CD1-CD1 4.32Å; L237-Y329 HydrophobicContact CD1-CD2 4.02Å; L237-Y329 HydrophobicContact CG-CD2 4.24Å
238	S	90.2	Very high	86.7	Confident	50 Å²	50	70.7 Å²	70.7	35%	0.35	38%	0.378	S	S	.	.			trans	-66.9	152.9	176.7	68.3	0	0	0	0	111.2	D240 I241 W242	S238-D240 PolarHBondContact O-N 2.74Å; S238-D240 VanDerWaalsContact O-N 3.15Å; S238-I241 PolarHBondContact O-N 2.92Å; S238-I241 WeakPolarHBondContact OG-CG1 3.25Å; S238-I241 PolarHBondContact OG-N 3.48Å; S238-W242 PolarHBondContact O-N 2.81Å
239	P	89.7	Confident	87.9	Confident	100 Å²	100	70.4 Å²	70.4	65%	0.649	37%	0.372	S	S	*	.	H	α-helix	trans	-54	-33.1	175.1	-27.1	35.4	0	0	0	113.4	W242 M243	P239-W242 WeakPolarHBondContact O-CB 3.45Å; P239-W242 PolarHBondContact O-N 2.91Å; P239-M243 WeakPolarHBondContact O-CG 3.46Å; P239-M243 PolarHBondContact O-N 3.4Å; P239-M243 VanDerWaalsContact O-N 3.1Å
240	D	93.1	Very high	88.9	Confident	109 Å²	109	71.7 Å²	71.7	58%	0.583	37%	0.368	S	S	*	.	H	α-helix	trans	-64.1	-42.2	177.7	-56.7	-38.4	0	0	0	111.9	S238 W242 M243 Y244	S238-D240 PolarHBondContact O-N 2.74Å; S238-D240 VanDerWaalsContact O-N 3.15Å; D240-W242 VanDerWaalsContact C-N 3.32Å; D240-W242 PolarHBondContact O-N 2.96Å; D240-M243 PolarHBondContact O-N 2.86Å; D240-Y244 HydrophobicContact CB-CE2 4.22Å; D240-Y244 WeakPolarHBondContact O-CD2 3.33Å; D240-Y244 PolarHBondContact O-N 2.96Å
241	I	93	Very high	89.7	Confident	64 Å²	64	69.9 Å²	69.9	33%	0.328	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-40.7	177.7	-65.5	169	0	0	0	110.3	L237 S238 M243 Y244 I245	L237-I241 HydrophobicContact CB-CB 4.49Å; L237-I241 HydrophobicContact CB-CG2 4.45Å; L237-I241 HydrophobicContact CD1-CG2 4.31Å; L237-I241 HydrophobicContact CD2-CD1 4.22Å; L237-I241 HydrophobicContact CD2-CG2 4.29Å; S238-I241 PolarHBondContact O-N 2.92Å; S238-I241 WeakPolarHBondContact OG-CG1 3.25Å; S238-I241 PolarHBondContact OG-N 3.48Å; I241-M243 VanDerWaalsContact C-N 3.3Å; I241-M243 PolarHBondContact O-N 3.49Å; I241-Y244 PolarHBondContact O-N 3.43Å; I241-I245 HydrophobicContact CG2-CD1 3.85Å; I241-I245 HydrophobicContact CG2-CG1 4.32Å; I241-I245 VanDerWaalsContact O-CG1 3.31Å; I241-I245 WeakPolarHBondContact O-CG1 3.18Å; I241-I245 PolarHBondContact O-N 3.15Å
242	W	92.3	Very high	90.2	Very high	94 Å²	94	65.9 Å²	65.9	36%	0.356	35%	0.349	S	S	.	.	H	α-helix	trans	-58.6	-41.9	174.5	-76.4	110.6	0	0	0	112.3	L234 L237 S238 P239 D240 I245 L246 Y329	L234-W242 HydrophobicContact CD2-CH2 4.16Å; L234-W242 HydrophobicContact CD2-CZ2 3.64Å; L234-W242 PolarHBondContact O-NE1 2.92Å; L234-W242 VanDerWaalsContact O-NE1 3.13Å; L237-W242 HydrophobicContact CD1-CZ2 4.34Å; S238-W242 PolarHBondContact O-N 2.81Å; P239-W242 WeakPolarHBondContact O-CB 3.45Å; P239-W242 PolarHBondContact O-N 2.91Å; D240-W242 VanDerWaalsContact C-N 3.32Å; D240-W242 PolarHBondContact O-N 2.96Å; W242-I245 PolarHBondContact O-N 2.87Å; W242-L246 PolarHBondContact O-N 2.76Å; W242-Y329 HydrophobicContact CZ2-CE2 4.33Å
243	M	92.8	Very high	90.8	Very high	129 Å²	129	65.8 Å²	65.8	64%	0.635	35%	0.348	S	S	*	.	H	α-helix	trans	-65.8	-40.5	175.8	-67.3	-66.5	-98	0	0	112	P239 D240 I241 L246 L247	P239-M243 WeakPolarHBondContact O-CG 3.46Å; P239-M243 PolarHBondContact O-N 3.4Å; P239-M243 VanDerWaalsContact O-N 3.1Å; D240-M243 PolarHBondContact O-N 2.86Å; I241-M243 VanDerWaalsContact C-N 3.3Å; I241-M243 PolarHBondContact O-N 3.49Å; M243-L246 PolarHBondContact O-N 2.92Å; M243-L247 WeakPolarHBondContact O-CB 3.31Å; M243-L247 PolarHBondContact O-N 2.92Å
244	Y	94.1	Very high	91.2	Very high	163 Å²	163	66.7 Å²	66.7	64%	0.639	36%	0.359	S	S	*	.	H	α-helix	trans	-65.7	-38.2	175.2	-68.3	-52.8	0	0	0	112.9	D240 I241 L247 A248	D240-Y244 HydrophobicContact CB-CE2 4.22Å; D240-Y244 WeakPolarHBondContact O-CD2 3.33Å; D240-Y244 PolarHBondContact O-N 2.96Å; I241-Y244 PolarHBondContact O-N 3.43Å; Y244-L247 PolarHBondContact O-N 3.27Å; Y244-A248 VanDerWaalsContact O-CB 3.25Å; Y244-A248 WeakPolarHBondContact O-CB 3.2Å; Y244-A248 PolarHBondContact O-N 2.95Å
245	I	92.5	Very high	91.3	Very high	14 Å²	14	67 Å²	67	7%	0.072	36%	0.363	C	S	.	.	H	α-helix	trans	-62.1	-45.3	174.6	-69.2	164.9	0	0	0	110.2	L237 I241 W242 A248 Y249 I325	L237-I245 HydrophobicContact CD1-CD1 4.32Å; I241-I245 HydrophobicContact CG2-CD1 3.85Å; I241-I245 HydrophobicContact CG2-CG1 4.32Å; I241-I245 VanDerWaalsContact O-CG1 3.31Å; I241-I245 WeakPolarHBondContact O-CG1 3.18Å; I241-I245 PolarHBondContact O-N 3.15Å; W242-I245 PolarHBondContact O-N 2.87Å; I245-A248 PolarHBondContact O-N 3.32Å; I245-Y249 VanDerWaalsContact O-CB 3.31Å; I245-Y249 WeakPolarHBondContact O-CB 3.43Å; I245-Y249 PolarHBondContact O-N 2.86Å; I245-I325 HydrophobicContact CD1-CG2 3.79Å; I245-I325 HydrophobicContact CG1-CG2 4.45Å
246	L	92	Very high	91.5	Very high	94 Å²	94	62.5 Å²	62.5	49%	0.492	34%	0.339	S	S	.	.	H	α-helix	trans	-61.2	-45.7	177.1	-179.7	65.5	0	0	0	111.6	W242 M243 Y249 L250	W242-L246 PolarHBondContact O-N 2.76Å; M243-L246 PolarHBondContact O-N 2.92Å; L246-Y249 HydrophobicContact CD1-CD1 4.35Å; L246-Y249 PolarHBondContact O-N 3.2Å; L246-L250 HydrophobicContact CG-CD1 4.5Å; L246-L250 WeakPolarHBondContact O-CG 3.48Å; L246-L250 PolarHBondContact O-N 3.5Å
247	L	93.4	Very high	91.5	Very high	118 Å²	118	65 Å²	65	62%	0.618	35%	0.349	S	S	*	.	H	α-helix	trans	-64.8	-43.3	178.8	-175.7	64.8	0	0	0	111.8	M243 Y244 L250 G251	M243-L247 WeakPolarHBondContact O-CB 3.31Å; M243-L247 PolarHBondContact O-N 2.92Å; Y244-L247 PolarHBondContact O-N 3.27Å; L247-L250 PolarHBondContact O-N 3.5Å; L247-G251 PolarHBondContact O-N 3.26Å
248	A	92.6	Very high	91.5	Very high	34 Å²	34	67.5 Å²	67.5	28%	0.281	36%	0.364	S	S	.	.	H	α-helix	trans	-62.6	-43.2	176.4	0	0	0	0	0	111.5	Y244 I245 G251 V252 W318	Y244-A248 VanDerWaalsContact O-CB 3.25Å; Y244-A248 WeakPolarHBondContact O-CB 3.2Å; Y244-A248 PolarHBondContact O-N 2.95Å; I245-A248 PolarHBondContact O-N 3.32Å; A248-G251 PolarHBondContact O-N 3.31Å; A248-V252 WeakPolarHBondContact O-CB 3.42Å; A248-V252 VanDerWaalsContact O-CG2 3.3Å; A248-V252 WeakPolarHBondContact O-CG2 3.47Å; A248-V252 PolarHBondContact O-N 2.91Å; A248-W318 HydrophobicContact CB-CZ3 4.38Å
249	Y	92.7	Very high	91.3	Very high	39 Å²	39	67.3 Å²	67.3	15%	0.153	36%	0.359	C	S	.	.	H	α-helix	trans	-57	-51.3	174.6	159.6	-105.4	0	0	0	111.9	I245 L246 G251 V252 S253 F290 V294 W318	I245-Y249 VanDerWaalsContact O-CB 3.31Å; I245-Y249 WeakPolarHBondContact O-CB 3.43Å; I245-Y249 PolarHBondContact O-N 2.86Å; L246-Y249 HydrophobicContact CD1-CD1 4.35Å; L246-Y249 PolarHBondContact O-N 3.2Å; Y249-G251 VanDerWaalsContact C-N 3.32Å; Y249-G251 PolarHBondContact O-N 2.85Å; Y249-V252 PolarHBondContact O-N 2.84Å; Y249-S253 WeakPolarHBondContact O-CB 3.4Å; Y249-S253 PolarHBondContact O-N 3.13Å; Y249-S253 PolarHBondContact O-OG 3.37Å; Y249-F290 HydrophobicContact CE1-CD1 4.23Å; Y249-F290 AromaticContact CZ-CD1 3.9Å; Y249-F290 WeakPolarHBondContact OH-CB 3.45Å; Y249-F290 PolarHBondContact OH-O 2.81Å; Y249-V294 HydrophobicContact CE2-CG2 3.75Å; Y249-V294 WeakPolarHBondContact OH-CG2 3.48Å; Y249-W318 HydrophobicContact CD2-CZ2 4.33Å
250	L	92.8	Very high	91.1	Very high	71 Å²	71	62.6 Å²	62.6	37%	0.372	33%	0.328	S	S	.	.	H	α-helix	trans	-61.6	-42.3	177.9	-67.4	175	0	0	0	111.6	L246 L247 C254 F290	L246-L250 HydrophobicContact CG-CD1 4.5Å; L246-L250 WeakPolarHBondContact O-CG 3.48Å; L246-L250 PolarHBondContact O-N 3.5Å; L247-L250 PolarHBondContact O-N 3.5Å; L250-C254 WeakPolarHBondContact O-CB 3.47Å; L250-C254 PolarHBondContact O-N 3.24Å; L250-C254 PolarHBondContact O-SG 3.24Å; L250-F290 HydrophobicContact CD2-CD1 4.37Å; L250-F290 HydrophobicContact CD2-CE1 3.67Å; L250-F290 HydrophobicContact CD2-CZ 4.21Å
251	G	92.9	Very high	90.6	Very high	35 Å²	35	64.4 Å²	64.4	36%	0.361	33%	0.327	S	S	.	.	H	α-helix	trans	-60.9	-49.4	177.7	0	0	0	0	0	112.7	L247 A248 Y249 C254 V255	L247-G251 PolarHBondContact O-N 3.26Å; A248-G251 PolarHBondContact O-N 3.31Å; Y249-G251 VanDerWaalsContact C-N 3.32Å; Y249-G251 PolarHBondContact O-N 2.85Å; G251-C254 PolarHBondContact O-N 3.15Å; G251-V255 WeakPolarHBondContact O-CB 3.38Å; G251-V255 VanDerWaalsContact O-CG2 3.29Å; G251-V255 WeakPolarHBondContact O-CG2 3.49Å; G251-V255 PolarHBondContact O-N 3.12Å
252	V	91.3	Very high	90.1	Very high	35 Å²	35	69.3 Å²	69.3	21%	0.212	35%	0.346	C	S	.	.	H	α-helix	trans	-65.1	-42.4	-179.7	173.1	0	0	0	0	111.2	A248 Y249 C254 V255 L256 V314 W318	A248-V252 WeakPolarHBondContact O-CB 3.42Å; A248-V252 VanDerWaalsContact O-CG2 3.3Å; A248-V252 WeakPolarHBondContact O-CG2 3.47Å; A248-V252 PolarHBondContact O-N 2.91Å; Y249-V252 PolarHBondContact O-N 2.84Å; V252-C254 PolarHBondContact O-N 3.46Å; V252-V255 PolarHBondContact O-N 3.13Å; V252-L256 VanDerWaalsContact O-CB 3.24Å; V252-L256 WeakPolarHBondContact O-CB 3.08Å; V252-L256 PolarHBondContact O-N 3.41Å; V252-V314 HydrophobicContact CG1-CG1 4.22Å; V252-W318 HydrophobicContact CB-CD2 4.37Å; V252-W318 HydrophobicContact CB-CE3 4.07Å; V252-W318 HydrophobicContact CB-CZ3 4.38Å; V252-W318 HydrophobicContact CG1-CB 4.06Å; V252-W318 HydrophobicContact CG1-CD2 3.93Å; V252-W318 HydrophobicContact CG1-CE3 4.05Å; V252-W318 HydrophobicContact CG1-CG 3.94Å; V252-W318 HydrophobicContact CG2-CD2 4.39Å; V252-W318 HydrophobicContact CG2-CE3 3.67Å; V252-W318 HydrophobicContact CG2-CZ3 3.98Å
253	S	90.9	Very high	89.7	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.014	33%	0.334	C	S	.	.	H	α-helix	trans	-63.1	-39.5	175.9	-72	0	0	0	0	112.6	Y249 F257 S289	Y249-S253 WeakPolarHBondContact O-CB 3.4Å; Y249-S253 PolarHBondContact O-N 3.13Å; Y249-S253 PolarHBondContact O-OG 3.37Å; S253-F257 WeakPolarHBondContact O-CB 3.46Å; S253-F257 PolarHBondContact O-N 3.44Å; S253-S289 WeakPolarHBondContact O-CB 3.34Å; S253-S289 PolarHBondContact OG-O 3.49Å
254	C	90.4	Very high	88.8	Confident	57 Å²	57	63.8 Å²	63.8	39%	0.385	33%	0.333	S	S	.	.	H	α-helix	trans	-65.9	-45.6	173.9	-75.1	0	0	0	0	112.3	L250 G251 V252 L256 F257 V258	L250-C254 WeakPolarHBondContact O-CB 3.47Å; L250-C254 PolarHBondContact O-N 3.24Å; L250-C254 PolarHBondContact O-SG 3.24Å; G251-C254 PolarHBondContact O-N 3.15Å; V252-C254 PolarHBondContact O-N 3.46Å; C254-L256 VanDerWaalsContact C-N 3.32Å; C254-L256 PolarHBondContact O-N 2.96Å; C254-F257 WeakPolarHBondContact O-CB 3.46Å; C254-F257 PolarHBondContact O-N 2.94Å; C254-V258 VanDerWaalsContact O-CG2 3.32Å; C254-V258 WeakPolarHBondContact O-CG2 3.32Å; C254-V258 PolarHBondContact O-N 2.95Å
255	V	90.2	Very high	87.9	Confident	70 Å²	70	65.1 Å²	65.1	42%	0.424	34%	0.338	S	S	.	.	H	α-helix	trans	-61.7	-42.3	177.4	168.7	0	0	0	0	110.8	G251 V252 V258 I259	G251-V255 WeakPolarHBondContact O-CB 3.38Å; G251-V255 VanDerWaalsContact O-CG2 3.29Å; G251-V255 WeakPolarHBondContact O-CG2 3.49Å; G251-V255 PolarHBondContact O-N 3.12Å; V252-V255 PolarHBondContact O-N 3.13Å; V255-V258 PolarHBondContact O-N 3.29Å; V255-I259 HydrophobicContact CG1-CD1 3.58Å; V255-I259 HydrophobicContact CG1-CG1 4.37Å; V255-I259 WeakPolarHBondContact O-CB 3.35Å; V255-I259 WeakPolarHBondContact O-CG1 3.26Å; V255-I259 PolarHBondContact O-N 3.27Å
256	L	87.8	Confident	87.2	Confident	3 Å²	3	64.8 Å²	64.8	2%	0.016	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-44.3	177	-166.7	154.1	0	0	0	111.2	V252 C254 V258 I259 A260 F284 F292	V252-L256 VanDerWaalsContact O-CB 3.24Å; V252-L256 WeakPolarHBondContact O-CB 3.08Å; V252-L256 PolarHBondContact O-N 3.41Å; C254-L256 VanDerWaalsContact C-N 3.32Å; C254-L256 PolarHBondContact O-N 2.96Å; L256-V258 PolarHBondContact O-N 3.1Å; L256-I259 PolarHBondContact O-N 2.86Å; L256-A260 WeakPolarHBondContact O-CB 3.24Å; L256-A260 PolarHBondContact O-N 2.79Å; L256-F284 HydrophobicContact CD2-CB 4.46Å; L256-F284 HydrophobicContact CD2-CD1 3.31Å; L256-F284 HydrophobicContact CD2-CE1 3.54Å; L256-F284 HydrophobicContact CD2-CG 3.89Å; L256-F284 HydrophobicContact CD2-CZ 4.3Å; L256-F292 HydrophobicContact CD1-CD1 3.49Å; L256-F292 VanDerWaalsContact CD1-CD1 3.49Å; L256-F292 HydrophobicContact CD1-CE1 3.57Å; L256-F292 HydrophobicContact CD1-CG 4.38Å
257	F	88.4	Confident	86.5	Confident	68 Å²	68	63.2 Å²	63.2	30%	0.298	32%	0.324	S	S	.	.	H	α-helix	trans	-58	-47.1	174.7	171.7	-107.1	0	0	0	112.2	S253 C254 R261 L286	S253-F257 WeakPolarHBondContact O-CB 3.46Å; S253-F257 PolarHBondContact O-N 3.44Å; C254-F257 WeakPolarHBondContact O-CB 3.46Å; C254-F257 PolarHBondContact O-N 2.94Å; F257-R261 PolarHBondContact O-N 3.48Å; F257-R261 VanDerWaalsContact O-N 3.08Å; F257-L286 HydrophobicContact CB-CD1 4.2Å; F257-L286 HydrophobicContact CD1-CD1 4.06Å; F257-L286 HydrophobicContact CD2-CB 4.13Å; F257-L286 HydrophobicContact CE2-CB 4.18Å; F257-L286 HydrophobicContact CG-CB 4.45Å; F257-L286 HydrophobicContact CG-CD1 3.99Å
258	V	88.4	Confident	85.5	Confident	68 Å²	68	61 Å²	61	41%	0.412	31%	0.307	S	S	.	.	H	α-helix	trans	-63.3	-50.2	180	172	0	0	0	0	111	C254 V255 L256 A260 R261 F262	C254-V258 VanDerWaalsContact O-CG2 3.32Å; C254-V258 WeakPolarHBondContact O-CG2 3.32Å; C254-V258 PolarHBondContact O-N 2.95Å; V255-V258 PolarHBondContact O-N 3.29Å; L256-V258 PolarHBondContact O-N 3.1Å; V258-A260 VanDerWaalsContact C-N 3.34Å; V258-A260 PolarHBondContact O-N 3.4Å; V258-R261 PolarHBondContact O-N 3.42Å; V258-F262 HydrophobicContact CG1-CD2 3.63Å; V258-F262 HydrophobicContact CG1-CE2 3.59Å; V258-F262 WeakPolarHBondContact O-CD2 3.4Å; V258-F262 PolarHBondContact O-N 3.22Å; V258-F262 VanDerWaalsContact O-N 3.11Å
259	I	86.9	Confident	84.5	Confident	47 Å²	47	61.6 Å²	61.6	24%	0.241	31%	0.306	C	S	.	.	H	α-helix	trans	-65.7	-38.4	-178.7	-67.8	171.7	0	0	0	111.3	V255 L256 R261 F262 S263 T311 V314	V255-I259 HydrophobicContact CG1-CD1 3.58Å; V255-I259 HydrophobicContact CG1-CG1 4.37Å; V255-I259 WeakPolarHBondContact O-CB 3.35Å; V255-I259 WeakPolarHBondContact O-CG1 3.26Å; V255-I259 PolarHBondContact O-N 3.27Å; L256-I259 PolarHBondContact O-N 2.86Å; I259-R261 VanDerWaalsContact C-N 3.29Å; I259-R261 PolarHBondContact O-N 3.15Å; I259-F262 PolarHBondContact O-N 3.44Å; I259-S263 VanDerWaalsContact O-CB 3.26Å; I259-S263 WeakPolarHBondContact O-CB 3.45Å; I259-S263 PolarHBondContact O-N 3.16Å; I259-S263 PolarHBondContact O-OG 3.48Å; I259-T311 HydrophobicContact CB-CG2 4.49Å; I259-T311 HydrophobicContact CG2-CG2 3.78Å; I259-V314 HydrophobicContact CD1-CG2 3.87Å
260	A	84.2	Confident	83.2	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-33.4	176.8	0	0	0	0	0	112	L256 V258 N282 F284 T311	L256-A260 WeakPolarHBondContact O-CB 3.24Å; L256-A260 PolarHBondContact O-N 2.79Å; V258-A260 VanDerWaalsContact C-N 3.34Å; V258-A260 PolarHBondContact O-N 3.4Å; A260-N282 PolarHBondContact O-ND2 2.47Å; A260-F284 HydrophobicContact CB-CB 3.63Å; A260-F284 HydrophobicContact CB-CD2 4.02Å; A260-F284 HydrophobicContact CB-CG 4.01Å; A260-T311 HydrophobicContact CB-CG2 4.19Å
261	R	83.1	Confident	82	Confident	147 Å²	147	63.9 Å²	63.9	56%	0.555	32%	0.319	S	S	*	.	H	α-helix	trans	-71.6	-39.1	175.7	-164.9	77.6	-175.3	62	-10.3	112.4	F257 V258 I259 W267	F257-R261 PolarHBondContact O-N 3.48Å; F257-R261 VanDerWaalsContact O-N 3.08Å; V258-R261 PolarHBondContact O-N 3.42Å; I259-R261 VanDerWaalsContact C-N 3.29Å; I259-R261 PolarHBondContact O-N 3.15Å; R261-W267 HydrophobicContact CG-CZ2 4.43Å; R261-W267 VanDerWaalsContact NH1-CH2 3.33Å; R261-W267 PolarHBondContact O-NE1 2.96Å
262	F	83.3	Confident	80.5	Confident	167 Å²	167	68 Å²	68	73%	0.732	34%	0.339	S	S	*	.	H	α-helix	trans	-78.7	-27.2	-178.8	-80	-63.1	0	0	0	113.9	V258 I259 P264	V258-F262 HydrophobicContact CG1-CD2 3.63Å; V258-F262 HydrophobicContact CG1-CE2 3.59Å; V258-F262 WeakPolarHBondContact O-CD2 3.4Å; V258-F262 PolarHBondContact O-N 3.22Å; V258-F262 VanDerWaalsContact O-N 3.11Å; I259-F262 PolarHBondContact O-N 3.44Å; F262-P264 VanDerWaalsContact O-CD 3.26Å; F262-P264 WeakPolarHBondContact O-CD 3.35Å
263	S	82.9	Confident	79.3	Confident	15 Å²	15	72.4 Å²	72.4	11%	0.105	37%	0.37	C	S	.	.			trans	-79.3	112.5	-177.4	-60.5	0	0	0	0	110.2	I259 Y265 E266 S310	I259-S263 VanDerWaalsContact O-CB 3.26Å; I259-S263 WeakPolarHBondContact O-CB 3.45Å; I259-S263 PolarHBondContact O-N 3.16Å; I259-S263 PolarHBondContact O-OG 3.48Å; S263-Y265 PolarHBondContact O-N 3.37Å; S263-E266 PolarHBondContact O-N 2.74Å; S263-S310 PolarHBondContact OG-OG 2.81Å; S263-S310 VanDerWaalsContact OG-OG 3.07Å
264	P	73.8	Confident	77.9	Confident	93 Å²	93	76.3 Å²	76.3	60%	0.604	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-63.7	-25.2	-177.7	25.2	-33.5	0	0	0	112.5	F262 E266 W267	F262-P264 VanDerWaalsContact O-CD 3.26Å; F262-P264 WeakPolarHBondContact O-CD 3.35Å; P264-E266 VanDerWaalsContact C-N 3.25Å; P264-E266 PolarHBondContact O-N 2.78Å; P264-W267 PolarHBondContact O-N 3.41Å
265	Y	75.2	Confident	76.6	Confident	190 Å²	190	78.9 Å²	78.9	75%	0.745	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-72.1	-10.7	178.9	-56.9	-68.1	0	0	0	115	S263	S263-Y265 PolarHBondContact O-N 3.37Å
266	E	77.1	Confident	75	Confident	7 Å²	7	82.2 Å²	82.2	3%	0.033	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-88	-15.6	174.3	-69.4	-66.9	176.3	0	0	112.8	S263 P264 K307 A308 T311	S263-E266 PolarHBondContact O-N 2.74Å; P264-E266 VanDerWaalsContact C-N 3.25Å; P264-E266 PolarHBondContact O-N 2.78Å; E266-K307 PolarHBondContact OE1-N 3.34Å; E266-K307 PolarHBondContact OE2-N 2.76Å; E266-A308 HydrophobicContact CG-CB 3.83Å; E266-A308 WeakPolarHBondContact OE1-CB 3.44Å; E266-A308 PolarHBondContact OE1-N 3.24Å; E266-T311 HydrophobicContact CG-CG2 4.17Å; E266-T311 WeakPolarHBondContact OE1-CB 3.34Å; E266-T311 PolarHBondContact OE1-OG1 2.92Å
267	W	77.8	Confident	73.7	Confident	62 Å²	62	83.2 Å²	83.2	24%	0.235	43%	0.429	C	S	.	.			trans	-79.6	128	175.9	-66.7	83.2	0	0	0	109.7	R261 P264 V280 N282	R261-W267 HydrophobicContact CG-CZ2 4.43Å; R261-W267 VanDerWaalsContact NH1-CH2 3.33Å; R261-W267 PolarHBondContact O-NE1 2.96Å; P264-W267 PolarHBondContact O-N 3.41Å; W267-V280 HydrophobicContact CB-CB 4.17Å; W267-V280 HydrophobicContact CB-CG2 4.45Å; W267-V280 HydrophobicContact CD2-CG2 4.14Å; W267-V280 HydrophobicContact CE3-CB 3.78Å; W267-V280 HydrophobicContact CE3-CG2 3.4Å; W267-V280 VanDerWaalsContact CE3-CG2 3.4Å; W267-V280 HydrophobicContact CZ3-CG2 4.06Å; W267-V280 WeakPolarHBondContact CZ3-O 3.41Å; W267-N282 HydrophobicContact CD2-CB 4.13Å; W267-N282 HydrophobicContact CE3-CB 4.03Å; W267-N282 HydrophobicContact CH2-CB 3.86Å; W267-N282 HydrophobicContact CZ2-CB 3.89Å; W267-N282 HydrophobicContact CZ3-CB 3.96Å
268	Y	72.1	Confident	72.4	Confident	71 Å²	71	87.8 Å²	87.8	28%	0.278	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-131.3	152	176	73.8	-86.1	0	0	0	111.4	P270 E281 N283	Y268-P270 WeakPolarHBondContact O-CD 3.32Å; Y268-E281 WeakPolarHBondContact CD1-O 3.41Å; Y268-E281 PolarHBondContact N-O 3.34Å; Y268-E281 PolarHBondContact O-N 3.36Å; Y268-N283 WeakPolarHBondContact CE1-ND2 3.47Å; Y268-N283 WeakPolarHBondContact CE1-OD1 3.31Å; Y268-N283 PolarHBondContact OH-ND2 2.93Å; Y268-N283 VanDerWaalsContact OH-ND2 3.09Å; Y268-N283 PolarHBondContact OH-OD1 3.27Å
269	N	71.8	Confident	71.2	Confident	46 Å²	46	88.9 Å²	88.9	25%	0.246	46%	0.464	C	S	.	.			trans	-80.9	118.5	176	-176.9	-13.7	0	0	0	109.1	H271 N274 S277	N269-H271 PolarHBondContact O-N 3.28Å; N269-H271 PolarHBondContact OD1-N 3.4Å; N269-H271 PolarHBondContact OD1-O 2.97Å; N269-N274 PolarHBondContact ND2-O 3.24Å; N269-S277 VanDerWaalsContact CG-OG 3.26Å; N269-S277 PolarHBondContact ND2-OG 3.37Å; N269-S277 PolarHBondContact OD1-OG 3.24Å
270	P	65.7	Low	70.3	Confident	34 Å²	34	90.2 Å²	90.2	22%	0.221	47%	0.474	C	S	.	.	S	Bend	trans	-69.3	-15.3	-180	29.6	-35.3	0	0	0	113.4	Y268 P272 V279 E281	Y268-P270 WeakPolarHBondContact O-CD 3.32Å; P270-P272 VanDerWaalsContact O-CD 3.31Å; P270-P272 WeakPolarHBondContact O-CD 3.44Å; P270-V279 VanDerWaalsContact CD-O 3.24Å; P270-V279 WeakPolarHBondContact CD-O 3.26Å; P270-E281 HydrophobicContact CB-CG 4.42Å; P270-E281 HydrophobicContact CG-CG 3.95Å
271	H	67.9	Low	69.6	Low	125 Å²	125	94.5 Å²	94.5	58%	0.579	49%	0.494	S	S	*	.			trans	-115.3	86	178.7	-64.7	-46.9	0	0	0	111.2	N269 C273 N274	N269-H271 PolarHBondContact O-N 3.28Å; N269-H271 PolarHBondContact OD1-N 3.4Å; N269-H271 PolarHBondContact OD1-O 2.97Å; H271-C273 PolarHBondContact O-N 2.9Å; H271-N274 PolarHBondContact O-N 3.41Å
272	P	61.7	Low	69.3	Low	120 Å²	120	88.6 Å²	88.6	78%	0.779	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.5	-176.4	23.4	-32.6	0	0	0	114.2	P270	P270-P272 VanDerWaalsContact O-CD 3.31Å; P270-P272 WeakPolarHBondContact O-CD 3.44Å
273	C	66.3	Low	68.9	Low	128 Å²	128	83.8 Å²	83.8	87%	0.865	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-7.8	177.6	-57.7	0	0	0	0	114.2	H271	H271-C273 PolarHBondContact O-N 2.9Å
274	N	62	Low	68.7	Low	84 Å²	84	83.5 Å²	83.5	45%	0.449	45%	0.452	S	S	.	.			trans	-126.5	92.6	176.8	-168.4	14.2	0	0	0	110.7	N269 H271 D276 S277	N269-N274 PolarHBondContact ND2-O 3.24Å; H271-N274 PolarHBondContact O-N 3.41Å; N274-D276 PolarHBondContact O-N 3Å; N274-S277 PolarHBondContact O-N 3.45Å; N274-S277 PolarHBondContact O-OG 3.36Å
275	P	61.3	Low	69.1	Low	111 Å²	111	82.1 Å²	82.1	72%	0.721	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.1	-175.4	19.7	-25.3	0	0	0	114.4
276	D	57.9	Low	69.5	Low	141 Å²	141	76.6 Å²	76.6	75%	0.754	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	15.1	-177.5	-63.6	-38.1	0	0	0	114.1	N274 D278	N274-D276 PolarHBondContact O-N 3Å; D276-D278 PolarHBondContact O-N 3.49Å
277	S	60.9	Low	69.9	Low	23 Å²	23	82.8 Å²	82.8	16%	0.161	46%	0.457	C	S	.	.			trans	-78.9	117.6	175.1	62.1	0	0	0	0	111.4	N269 N274 V279	N269-S277 VanDerWaalsContact CG-OG 3.26Å; N269-S277 PolarHBondContact ND2-OG 3.37Å; N269-S277 PolarHBondContact OD1-OG 3.24Å; N274-S277 PolarHBondContact O-N 3.45Å; N274-S277 PolarHBondContact O-OG 3.36Å; S277-V279 PolarHBondContact O-N 2.92Å
278	D	60.4	Low	70.3	Confident	164 Å²	164	82.5 Å²	82.5	88%	0.877	46%	0.461	S	S	*	.			trans	-64.8	-3.6	175	-70.6	-33.2	0	0	0	114.5	D276 V280	D276-D278 PolarHBondContact O-N 3.49Å; D278-V280 PolarHBondContact O-N 3.12Å
279	V	62.6	Low	71	Confident	92 Å²	92	79.1 Å²	79.1	56%	0.558	45%	0.447	S	S	*	.			trans	-86.8	98	-179.4	-171.8	0	0	0	0	109.3	P270 S277	P270-V279 VanDerWaalsContact CD-O 3.24Å; P270-V279 WeakPolarHBondContact CD-O 3.26Å; S277-V279 PolarHBondContact O-N 2.92Å
280	V	68.9	Low	71.9	Confident	74 Å²	74	79.2 Å²	79.2	45%	0.448	45%	0.445	S	S	.	.			trans	-99.5	136.7	170.3	-72.6	0	0	0	0	110.5	W267 D278	W267-V280 HydrophobicContact CB-CB 4.17Å; W267-V280 HydrophobicContact CB-CG2 4.45Å; W267-V280 HydrophobicContact CD2-CG2 4.14Å; W267-V280 HydrophobicContact CE3-CB 3.78Å; W267-V280 HydrophobicContact CE3-CG2 3.4Å; W267-V280 VanDerWaalsContact CE3-CG2 3.4Å; W267-V280 HydrophobicContact CZ3-CG2 4.06Å; W267-V280 WeakPolarHBondContact CZ3-O 3.41Å; D278-V280 PolarHBondContact O-N 3.12Å
281	E	69.5	Low	72.9	Confident	90 Å²	90	85.8 Å²	85.8	42%	0.421	47%	0.466	S	S	.	.	B	Isolated β-bridge	trans	-111.1	148.7	178.3	-70.3	-174.9	172.1	0	0	111.2	Y268 P270	Y268-E281 WeakPolarHBondContact CD1-O 3.41Å; Y268-E281 PolarHBondContact N-O 3.34Å; Y268-E281 PolarHBondContact O-N 3.36Å; P270-E281 HydrophobicContact CB-CG 4.42Å; P270-E281 HydrophobicContact CG-CG 3.95Å
282	N	76.6	Confident	73.8	Confident	24 Å²	24	80.2 Å²	80.2	13%	0.128	44%	0.44	C	S	.	.			trans	-126.8	121.5	175.1	-171.1	-30.5	0	0	0	108.8	A260 W267 F284	A260-N282 PolarHBondContact O-ND2 2.47Å; W267-N282 HydrophobicContact CD2-CB 4.13Å; W267-N282 HydrophobicContact CE3-CB 4.03Å; W267-N282 HydrophobicContact CH2-CB 3.86Å; W267-N282 HydrophobicContact CZ2-CB 3.89Å; W267-N282 HydrophobicContact CZ3-CB 3.96Å; N282-F284 VanDerWaalsContact C-N 3.29Å; N282-F284 PolarHBondContact O-N 3.34Å; N282-F284 PolarHBondContact OD1-N 2.99Å
283	N	74.8	Confident	75	Confident	65 Å²	65	74.5 Å²	74.5	35%	0.348	40%	0.403	S	S	.	.	S	Bend	trans	-76.1	-16.6	-176.1	-72.3	-7	0	0	0	113.2	Y268 T285 N288 L304	Y268-N283 WeakPolarHBondContact CE1-ND2 3.47Å; Y268-N283 WeakPolarHBondContact CE1-OD1 3.31Å; Y268-N283 PolarHBondContact OH-ND2 2.93Å; Y268-N283 VanDerWaalsContact OH-ND2 3.09Å; Y268-N283 PolarHBondContact OH-OD1 3.27Å; N283-T285 PolarHBondContact O-N 3.22Å; N283-T285 VanDerWaalsContact O-N 3.13Å; N283-N288 VanDerWaalsContact O-CB 3.3Å; N283-N288 WeakPolarHBondContact O-CB 3.27Å; N283-N288 PolarHBondContact O-ND2 2.9Å; N283-L304 HydrophobicContact CB-CD2 4.03Å
284	F	78	Confident	76	Confident	10 Å²	10	70.9 Å²	70.9	4%	0.044	38%	0.377	C	S	.	.			trans	-86.3	75.3	175.5	-71.6	-73.6	0	0	0	111.4	L256 A260 N282 F292 L304 P306	L256-F284 HydrophobicContact CD2-CB 4.46Å; L256-F284 HydrophobicContact CD2-CD1 3.31Å; L256-F284 HydrophobicContact CD2-CE1 3.54Å; L256-F284 HydrophobicContact CD2-CG 3.89Å; L256-F284 HydrophobicContact CD2-CZ 4.3Å; A260-F284 HydrophobicContact CB-CB 3.63Å; A260-F284 HydrophobicContact CB-CD2 4.02Å; A260-F284 HydrophobicContact CB-CG 4.01Å; N282-F284 VanDerWaalsContact C-N 3.29Å; N282-F284 PolarHBondContact O-N 3.34Å; N282-F284 PolarHBondContact OD1-N 2.99Å; F284-F292 HydrophobicContact CE1-CB 4.31Å; F284-F292 HydrophobicContact CE1-CD2 4.19Å; F284-F292 HydrophobicContact CE1-CG 4.22Å; F284-L304 HydrophobicContact CE1-CB 4.19Å; F284-L304 HydrophobicContact CZ-CB 4.33Å; F284-P306 HydrophobicContact CE2-CB 4.29Å; F284-P306 HydrophobicContact CZ-CB 4.18Å
285	T	82.9	Confident	77.2	Confident	64 Å²	64	67.4 Å²	67.4	39%	0.393	36%	0.361	S	S	.	.			trans	-73.7	160.8	160.5	68.3	0	0	0	0	110.1	N283 L287 N288 S289	N283-T285 PolarHBondContact O-N 3.22Å; N283-T285 VanDerWaalsContact O-N 3.13Å; T285-L287 PolarHBondContact O-N 3.07Å; T285-N288 CarbonylContact O-C 3.59Å; T285-N288 WeakPolarHBondContact O-CA 3.39Å; T285-N288 WeakPolarHBondContact O-CB 3.35Å; T285-N288 PolarHBondContact O-N 2.64Å; T285-N288 WeakPolarHBondContact OG1-CB 3.43Å; T285-N288 PolarHBondContact OG1-N 2.9Å; T285-N288 PolarHBondContact OG1-ND2 2.95Å; T285-S289 PolarHBondContact O-N 3.21Å; T285-S289 PolarHBondContact O-OG 3.29Å
286	L	83.5	Confident	78.3	Confident	74 Å²	74	62.4 Å²	62.4	39%	0.387	33%	0.329	S	S	.	.	H	α-helix	trans	-53.9	-41.5	-179.1	-175.5	69.1	0	0	0	112.5	F257 S289 F290	F257-L286 HydrophobicContact CB-CD1 4.2Å; F257-L286 HydrophobicContact CD1-CD1 4.06Å; F257-L286 HydrophobicContact CD2-CB 4.13Å; F257-L286 HydrophobicContact CE2-CB 4.18Å; F257-L286 HydrophobicContact CG-CB 4.45Å; F257-L286 HydrophobicContact CG-CD1 3.99Å; L286-S289 PolarHBondContact O-N 3.39Å; L286-F290 HydrophobicContact CD1-CE2 3.99Å; L286-F290 HydrophobicContact CD1-CZ 4.17Å; L286-F290 HydrophobicContact CD2-CE2 4.14Å; L286-F290 HydrophobicContact CG-CD2 4.22Å; L286-F290 HydrophobicContact CG-CE2 3.67Å; L286-F290 HydrophobicContact CG-CZ 4.34Å; L286-F290 WeakPolarHBondContact O-CD2 3.38Å; L286-F290 PolarHBondContact O-N 2.68Å
287	L	85.9	Confident	79.7	Confident	136 Å²	136	57.7 Å²	57.7	71%	0.712	30%	0.304	S	S	*	.	H	α-helix	trans	-66.7	-40.4	175.8	-70.1	171	0	0	0	112.2	T285 S289 F290 W291	T285-L287 PolarHBondContact O-N 3.07Å; L287-S289 VanDerWaalsContact C-N 3.33Å; L287-F290 PolarHBondContact O-N 2.91Å; L287-W291 PolarHBondContact O-N 2.8Å
288	N	85.7	Confident	80.9	Confident	57 Å²	57	62 Å²	62	31%	0.305	32%	0.323	S	S	.	.	H	α-helix	trans	-68.8	-31.5	176.5	-72	-6.4	0	0	0	112.2	N283 T285 W291 F292 L304	N283-N288 VanDerWaalsContact O-CB 3.3Å; N283-N288 WeakPolarHBondContact O-CB 3.27Å; N283-N288 PolarHBondContact O-ND2 2.9Å; T285-N288 CarbonylContact O-C 3.59Å; T285-N288 WeakPolarHBondContact O-CA 3.39Å; T285-N288 WeakPolarHBondContact O-CB 3.35Å; T285-N288 PolarHBondContact O-N 2.64Å; T285-N288 WeakPolarHBondContact OG1-CB 3.43Å; T285-N288 PolarHBondContact OG1-N 2.9Å; T285-N288 PolarHBondContact OG1-ND2 2.95Å; N288-W291 PolarHBondContact O-N 2.84Å; N288-F292 WeakPolarHBondContact O-CB 3.42Å; N288-F292 PolarHBondContact O-N 3.32Å; N288-L304 HydrophobicContact CB-CD1 3.62Å; N288-L304 WeakPolarHBondContact O-CD1 3.24Å
289	S	87	Confident	82	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-70.3	-34.6	172.3	-62	0	0	0	0	112.6	S253 T285 L286 L287 G293	S253-S289 WeakPolarHBondContact O-CB 3.34Å; S253-S289 PolarHBondContact OG-O 3.49Å; T285-S289 PolarHBondContact O-N 3.21Å; T285-S289 PolarHBondContact O-OG 3.29Å; L286-S289 PolarHBondContact O-N 3.39Å; L287-S289 VanDerWaalsContact C-N 3.33Å; S289-G293 PolarHBondContact O-N 3.45Å
290	F	89.5	Confident	82.9	Confident	47 Å²	47	64.3 Å²	64.3	21%	0.206	32%	0.322	C	S	.	.	H	α-helix	trans	-66.1	-45.8	168.4	-73.5	-47.6	0	0	0	111.2	Y249 L250 L286 L287 F292 G293 V294	Y249-F290 HydrophobicContact CE1-CD1 4.23Å; Y249-F290 AromaticContact CZ-CD1 3.9Å; Y249-F290 WeakPolarHBondContact OH-CB 3.45Å; Y249-F290 PolarHBondContact OH-O 2.81Å; L250-F290 HydrophobicContact CD2-CD1 4.37Å; L250-F290 HydrophobicContact CD2-CE1 3.67Å; L250-F290 HydrophobicContact CD2-CZ 4.21Å; L286-F290 HydrophobicContact CD1-CE2 3.99Å; L286-F290 HydrophobicContact CD1-CZ 4.17Å; L286-F290 HydrophobicContact CD2-CE2 4.14Å; L286-F290 HydrophobicContact CG-CD2 4.22Å; L286-F290 HydrophobicContact CG-CE2 3.67Å; L286-F290 HydrophobicContact CG-CZ 4.34Å; L286-F290 WeakPolarHBondContact O-CD2 3.38Å; L286-F290 PolarHBondContact O-N 2.68Å; L287-F290 PolarHBondContact O-N 2.91Å; F290-F292 VanDerWaalsContact C-N 3.34Å; F290-F292 PolarHBondContact O-N 2.92Å; F290-G293 WeakPolarHBondContact O-CA 3.4Å; F290-G293 PolarHBondContact O-N 3.29Å; F290-V294 PolarHBondContact O-N 3.24Å
291	W	88.1	Confident	83.4	Confident	172 Å²	172	62.6 Å²	62.6	65%	0.652	32%	0.32	S	S	*	.	H	α-helix	trans	-59.7	-41.7	177.2	-169.7	-112.2	0	0	0	112.9	L287 N288 G293 V294 G295	L287-W291 PolarHBondContact O-N 2.8Å; N288-W291 PolarHBondContact O-N 2.84Å; W291-G293 VanDerWaalsContact C-N 3.34Å; W291-G293 PolarHBondContact O-N 2.99Å; W291-V294 PolarHBondContact O-N 2.83Å; W291-G295 PolarHBondContact O-N 2.87Å
292	F	86.6	Confident	83.8	Confident	8 Å²	8	60 Å²	60	4%	0.035	31%	0.311	C	S	.	.	H	α-helix	trans	-58.8	-44.3	172.5	179.2	-91	0	0	0	112	L256 F284 N288 F290 G295 A296 L304	L256-F292 HydrophobicContact CD1-CD1 3.49Å; L256-F292 VanDerWaalsContact CD1-CD1 3.49Å; L256-F292 HydrophobicContact CD1-CE1 3.57Å; L256-F292 HydrophobicContact CD1-CG 4.38Å; F284-F292 HydrophobicContact CE1-CB 4.31Å; F284-F292 HydrophobicContact CE1-CD2 4.19Å; F284-F292 HydrophobicContact CE1-CG 4.22Å; N288-F292 WeakPolarHBondContact O-CB 3.42Å; N288-F292 PolarHBondContact O-N 3.32Å; F290-F292 VanDerWaalsContact C-N 3.34Å; F290-F292 PolarHBondContact O-N 2.92Å; F292-G295 PolarHBondContact O-N 3Å; F292-A296 PolarHBondContact O-N 3.08Å; F292-A296 VanDerWaalsContact O-N 3.13Å; F292-L304 WeakPolarHBondContact CD2-O 3.31Å; F292-L304 WeakPolarHBondContact CE2-O 3.35Å
293	G	86.3	Confident	83.7	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.01	35%	0.349	C	S	.	.	H	α-helix	trans	-61.9	-42.8	177.6	0	0	0	0	0	113	S289 F290 W291 L297 W318	S289-G293 PolarHBondContact O-N 3.45Å; F290-G293 WeakPolarHBondContact O-CA 3.4Å; F290-G293 PolarHBondContact O-N 3.29Å; W291-G293 VanDerWaalsContact C-N 3.34Å; W291-G293 PolarHBondContact O-N 2.99Å; G293-L297 PolarHBondContact O-N 2.89Å; G293-L297 VanDerWaalsContact O-N 3.13Å; G293-W318 PolarHBondContact O-NE1 2.78Å
294	V	87.9	Confident	83.7	Confident	52 Å²	52	66.7 Å²	66.7	32%	0.315	34%	0.34	S	S	.	.	H	α-helix	trans	-66.2	-45.9	176.7	174.6	0	0	0	0	111.5	Y249 F290 W291 A296 L297 M298	Y249-V294 HydrophobicContact CE2-CG2 3.75Å; Y249-V294 WeakPolarHBondContact OH-CG2 3.48Å; F290-V294 PolarHBondContact O-N 3.24Å; W291-V294 PolarHBondContact O-N 2.83Å; V294-A296 PolarHBondContact O-N 3.05Å; V294-L297 PolarHBondContact O-N 3.15Å; V294-L297 VanDerWaalsContact O-N 3.08Å; V294-M298 HydrophobicContact CG1-CG 4.29Å; V294-M298 WeakPolarHBondContact O-CG 3.35Å; V294-M298 PolarHBondContact O-N 3.43Å
295	G	86.7	Confident	83.7	Confident	10 Å²	10	73.3 Å²	73.3	10%	0.103	37%	0.373	C	S	.	.	H	α-helix	trans	-60.8	-34.1	179.1	0	0	0	0	0	113.2	W291 F292 Q299 Q300 G301	W291-G295 PolarHBondContact O-N 2.87Å; F292-G295 PolarHBondContact O-N 3Å; G295-Q299 PolarHBondContact O-N 2.79Å; G295-Q300 PolarHBondContact O-N 2.89Å; G295-G301 WeakPolarHBondContact CA-O 3.46Å; G295-G301 PolarHBondContact O-N 3.35Å; G295-G301 VanDerWaalsContact O-N 3.13Å
296	A	84.8	Confident	83.6	Confident	7 Å²	7	71 Å²	71	6%	0.058	36%	0.359	C	S	.	.	H	α-helix	trans	-72	-35.7	173.2	0	0	0	0	0	113.6	F292 V294 W318 T322	F292-A296 PolarHBondContact O-N 3.08Å; F292-A296 VanDerWaalsContact O-N 3.13Å; V294-A296 PolarHBondContact O-N 3.05Å; A296-W318 VanDerWaalsContact CB-CD1 3.5Å; A296-T322 PolarHBondContact O-OG1 3Å
297	L	86.1	Confident	83.4	Confident	41 Å²	41	72.6 Å²	72.6	22%	0.215	36%	0.363	C	S	.	.	H	α-helix	trans	-72.1	-31.8	176.2	-168.8	71	0	0	0	112.1	G293 V294 Q299 T322 I326	G293-L297 PolarHBondContact O-N 2.89Å; G293-L297 VanDerWaalsContact O-N 3.13Å; V294-L297 PolarHBondContact O-N 3.15Å; V294-L297 VanDerWaalsContact O-N 3.08Å; L297-Q299 VanDerWaalsContact C-N 3.31Å; L297-T322 HydrophobicContact CD1-CG2 3.82Å; L297-I326 WeakPolarHBondContact O-CD1 3.22Å
298	M	86.4	Confident	83.3	Confident	115 Å²	115	66.2 Å²	66.2	57%	0.567	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	3.2	178.3	-65.8	-68.8	114.5	0	0	113.8	V294 Q300	V294-M298 HydrophobicContact CG1-CG 4.29Å; V294-M298 WeakPolarHBondContact O-CG 3.35Å; V294-M298 PolarHBondContact O-N 3.43Å; M298-Q300 PolarHBondContact O-N 3.08Å; M298-Q300 VanDerWaalsContact O-N 3.07Å
299	Q	83.4	Confident	83.3	Confident	128 Å²	128	69.9 Å²	69.9	60%	0.598	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	16.3	-175.8	-58.3	-178.9	3	0	0	115.4	G295 L297 I326	G295-Q299 PolarHBondContact O-N 2.79Å; L297-Q299 VanDerWaalsContact C-N 3.31Å; Q299-I326 HydrophobicContact CG-CD1 3.68Å; Q299-I326 VanDerWaalsContact NE2-CD1 3.32Å; Q299-I326 VanDerWaalsContact NE2-CG2 3.3Å
300	Q	82.1	Confident	83.3	Confident	176 Å²	176	72.1 Å²	72.1	82%	0.822	36%	0.364	S	S	*	.	S	Bend	trans	-91.7	-13.2	179.1	-69.5	-177.2	-2.8	0	0	112.8	G295 M298	G295-Q300 PolarHBondContact O-N 2.89Å; M298-Q300 PolarHBondContact O-N 3.08Å; M298-Q300 VanDerWaalsContact O-N 3.07Å
301	G	78.5	Confident	83.1	Confident	38 Å²	38	69.9 Å²	69.9	39%	0.392	36%	0.355	S	S	.	.			trans	77.6	-179.7	-173.8	0	0	0	0	0	112.1	G295	G295-G301 WeakPolarHBondContact CA-O 3.46Å; G295-G301 PolarHBondContact O-N 3.35Å; G295-G301 VanDerWaalsContact O-N 3.13Å
302	S	79.1	Confident	83.2	Confident	34 Å²	34	68 Å²	68	24%	0.238	35%	0.348	C	S	.	.			trans	-131.1	145.1	174.6	-172.8	0	0	0	0	108.4	L304	S302-L304 PolarHBondContact O-N 2.94Å; S302-L304 PolarHBondContact OG-N 3.22Å
303	E	75.4	Confident	83.4	Confident	200 Å²	200	72.2 Å²	72.2	94%	0.935	37%	0.369	S	S	*	.	S	Bend	trans	-64.1	-16.5	170.8	-61.9	-176.7	168.3	0	0	111.9	M305	E303-M305 PolarHBondContact O-N 3.46Å
304	L	74.4	Confident	83.6	Confident	31 Å²	31	73.7 Å²	73.7	16%	0.162	38%	0.378	C	S	.	.			trans	-86.1	105	179.1	-58.3	170	0	0	0	110.3	N283 F284 N288 F292 S302	N283-L304 HydrophobicContact CB-CD2 4.03Å; F284-L304 HydrophobicContact CE1-CB 4.19Å; F284-L304 HydrophobicContact CZ-CB 4.33Å; N288-L304 HydrophobicContact CB-CD1 3.62Å; N288-L304 WeakPolarHBondContact O-CD1 3.24Å; F292-L304 WeakPolarHBondContact CD2-O 3.31Å; F292-L304 WeakPolarHBondContact CE2-O 3.35Å; S302-L304 PolarHBondContact O-N 2.94Å; S302-L304 PolarHBondContact OG-N 3.22Å
305	M	76.8	Confident	83.6	Confident	149 Å²	149	71.4 Å²	71.4	73%	0.734	37%	0.365	S	S	*	.			trans	-100	121.1	179.8	-169.9	160.5	62.4	0	0	111.6	E303 K307	E303-M305 PolarHBondContact O-N 3.46Å; M305-K307 PolarHBondContact O-N 3.12Å
306	P	81.7	Confident	83.7	Confident	14 Å²	14	72.6 Å²	72.6	9%	0.091	38%	0.377	C	S	.	.			trans	-64.8	131.1	175.9	23.8	-30.7	0	0	0	111.8	F284 T311 R312	F284-P306 HydrophobicContact CE2-CB 4.29Å; F284-P306 HydrophobicContact CZ-CB 4.18Å; P306-T311 WeakPolarHBondContact CB-OG1 3.13Å; P306-R312 HydrophobicContact CB-CG 4.16Å; P306-R312 HydrophobicContact CG-CG 4.07Å; P306-R312 PolarHBondContact O-NE 2.93Å
307	K	78.6	Confident	84.1	Confident	108 Å²	108	77.8 Å²	77.8	47%	0.47	40%	0.403	S	S	.	.			trans	-93.3	-39.9	-178.3	-65.3	179.4	-177.6	172.8	0	112.1	E266 M305 R312	E266-K307 PolarHBondContact OE1-N 3.34Å; E266-K307 PolarHBondContact OE2-N 2.76Å; M305-K307 PolarHBondContact O-N 3.12Å; K307-R312 PolarHBondContact O-NE 2.93Å
308	A	85.2	Confident	84.3	Confident	3 Å²	3	76.1 Å²	76.1	3%	0.025	39%	0.394	C	S	.	.	S	Bend	trans	-74.6	151.8	-177.8	0	0	0	0	0	112.1	E266 S310 T311 R312	E266-A308 HydrophobicContact CG-CB 3.83Å; E266-A308 WeakPolarHBondContact OE1-CB 3.44Å; E266-A308 PolarHBondContact OE1-N 3.24Å; A308-S310 VanDerWaalsContact C-N 3.33Å; A308-S310 PolarHBondContact O-N 3.21Å; A308-T311 PolarHBondContact O-OG1 3.43Å; A308-R312 WeakPolarHBondContact O-CB 3.33Å; A308-R312 VanDerWaalsContact O-CG 3.24Å; A308-R312 WeakPolarHBondContact O-CG 3.39Å; A308-R312 PolarHBondContact O-N 2.77Å; A308-R312 VanDerWaalsContact O-N 3.12Å
309	L	85.2	Confident	84.5	Confident	133 Å²	133	77.4 Å²	77.4	70%	0.696	39%	0.392	S	S	*	.	H	α-helix	trans	-65	-38.2	178.1	-175.1	65.9	0	0	0	111.8	R312 I313	L309-R312 PolarHBondContact O-N 3.24Å; L309-I313 HydrophobicContact CG-CD1 4.18Å; L309-I313 WeakPolarHBondContact O-CG1 3.47Å; L309-I313 PolarHBondContact O-N 3Å
310	S	87.4	Confident	84.9	Confident	47 Å²	47	77.7 Å²	77.7	33%	0.329	39%	0.392	S	S	.	.	H	α-helix	trans	-61.2	-47.5	179.6	47.4	0	0	0	0	112.6	S263 A308 I313 V314	S263-S310 PolarHBondContact OG-OG 2.81Å; S263-S310 VanDerWaalsContact OG-OG 3.07Å; A308-S310 VanDerWaalsContact C-N 3.33Å; A308-S310 PolarHBondContact O-N 3.21Å; S310-I313 PolarHBondContact O-N 3.4Å; S310-V314 PolarHBondContact O-N 3.39Å
311	T	85.5	Confident	85.4	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.006	37%	0.368	C	S	.	.	H	α-helix	trans	-69.3	-35.3	177.7	50.5	0	0	0	0	111.6	I259 A260 E266 P306 A308 V314 G315	I259-T311 HydrophobicContact CB-CG2 4.49Å; I259-T311 HydrophobicContact CG2-CG2 3.78Å; A260-T311 HydrophobicContact CB-CG2 4.19Å; E266-T311 HydrophobicContact CG-CG2 4.17Å; E266-T311 WeakPolarHBondContact OE1-CB 3.34Å; E266-T311 PolarHBondContact OE1-OG1 2.92Å; P306-T311 WeakPolarHBondContact CB-OG1 3.13Å; A308-T311 PolarHBondContact O-OG1 3.43Å; T311-V314 PolarHBondContact O-N 2.88Å; T311-G315 PolarHBondContact O-N 3.03Å
312	R	89.2	Confident	86	Confident	133 Å²	133	71.3 Å²	71.3	50%	0.502	35%	0.351	S	S	.	.	H	α-helix	trans	-63.6	-39.4	173.3	-75.6	175.1	-178.5	-172.9	2.7	113.4	P306 K307 A308 L309 G315 G316	P306-R312 HydrophobicContact CB-CG 4.16Å; P306-R312 HydrophobicContact CG-CG 4.07Å; P306-R312 PolarHBondContact O-NE 2.93Å; K307-R312 PolarHBondContact O-NE 2.93Å; A308-R312 WeakPolarHBondContact O-CB 3.33Å; A308-R312 VanDerWaalsContact O-CG 3.24Å; A308-R312 WeakPolarHBondContact O-CG 3.39Å; A308-R312 PolarHBondContact O-N 2.77Å; A308-R312 VanDerWaalsContact O-N 3.12Å; L309-R312 PolarHBondContact O-N 3.24Å; R312-G315 PolarHBondContact O-N 3Å; R312-G316 PolarHBondContact O-N 3.16Å
313	I	90.4	Very high	86.6	Confident	95 Å²	95	74.3 Å²	74.3	49%	0.487	36%	0.364	S	S	.	.	H	α-helix	trans	-64.7	-45.8	176.8	-69.1	165.4	0	0	0	110.4	L309 S310 G315 G316 I317	L309-I313 HydrophobicContact CG-CD1 4.18Å; L309-I313 WeakPolarHBondContact O-CG1 3.47Å; L309-I313 PolarHBondContact O-N 3Å; S310-I313 PolarHBondContact O-N 3.4Å; I313-G315 PolarHBondContact O-N 2.91Å; I313-G316 PolarHBondContact O-N 3.39Å; I313-I317 HydrophobicContact CG2-CD1 3.94Å; I313-I317 WeakPolarHBondContact O-CG1 3.47Å; I313-I317 PolarHBondContact O-N 3.39Å
314	V	90.4	Very high	87.4	Confident	32 Å²	32	68.7 Å²	68.7	19%	0.194	34%	0.34	C	S	.	.	H	α-helix	trans	-61.1	-46.3	176.6	175.1	0	0	0	0	111	V252 I259 S310 T311 G316 I317 W318	V252-V314 HydrophobicContact CG1-CG1 4.22Å; I259-V314 HydrophobicContact CD1-CG2 3.87Å; S310-V314 PolarHBondContact O-N 3.39Å; T311-V314 PolarHBondContact O-N 2.88Å; V314-G316 PolarHBondContact O-N 3.08Å; V314-I317 PolarHBondContact O-N 3.39Å; V314-W318 WeakPolarHBondContact O-CB 3.38Å; V314-W318 PolarHBondContact O-N 3.05Å
315	G	87.9	Confident	88.2	Confident	4 Å²	4	69.1 Å²	69.1	4%	0.041	34%	0.342	C	S	.	.	H	α-helix	trans	-61.5	-41.2	175.8	0	0	0	0	0	113.1	T311 R312 I313 W318 W319	T311-G315 PolarHBondContact O-N 3.03Å; R312-G315 PolarHBondContact O-N 3Å; I313-G315 PolarHBondContact O-N 2.91Å; G315-W318 PolarHBondContact O-N 3.25Å; G315-W319 VanDerWaalsContact O-CG 3.29Å; G315-W319 PolarHBondContact O-N 3.39Å
316	G	89.1	Confident	88.9	Confident	35 Å²	35	63.7 Å²	63.7	36%	0.361	32%	0.315	S	S	.	.	H	α-helix	trans	-66.4	-42.3	178.6	0	0	0	0	0	113.2	R312 I313 V314 W318 W319 F320	R312-G316 PolarHBondContact O-N 3.16Å; I313-G316 PolarHBondContact O-N 3.39Å; V314-G316 PolarHBondContact O-N 3.08Å; G316-W318 VanDerWaalsContact C-N 3.35Å; G316-W319 PolarHBondContact O-N 2.96Å; G316-F320 PolarHBondContact O-N 3.33Å
317	I	92.1	Very high	89.3	Confident	116 Å²	116	65.9 Å²	65.9	60%	0.595	33%	0.331	S	S	*	.	H	α-helix	trans	-65.4	-41.5	174.5	-67.2	171.2	0	0	0	110.3	I313 V314 F320 F321	I313-I317 HydrophobicContact CG2-CD1 3.94Å; I313-I317 WeakPolarHBondContact O-CG1 3.47Å; I313-I317 PolarHBondContact O-N 3.39Å; V314-I317 PolarHBondContact O-N 3.39Å; I317-F320 PolarHBondContact O-N 3.27Å; I317-F321 WeakPolarHBondContact O-CB 3.14Å; I317-F321 PolarHBondContact O-N 3.42Å
318	W	91.8	Very high	90	Very high	7 Å²	7	63.2 Å²	63.2	3%	0.027	33%	0.326	C	S	.	.	H	α-helix	trans	-60.1	-45.5	174.9	179.8	-117.2	0	0	0	111.8	A248 Y249 V252 G293 A296 V314 G315 G316 F320 F321 T322	A248-W318 HydrophobicContact CB-CZ3 4.38Å; Y249-W318 HydrophobicContact CD2-CZ2 4.33Å; V252-W318 HydrophobicContact CB-CD2 4.37Å; V252-W318 HydrophobicContact CB-CE3 4.07Å; V252-W318 HydrophobicContact CB-CZ3 4.38Å; V252-W318 HydrophobicContact CG1-CB 4.06Å; V252-W318 HydrophobicContact CG1-CD2 3.93Å; V252-W318 HydrophobicContact CG1-CE3 4.05Å; V252-W318 HydrophobicContact CG1-CG 3.94Å; V252-W318 HydrophobicContact CG2-CD2 4.39Å; V252-W318 HydrophobicContact CG2-CE3 3.67Å; V252-W318 HydrophobicContact CG2-CZ3 3.98Å; G293-W318 PolarHBondContact O-NE1 2.78Å; A296-W318 VanDerWaalsContact CB-CD1 3.5Å; V314-W318 WeakPolarHBondContact O-CB 3.38Å; V314-W318 PolarHBondContact O-N 3.05Å; G315-W318 PolarHBondContact O-N 3.25Å; G316-W318 VanDerWaalsContact C-N 3.35Å; W318-F320 VanDerWaalsContact C-N 3.35Å; W318-F320 PolarHBondContact O-N 3.26Å; W318-F321 AromaticContact CE3-CD1 3.83Å; W318-F321 HydrophobicContact CE3-CD1 3.83Å; W318-F321 HydrophobicContact CH2-CD1 4.29Å; W318-F321 HydrophobicContact CH2-CE1 4.31Å; W318-F321 AromaticContact CZ3-CD1 3.55Å; W318-F321 HydrophobicContact CZ3-CD1 3.55Å; W318-F321 AromaticContact CZ3-CE1 3.78Å; W318-F321 HydrophobicContact CZ3-CE1 3.78Å; W318-F321 WeakPolarHBondContact O-CB 3.31Å; W318-F321 PolarHBondContact O-N 3.41Å; W318-T322 HydrophobicContact CD2-CG2 3.87Å; W318-T322 VanDerWaalsContact CE2-CG2 3.49Å; W318-T322 HydrophobicContact CE3-CG2 4.37Å; W318-T322 HydrophobicContact CG-CG2 4.34Å; W318-T322 HydrophobicContact CH2-CG2 4.23Å; W318-T322 HydrophobicContact CZ2-CG2 3.69Å; W318-T322 WeakPolarHBondContact O-CG2 3.13Å; W318-T322 PolarHBondContact O-N 3.37Å; W318-T322 PolarHBondContact O-OG1 2.82Å
319	W	90.7	Very high	90.3	Very high	141 Å²	141	65.5 Å²	65.5	53%	0.534	33%	0.334	S	S	.	.	H	α-helix	trans	-60.9	-40.8	176.1	-73.5	-0.2	0	0	0	113.1	G315 G316 T322 L323	G315-W319 VanDerWaalsContact O-CG 3.29Å; G315-W319 PolarHBondContact O-N 3.39Å; G316-W319 PolarHBondContact O-N 2.96Å; W319-T322 PolarHBondContact O-OG1 2.85Å; W319-L323 VanDerWaalsContact O-CB 3.29Å; W319-L323 WeakPolarHBondContact O-CB 3.28Å; W319-L323 PolarHBondContact O-N 3.28Å
320	F	91.4	Very high	90.5	Very high	134 Å²	134	62.8 Å²	62.8	59%	0.588	32%	0.323	S	S	*	.	H	α-helix	trans	-64.2	-42.7	175.5	-178.1	-109	0	0	0	111.6	G316 I317 W318 L323 I324	G316-F320 PolarHBondContact O-N 3.33Å; I317-F320 PolarHBondContact O-N 3.27Å; W318-F320 VanDerWaalsContact C-N 3.35Å; W318-F320 PolarHBondContact O-N 3.26Å; F320-L323 PolarHBondContact O-N 3.15Å; F320-I324 HydrophobicContact CD1-CD1 3.94Å; F320-I324 HydrophobicContact CE1-CD1 3.42Å; F320-I324 VanDerWaalsContact CE1-CD1 3.42Å; F320-I324 HydrophobicContact CE2-CD1 4.12Å; F320-I324 HydrophobicContact CG-CD1 4.49Å; F320-I324 HydrophobicContact CZ-CD1 3.54Å; F320-I324 HydrophobicContact CZ-CG1 4.45Å; F320-I324 WeakPolarHBondContact O-CG1 3.37Å; F320-I324 PolarHBondContact O-N 3.03Å
321	F	92.3	Very high	90.6	Very high	75 Å²	75	63.3 Å²	63.3	33%	0.329	33%	0.33	S	S	.	.	H	α-helix	trans	-62.1	-48.6	175.7	175.6	-98.5	0	0	0	112.2	I317 W318 L323 I324 I325	I317-F321 WeakPolarHBondContact O-CB 3.14Å; I317-F321 PolarHBondContact O-N 3.42Å; W318-F321 AromaticContact CE3-CD1 3.83Å; W318-F321 HydrophobicContact CE3-CD1 3.83Å; W318-F321 HydrophobicContact CH2-CD1 4.29Å; W318-F321 HydrophobicContact CH2-CE1 4.31Å; W318-F321 AromaticContact CZ3-CD1 3.55Å; W318-F321 HydrophobicContact CZ3-CD1 3.55Å; W318-F321 AromaticContact CZ3-CE1 3.78Å; W318-F321 HydrophobicContact CZ3-CE1 3.78Å; W318-F321 WeakPolarHBondContact O-CB 3.31Å; W318-F321 PolarHBondContact O-N 3.41Å; F321-L323 VanDerWaalsContact C-N 3.33Å; F321-L323 PolarHBondContact O-N 2.94Å; F321-I324 PolarHBondContact O-N 2.94Å; F321-I325 HydrophobicContact CD1-CG1 4.42Å; F321-I325 HydrophobicContact CD2-CG1 4.49Å; F321-I325 HydrophobicContact CE1-CG1 3.99Å; F321-I325 HydrophobicContact CE2-CD1 4.29Å; F321-I325 HydrophobicContact CE2-CG1 4.07Å; F321-I325 HydrophobicContact CZ-CD1 4.15Å; F321-I325 HydrophobicContact CZ-CG1 3.8Å; F321-I325 WeakPolarHBondContact O-CG1 3.45Å; F321-I325 PolarHBondContact O-N 3.44Å; F321-I325 VanDerWaalsContact O-N 3.11Å
322	T	91.1	Very high	90.7	Very high	5 Å²	5	66.7 Å²	66.7	3%	0.031	35%	0.348	C	S	.	.	H	α-helix	trans	-64.9	-37.3	-179.9	62.1	0	0	0	0	112	A296 L297 W318 W319 I325 I326	A296-T322 PolarHBondContact O-OG1 3Å; L297-T322 HydrophobicContact CD1-CG2 3.82Å; W318-T322 HydrophobicContact CD2-CG2 3.87Å; W318-T322 VanDerWaalsContact CE2-CG2 3.49Å; W318-T322 HydrophobicContact CE3-CG2 4.37Å; W318-T322 HydrophobicContact CG-CG2 4.34Å; W318-T322 HydrophobicContact CH2-CG2 4.23Å; W318-T322 HydrophobicContact CZ2-CG2 3.69Å; W318-T322 WeakPolarHBondContact O-CG2 3.13Å; W318-T322 PolarHBondContact O-N 3.37Å; W318-T322 PolarHBondContact O-OG1 2.82Å; W319-T322 PolarHBondContact O-OG1 2.85Å; T322-I325 PolarHBondContact O-N 3.27Å; T322-I326 WeakPolarHBondContact O-CD1 3.13Å; T322-I326 VanDerWaalsContact O-CG1 3.22Å; T322-I326 WeakPolarHBondContact O-CG1 3.44Å; T322-I326 PolarHBondContact O-N 2.88Å
323	L	91.1	Very high	90.4	Very high	97 Å²	97	62.4 Å²	62.4	51%	0.508	34%	0.335	S	S	.	.	H	α-helix	trans	-57.5	-50.8	174.5	-172.6	162.5	0	0	0	111.1	W319 F320 F321 I325 I326 S327	W319-L323 VanDerWaalsContact O-CB 3.29Å; W319-L323 WeakPolarHBondContact O-CB 3.28Å; W319-L323 PolarHBondContact O-N 3.28Å; F320-L323 PolarHBondContact O-N 3.15Å; F321-L323 VanDerWaalsContact C-N 3.33Å; F321-L323 PolarHBondContact O-N 2.94Å; L323-I325 PolarHBondContact O-N 3.39Å; L323-I326 PolarHBondContact O-N 3.49Å; L323-S327 WeakPolarHBondContact O-CB 3.2Å; L323-S327 PolarHBondContact O-N 2.87Å; L323-S327 PolarHBondContact O-OG 2.99Å; L323-S327 VanDerWaalsContact O-OG 3.13Å
324	I	92.9	Very high	89.9	Confident	83 Å²	83	60.5 Å²	60.5	43%	0.426	33%	0.334	S	S	.	.	H	α-helix	trans	-60.1	-46.3	179.8	-68.8	171.2	0	0	0	111.2	F320 F321 I326 S327 S328	F320-I324 HydrophobicContact CD1-CD1 3.94Å; F320-I324 HydrophobicContact CE1-CD1 3.42Å; F320-I324 VanDerWaalsContact CE1-CD1 3.42Å; F320-I324 HydrophobicContact CE2-CD1 4.12Å; F320-I324 HydrophobicContact CG-CD1 4.49Å; F320-I324 HydrophobicContact CZ-CD1 3.54Å; F320-I324 HydrophobicContact CZ-CG1 4.45Å; F320-I324 WeakPolarHBondContact O-CG1 3.37Å; F320-I324 PolarHBondContact O-N 3.03Å; F321-I324 PolarHBondContact O-N 2.94Å; I324-I326 PolarHBondContact O-N 2.76Å; I324-S327 PolarHBondContact O-N 3.08Å; I324-S328 WeakPolarHBondContact O-CB 3.46Å; I324-S328 PolarHBondContact O-N 3.1Å
325	I	91.8	Very high	89.5	Confident	39 Å²	39	61.5 Å²	61.5	20%	0.2	35%	0.345	C	S	.	.	H	α-helix	trans	-62.7	-45.5	-178.1	-68.7	-64.6	0	0	0	111.2	I245 F321 T322 L323 S328 Y329	I245-I325 HydrophobicContact CD1-CG2 3.79Å; I245-I325 HydrophobicContact CG1-CG2 4.45Å; F321-I325 HydrophobicContact CD1-CG1 4.42Å; F321-I325 HydrophobicContact CD2-CG1 4.49Å; F321-I325 HydrophobicContact CE1-CG1 3.99Å; F321-I325 HydrophobicContact CE2-CD1 4.29Å; F321-I325 HydrophobicContact CE2-CG1 4.07Å; F321-I325 HydrophobicContact CZ-CD1 4.15Å; F321-I325 HydrophobicContact CZ-CG1 3.8Å; F321-I325 WeakPolarHBondContact O-CG1 3.45Å; F321-I325 PolarHBondContact O-N 3.44Å; F321-I325 VanDerWaalsContact O-N 3.11Å; T322-I325 PolarHBondContact O-N 3.27Å; L323-I325 PolarHBondContact O-N 3.39Å; I325-S328 PolarHBondContact O-N 2.83Å; I325-Y329 WeakPolarHBondContact O-CB 3.38Å; I325-Y329 PolarHBondContact O-N 3Å
326	I	90.8	Very high	88.9	Confident	35 Å²	35	65.6 Å²	65.6	18%	0.179	36%	0.362	C	S	.	.	H	α-helix	trans	-68.2	-42.6	-178.8	-62.4	160.8	0	0	0	110.5	L297 Q299 T322 L323 I324 S328 Y329 T330	L297-I326 WeakPolarHBondContact O-CD1 3.22Å; Q299-I326 HydrophobicContact CG-CD1 3.68Å; Q299-I326 VanDerWaalsContact NE2-CD1 3.32Å; Q299-I326 VanDerWaalsContact NE2-CG2 3.3Å; T322-I326 WeakPolarHBondContact O-CD1 3.13Å; T322-I326 VanDerWaalsContact O-CG1 3.22Å; T322-I326 WeakPolarHBondContact O-CG1 3.44Å; T322-I326 PolarHBondContact O-N 2.88Å; L323-I326 PolarHBondContact O-N 3.49Å; I324-I326 PolarHBondContact O-N 2.76Å; I326-S328 VanDerWaalsContact C-N 3.31Å; I326-S328 PolarHBondContact O-N 3.19Å; I326-Y329 PolarHBondContact O-N 2.83Å; I326-T330 HydrophobicContact CG2-CG2 4.4Å; I326-T330 WeakPolarHBondContact O-CG2 3.49Å; I326-T330 PolarHBondContact O-N 3.26Å; I326-T330 PolarHBondContact O-OG1 3.34Å
327	S	90.8	Very high	88.2	Confident	60 Å²	60	66.9 Å²	66.9	42%	0.42	36%	0.36	S	S	.	.	H	α-helix	trans	-61.4	-38.2	174.8	-66	0	0	0	0	112.6	L323 I324 T330 A331	L323-S327 WeakPolarHBondContact O-CB 3.2Å; L323-S327 PolarHBondContact O-N 2.87Å; L323-S327 PolarHBondContact O-OG 2.99Å; L323-S327 VanDerWaalsContact O-OG 3.13Å; I324-S327 PolarHBondContact O-N 3.08Å; S327-T330 PolarHBondContact O-OG1 2.67Å; S327-A331 WeakPolarHBondContact O-CB 3.46Å; S327-A331 PolarHBondContact O-N 3.02Å; S327-A331 VanDerWaalsContact O-N 3.1Å
328	S	91.9	Very high	87.2	Confident	52 Å²	52	66.3 Å²	66.3	36%	0.364	36%	0.362	S	S	.	.	H	α-helix	trans	-69.4	-38.5	175	-173.6	0	0	0	0	112	I324 I325 I326 A331 N332	I324-S328 WeakPolarHBondContact O-CB 3.46Å; I324-S328 PolarHBondContact O-N 3.1Å; I325-S328 PolarHBondContact O-N 2.83Å; I326-S328 VanDerWaalsContact C-N 3.31Å; I326-S328 PolarHBondContact O-N 3.19Å; S328-A331 PolarHBondContact O-N 3.37Å; S328-N332 WeakPolarHBondContact O-CB 3.33Å; S328-N332 PolarHBondContact O-N 2.86Å
329	Y	91.5	Very high	85.9	Confident	51 Å²	51	69.4 Å²	69.4	20%	0.2	38%	0.382	C	S	.	.	H	α-helix	trans	-63.8	-46.2	176.4	171.3	-97.1	0	0	0	111.1	F233 P236 L237 W242 I325 I326 A331 N332 L333	F233-Y329 WeakPolarHBondContact O-CE2 3.47Å; F233-Y329 PolarHBondContact O-OH 2.83Å; P236-Y329 HydrophobicContact CB-CD2 4.2Å; P236-Y329 HydrophobicContact CB-CE2 4.17Å; P236-Y329 HydrophobicContact CG-CE2 4.08Å; L237-Y329 HydrophobicContact CD1-CD2 4.02Å; L237-Y329 HydrophobicContact CG-CD2 4.24Å; W242-Y329 HydrophobicContact CZ2-CE2 4.33Å; I325-Y329 WeakPolarHBondContact O-CB 3.38Å; I325-Y329 PolarHBondContact O-N 3Å; I326-Y329 PolarHBondContact O-N 2.83Å; Y329-A331 VanDerWaalsContact C-N 3.34Å; Y329-A331 PolarHBondContact O-N 3.2Å; Y329-N332 PolarHBondContact O-N 3.43Å; Y329-L333 HydrophobicContact CE1-CD2 4Å; Y329-L333 WeakPolarHBondContact O-CB 3.35Å; Y329-L333 PolarHBondContact O-N 3.08Å
330	T	90	Very high	84.4	Confident	77 Å²	77	69.4 Å²	69.4	47%	0.472	39%	0.388	S	S	.	.	H	α-helix	trans	-64.9	-38.1	178.7	55.7	0	0	0	0	112	I326 S327 A334	I326-T330 HydrophobicContact CG2-CG2 4.4Å; I326-T330 WeakPolarHBondContact O-CG2 3.49Å; I326-T330 PolarHBondContact O-N 3.26Å; I326-T330 PolarHBondContact O-OG1 3.34Å; S327-T330 PolarHBondContact O-OG1 2.67Å; T330-A334 WeakPolarHBondContact O-CB 3.46Å; T330-A334 PolarHBondContact O-N 3.14Å
331	A	89.5	Confident	82.8	Confident	57 Å²	57	72.4 Å²	72.4	47%	0.471	40%	0.395	S	S	.	.	H	α-helix	trans	-64	-48.6	174.6	0	0	0	0	0	112.4	S327 S328 Y329 A334 A335	S327-A331 WeakPolarHBondContact O-CB 3.46Å; S327-A331 PolarHBondContact O-N 3.02Å; S327-A331 VanDerWaalsContact O-N 3.1Å; S328-A331 PolarHBondContact O-N 3.37Å; Y329-A331 VanDerWaalsContact C-N 3.34Å; Y329-A331 PolarHBondContact O-N 3.2Å; A331-A334 PolarHBondContact O-N 3.28Å; A331-A335 PolarHBondContact O-N 3.38Å
332	N	87.5	Confident	81.2	Confident	72 Å²	72	74.2 Å²	74.2	39%	0.385	41%	0.406	S	S	.	.	H	α-helix	trans	-68.3	-36.9	179.4	-75.5	-5	0	0	0	112.3	P236 S328 Y329 A335 F336	P236-N332 HydrophobicContact CB-CB 4.02Å; P236-N332 PolarHBondContact O-ND2 2.71Å; S328-N332 WeakPolarHBondContact O-CB 3.33Å; S328-N332 PolarHBondContact O-N 2.86Å; Y329-N332 PolarHBondContact O-N 3.43Å; N332-A335 PolarHBondContact O-N 2.72Å; N332-F336 VanDerWaalsContact O-CB 3.28Å; N332-F336 WeakPolarHBondContact O-CB 3.46Å; N332-F336 PolarHBondContact O-N 3.46Å
333	L	83.9	Confident	79.8	Confident	44 Å²	44	81.3 Å²	81.3	23%	0.23	44%	0.439	C	S	.	.	H	α-helix	trans	-62.3	-44.6	174.9	178.8	65.2	0	0	0	110.8	P236 Y329 A335 F336 L337	P236-L333 HydrophobicContact CB-CB 4.41Å; P236-L333 HydrophobicContact CG-CB 4.01Å; P236-L333 HydrophobicContact CG-CD1 3.72Å; P236-L333 HydrophobicContact CG-CG 4.47Å; Y329-L333 HydrophobicContact CE1-CD2 4Å; Y329-L333 WeakPolarHBondContact O-CB 3.35Å; Y329-L333 PolarHBondContact O-N 3.08Å; L333-A335 VanDerWaalsContact C-N 3.34Å; L333-A335 PolarHBondContact O-N 3.25Å; L333-F336 PolarHBondContact O-N 2.99Å; L333-L337 HydrophobicContact CD1-CD1 4.16Å; L333-L337 HydrophobicContact CD1-CG 4.3Å; L333-L337 HydrophobicContact CG-CD1 4Å; L333-L337 WeakPolarHBondContact O-CB 3.29Å; L333-L337 VanDerWaalsContact O-CG 3.25Å; L333-L337 WeakPolarHBondContact O-CG 3.35Å; L333-L337 PolarHBondContact O-N 2.81Å
334	A	80.1	Confident	78.9	Confident	55 Å²	55	78.2 Å²	78.2	46%	0.455	43%	0.426	S	S	.	.	H	α-helix	trans	-61.2	-42.4	175.9	0	0	0	0	0	111.9	T330 A331 L337 T338	T330-A334 WeakPolarHBondContact O-CB 3.46Å; T330-A334 PolarHBondContact O-N 3.14Å; A331-A334 PolarHBondContact O-N 3.28Å; A334-L337 PolarHBondContact O-N 2.95Å; A334-T338 WeakPolarHBondContact O-CG2 3.46Å; A334-T338 PolarHBondContact O-N 3.28Å; A334-T338 PolarHBondContact O-OG1 3.25Å
335	A	80.8	Confident	78.2	Confident	53 Å²	53	78.4 Å²	78.4	44%	0.438	43%	0.432	S	S	.	.	H	α-helix	trans	-67.6	-34.9	175.7	0	0	0	0	0	113.1	A331 N332 L333 T338 V339	A331-A335 PolarHBondContact O-N 3.38Å; N332-A335 PolarHBondContact O-N 2.72Å; L333-A335 VanDerWaalsContact C-N 3.34Å; L333-A335 PolarHBondContact O-N 3.25Å; A335-T338 PolarHBondContact O-OG1 2.78Å; A335-V339 PolarHBondContact O-N 3.16Å
336	F	76.3	Confident	78	Confident	90 Å²	90	76.7 Å²	76.7	40%	0.395	42%	0.423	S	S	.	.	H	α-helix	trans	-68.6	-39.7	177.5	-173.3	-95.7	0	0	0	111.5	N235 N332 L333 T338 V339	N235-F336 HydrophobicContact CB-CE2 4.39Å; N235-F336 HydrophobicContact CB-CZ 4.19Å; N332-F336 VanDerWaalsContact O-CB 3.28Å; N332-F336 WeakPolarHBondContact O-CB 3.46Å; N332-F336 PolarHBondContact O-N 3.46Å; L333-F336 PolarHBondContact O-N 2.99Å; F336-T338 VanDerWaalsContact C-N 3.3Å; F336-T338 PolarHBondContact O-N 2.81Å; F336-V339 PolarHBondContact O-N 3.39Å
337	L	74.3	Confident	77.8	Confident	62 Å²	62	80.4 Å²	80.4	33%	0.325	44%	0.443	S	S	.	.	H	α-helix	trans	-70.1	-23.9	178.7	-70.7	167.1	0	0	0	113.5	L333 A334 L493 N497	L333-L337 HydrophobicContact CD1-CD1 4.16Å; L333-L337 HydrophobicContact CD1-CG 4.3Å; L333-L337 HydrophobicContact CG-CD1 4Å; L333-L337 WeakPolarHBondContact O-CB 3.29Å; L333-L337 VanDerWaalsContact O-CG 3.25Å; L333-L337 WeakPolarHBondContact O-CG 3.35Å; L333-L337 PolarHBondContact O-N 2.81Å; A334-L337 PolarHBondContact O-N 2.95Å; L337-L493 HydrophobicContact CD1-CD2 3.78Å; L337-L493 HydrophobicContact CD2-CD2 4.21Å; L337-N497 HydrophobicContact CD2-CB 4.36Å
338	T	69.9	Low	77.8	Confident	103 Å²	103	79.2 Å²	79.2	63%	0.632	44%	0.435	S	S	*	.	H	α-helix	trans	-86.4	-19.3	177.3	54.6	0	0	0	0	113.1	A334 A335 F336	A334-T338 WeakPolarHBondContact O-CG2 3.46Å; A334-T338 PolarHBondContact O-N 3.28Å; A334-T338 PolarHBondContact O-OG1 3.25Å; A335-T338 PolarHBondContact O-OG1 2.78Å; F336-T338 VanDerWaalsContact C-N 3.3Å; F336-T338 PolarHBondContact O-N 2.81Å
339	V	65.3	Low	77.7	Confident	73 Å²	73	77.3 Å²	77.3	44%	0.442	42%	0.422	S	S	.	.			trans	-116	86.3	-178.1	-169.2	0	0	0	0	110.1	A335 F336 R341	A335-V339 PolarHBondContact O-N 3.16Å; F336-V339 PolarHBondContact O-N 3.39Å; V339-R341 VanDerWaalsContact C-N 3.35Å; V339-R341 HydrophobicContact CG1-CG 3.56Å; V339-R341 PolarHBondContact O-N 3.38Å
340	E	59.7	Low	77.7	Confident	141 Å²	141	78.1 Å²	78.1	66%	0.659	43%	0.43	S	S	*	.			trans	-67.6	98.5	157.4	-69.6	-171.4	173.8	0	0	108.2	M342	E340-M342 PolarHBondContact O-N 2.71Å
341	R	57.3	Low	77.8	Confident	197 Å²	197	77 Å²	77	74%	0.743	42%	0.422	S	S	*	.			trans	-77.6	110.3	170.8	-68.1	-169.2	176.5	171.6	-1.1	107.9	V339 E343	V339-R341 VanDerWaalsContact C-N 3.35Å; V339-R341 HydrophobicContact CG1-CG 3.56Å; V339-R341 PolarHBondContact O-N 3.38Å; R341-E343 VanDerWaalsContact C-N 3.34Å; R341-E343 PolarHBondContact O-N 2.89Å; R341-E343 VanDerWaalsContact O-N 3.09Å
342	M	58.1	Low	77.9	Confident	113 Å²	113	74.3 Å²	74.3	56%	0.557	40%	0.399	S	S	*	.			trans	-70	98.4	157.9	-65.5	-172	-172.1	0	0	106.6	E340 S344	E340-M342 PolarHBondContact O-N 2.71Å; M342-S344 PolarHBondContact O-N 3.17Å
343	E	62.8	Low	78.2	Confident	154 Å²	154	72.2 Å²	72.2	72%	0.72	39%	0.392	S	S	*	.			trans	-73.6	111.6	171.3	-74.8	-170.5	166.1	0	0	108.7	R341	R341-E343 VanDerWaalsContact C-N 3.34Å; R341-E343 PolarHBondContact O-N 2.89Å; R341-E343 VanDerWaalsContact O-N 3.09Å
344	S	70.9	Confident	78.5	Confident	32 Å²	32	78 Å²	78	22%	0.224	42%	0.415	C	S	.	.			trans	-80	135.3	169.4	-175	0	0	0	0	109.2	M342 I346	M342-S344 PolarHBondContact O-N 3.17Å; S344-I346 WeakPolarHBondContact CB-O 3.4Å; S344-I346 PolarHBondContact O-N 3.44Å; S344-I346 PolarHBondContact OG-N 3.2Å; S344-I346 PolarHBondContact OG-O 2.76Å
345	P	78.8	Confident	79.1	Confident	86 Å²	86	77.5 Å²	77.5	56%	0.558	40%	0.403	S	S	*	.	S	Bend	trans	-69.1	-15.5	175.6	28.7	-34.5	0	0	0	113.1	F220 I358	F220-P345 HydrophobicContact CE1-CG 3.97Å; P345-I358 HydrophobicContact CB-CD1 4.35Å; P345-I358 HydrophobicContact CG-CD1 4.35Å
346	I	86.7	Confident	79.5	Confident	3 Å²	3	79.8 Å²	79.8	2%	0.015	41%	0.412	C	S	.	.			trans	-139.7	134.3	-179.9	50.2	167.6	0	0	0	109.9	I218 F220 S344 L352 I358 A412 I433	I218-I346 HydrophobicContact CG2-CD1 4.48Å; F220-I346 HydrophobicContact CB-CD1 4.35Å; F220-I346 HydrophobicContact CD1-CD1 4.24Å; F220-I346 HydrophobicContact CD1-CG1 4.41Å; F220-I346 HydrophobicContact CD2-CD1 4.22Å; F220-I346 HydrophobicContact CG-CD1 4.01Å; S344-I346 WeakPolarHBondContact CB-O 3.4Å; S344-I346 PolarHBondContact O-N 3.44Å; S344-I346 PolarHBondContact OG-N 3.2Å; S344-I346 PolarHBondContact OG-O 2.76Å; I346-L352 HydrophobicContact CD1-CD2 3.97Å; I346-L352 HydrophobicContact CD1-CG 4.34Å; I346-L352 HydrophobicContact CG2-CD2 3.94Å; I346-L352 HydrophobicContact CG2-CG 4.31Å; I346-I358 HydrophobicContact CG2-CD1 3.78Å; I346-A412 HydrophobicContact CD1-CB 4.3Å; I346-I433 HydrophobicContact CB-CG2 4.48Å; I346-I433 HydrophobicContact CD1-CG1 4.39Å; I346-I433 HydrophobicContact CD1-CG2 4.3Å; I346-I433 HydrophobicContact CG1-CG1 4.4Å; I346-I433 HydrophobicContact CG1-CG2 4.09Å; I346-I433 WeakPolarHBondContact O-CG2 3.22Å
347	D	87.3	Confident	80.2	Confident	113 Å²	113	83.9 Å²	83.9	60%	0.604	43%	0.43	S	S	*	.	S	Bend	trans	-116.1	-25.6	174.7	-72.7	-26.7	0	0	0	112	G434	D347-G434 WeakPolarHBondContact O-CA 2.96Å; D347-G434 PolarHBondContact O-N 3.41Å
348	S	90.6	Very high	81	Confident	36 Å²	36	81.6 Å²	81.6	25%	0.252	42%	0.418	S	S	.	.	S	Bend	trans	-138.9	162.6	-174.5	72.7	0	0	0	0	113.8	D350 D351 L352	S348-D350 PolarHBondContact O-N 3.3Å; S348-D350 PolarHBondContact OG-N 3.12Å; S348-D351 PolarHBondContact N-OD2 3.45Å; S348-D351 VanDerWaalsContact N-OD2 3.15Å; S348-D351 PolarHBondContact O-N 3.29Å; S348-D351 PolarHBondContact OG-N 3.09Å; S348-D351 PolarHBondContact OG-OD2 3.36Å; S348-L352 PolarHBondContact O-N 3.39Å
349	A	90.8	Very high	82.2	Confident	11 Å²	11	79.2 Å²	79.2	9%	0.091	40%	0.399	C	S	.	.	H	α-helix	trans	-63	-28.3	171	0	0	0	0	0	112.6	I218 D351 L352 A353 Y380 M383 I437	I218-A349 HydrophobicContact CD1-CB 4.16Å; A349-D351 VanDerWaalsContact C-N 3.32Å; A349-L352 PolarHBondContact O-N 2.86Å; A349-A353 PolarHBondContact O-N 3.37Å; A349-A353 VanDerWaalsContact O-N 3.1Å; A349-Y380 HydrophobicContact CB-CE1 4.11Å; A349-M383 HydrophobicContact CB-SD 4.26Å; A349-I437 HydrophobicContact CB-CD1 3.97Å; A349-I437 HydrophobicContact CB-CG1 4.27Å
350	D	91.6	Very high	83.6	Confident	69 Å²	69	76 Å²	76	37%	0.369	38%	0.379	S	S	.	.	H	α-helix	trans	-66.1	-35.7	175.6	-73.5	-47.8	0	0	0	111.6	S348 A353 K354 T379	S348-D350 PolarHBondContact O-N 3.3Å; S348-D350 PolarHBondContact OG-N 3.12Å; D350-A353 PolarHBondContact O-N 3.17Å; D350-K354 VanDerWaalsContact O-CG 3.32Å; D350-K354 WeakPolarHBondContact O-CG 3.42Å; D350-K354 PolarHBondContact O-N 2.69Å; D350-K354 VanDerWaalsContact O-N 3.13Å; D350-T379 WeakPolarHBondContact OD1-CB 3.3Å; D350-T379 WeakPolarHBondContact OD1-CG2 3.45Å; D350-T379 PolarHBondContact OD1-OG1 3.39Å
351	D	91.9	Very high	85.3	Confident	54 Å²	54	69.2 Å²	69.2	29%	0.289	35%	0.348	S	S	.	.	H	α-helix	trans	-67.6	-41	177.9	-57.7	-40.2	0	0	0	110.7	S348 A349 A353 K354 Q355	S348-D351 PolarHBondContact N-OD2 3.45Å; S348-D351 VanDerWaalsContact N-OD2 3.15Å; S348-D351 PolarHBondContact O-N 3.29Å; S348-D351 PolarHBondContact OG-N 3.09Å; S348-D351 PolarHBondContact OG-OD2 3.36Å; A349-D351 VanDerWaalsContact C-N 3.32Å; D351-A353 VanDerWaalsContact C-N 3.3Å; D351-A353 PolarHBondContact O-N 3.33Å; D351-K354 PolarHBondContact O-N 2.94Å; D351-K354 IonicContact OD1-NZ 3.75Å; D351-Q355 WeakPolarHBondContact O-CG 3.35Å; D351-Q355 PolarHBondContact O-N 2.95Å
352	L	91.7	Very high	87	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.6	-41.3	172.3	-75.6	175	0	0	0	112	I218 I346 S348 A349 K354 Q355 I358 Y360 M383 A412	I218-L352 HydrophobicContact CD1-CD1 3.7Å; I218-L352 HydrophobicContact CG1-CD1 4.24Å; I218-L352 HydrophobicContact CG2-CD1 4.15Å; I346-L352 HydrophobicContact CD1-CD2 3.97Å; I346-L352 HydrophobicContact CD1-CG 4.34Å; I346-L352 HydrophobicContact CG2-CD2 3.94Å; I346-L352 HydrophobicContact CG2-CG 4.31Å; S348-L352 PolarHBondContact O-N 3.39Å; A349-L352 PolarHBondContact O-N 2.86Å; L352-K354 VanDerWaalsContact C-N 3.33Å; L352-K354 PolarHBondContact O-N 3.08Å; L352-Q355 PolarHBondContact O-N 2.82Å; L352-Q355 PolarHBondContact O-NE2 3.42Å; L352-I358 HydrophobicContact CD2-CB 4.39Å; L352-I358 HydrophobicContact CD2-CG2 4.1Å; L352-Y360 HydrophobicContact CB-CD1 4.1Å; L352-Y360 HydrophobicContact CB-CE1 4.17Å; L352-Y360 HydrophobicContact CD2-CD1 4.07Å; L352-Y360 WeakPolarHBondContact O-CE1 3.44Å; L352-M383 HydrophobicContact CB-CE 4.46Å; L352-A412 HydrophobicContact CD1-CB 4.16Å; L352-A412 HydrophobicContact CD2-CB 4.12Å
353	A	92.4	Very high	88.6	Confident	28 Å²	28	56 Å²	56	23%	0.231	30%	0.295	C	S	.	.	H	α-helix	trans	-71	-24	-179.8	0	0	0	0	0	113.9	A349 D350 D351 T379 M383	A349-A353 PolarHBondContact O-N 3.37Å; A349-A353 VanDerWaalsContact O-N 3.1Å; D350-A353 PolarHBondContact O-N 3.17Å; D351-A353 VanDerWaalsContact C-N 3.3Å; D351-A353 PolarHBondContact O-N 3.33Å; A353-T379 HydrophobicContact CB-CG2 3.69Å; A353-M383 HydrophobicContact CB-CG 3.75Å; A353-M383 HydrophobicContact CB-SD 4.4Å
354	K	92	Very high	89.6	Confident	166 Å²	166	51.6 Å²	51.6	72%	0.722	27%	0.274	S	S	*	.	H	α-helix	trans	-83.3	-20.3	178.9	-71.9	167.3	-167.9	161	0	113.3	D350 D351 L352	D350-K354 VanDerWaalsContact O-CG 3.32Å; D350-K354 WeakPolarHBondContact O-CG 3.42Å; D350-K354 PolarHBondContact O-N 2.69Å; D350-K354 VanDerWaalsContact O-N 3.13Å; D351-K354 PolarHBondContact O-N 2.94Å; D351-K354 IonicContact OD1-NZ 3.75Å; L352-K354 VanDerWaalsContact C-N 3.33Å; L352-K354 PolarHBondContact O-N 3.08Å
355	Q	91	Very high	89.9	Confident	44 Å²	44	55.1 Å²	55.1	21%	0.206	29%	0.291	C	S	.	.			trans	-116.5	161.3	-173.2	68.9	79.1	44.6	0	0	111.6	D351 L352 I358	D351-Q355 WeakPolarHBondContact O-CG 3.35Å; D351-Q355 PolarHBondContact O-N 2.95Å; L352-Q355 PolarHBondContact O-N 2.82Å; L352-Q355 PolarHBondContact O-NE2 3.42Å; Q355-I358 PolarHBondContact NE2-O 3.12Å
356	T	89.6	Confident	89.9	Confident	100 Å²	100	52.1 Å²	52.1	61%	0.613	28%	0.275	S	S	*	.	S	Bend	trans	-129.5	8.7	179.1	64.2	0	0	0	0	113.6
357	K	90.8	Very high	89.7	Confident	177 Å²	177	53.2 Å²	53.2	77%	0.77	29%	0.285	S	S	*	.	S	Bend	trans	-80.2	-45.5	-177.6	-177.6	-177.2	176.2	-172.8	0	111.4
358	I	92.5	Very high	89.7	Confident	14 Å²	14	48.5 Å²	48.5	7%	0.072	26%	0.26	C	S	.	.	S	Bend	trans	-89	119.1	175.2	-59.3	169.8	0	0	0	107.1	F220 P345 I346 L352 Q355 A412	F220-I358 HydrophobicContact CE2-CG2 3.91Å; F220-I358 HydrophobicContact CZ-CD1 4.33Å; F220-I358 HydrophobicContact CZ-CG2 4.45Å; P345-I358 HydrophobicContact CB-CD1 4.35Å; P345-I358 HydrophobicContact CG-CD1 4.35Å; I346-I358 HydrophobicContact CG2-CD1 3.78Å; L352-I358 HydrophobicContact CD2-CB 4.39Å; L352-I358 HydrophobicContact CD2-CG2 4.1Å; Q355-I358 PolarHBondContact NE2-O 3.12Å; I358-A412 HydrophobicContact CG2-CB 4.12Å
359	E	94	Very high	89.6	Confident	53 Å²	53	47.4 Å²	47.4	25%	0.248	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	149.7	173.9	-66.6	-170.6	156.6	0	0	110	R390 V394 R405 D410 Y411 A412	E359-R390 IonicContact OE1-NH1 3.2Å; E359-V394 HydrophobicContact CB-CG1 4.45Å; E359-R405 IonicContact OE2-NH2 2.94Å; E359-R405 PolarHBondContact OE2-NH2 3.37Å; E359-D410 PolarHBondContact N-O 3.2Å; E359-Y411 HydrophobicContact CB-CD2 3.88Å; E359-Y411 CarbonylContact O-C 3.53Å; E359-Y411 VanDerWaalsContact O-CA 3.28Å; E359-Y411 WeakPolarHBondContact O-CA 3.46Å; E359-Y411 WeakPolarHBondContact O-CD2 3.3Å; E359-A412 PolarHBondContact O-N 3.22Å
360	Y	94.9	Very high	89.4	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.016	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	149.8	176.4	57	-96.3	0	0	0	111.7	L352 M383 F386 M387 V394 A412 L414	L352-Y360 HydrophobicContact CB-CD1 4.1Å; L352-Y360 HydrophobicContact CB-CE1 4.17Å; L352-Y360 HydrophobicContact CD2-CD1 4.07Å; L352-Y360 WeakPolarHBondContact O-CE1 3.44Å; Y360-M383 HydrophobicContact CD2-CE 3.92Å; Y360-M383 HydrophobicContact CE2-CB 3.87Å; Y360-M383 HydrophobicContact CE2-CE 3.79Å; Y360-M383 HydrophobicContact CE2-CG 4.05Å; Y360-F386 HydrophobicContact CD1-CD1 4.45Å; Y360-F386 HydrophobicContact CD1-CE1 4.2Å; Y360-F386 HydrophobicContact CD2-CD1 4.25Å; Y360-F386 AromaticContact CE1-CD1 3.88Å; Y360-F386 HydrophobicContact CE1-CD1 3.88Å; Y360-F386 AromaticContact CE1-CE1 3.93Å; Y360-F386 HydrophobicContact CE1-CE1 3.93Å; Y360-F386 HydrophobicContact CE1-CG 4.45Å; Y360-F386 AromaticContact CE2-CD1 3.62Å; Y360-F386 HydrophobicContact CE2-CD1 3.62Å; Y360-F386 HydrophobicContact CE2-CE1 4.24Å; Y360-F386 HydrophobicContact CE2-CG 4.36Å; Y360-F386 HydrophobicContact CG-CE1 4.48Å; Y360-F386 AromaticContact CZ-CD1 3.41Å; Y360-F386 VanDerWaalsContact CZ-CD1 3.41Å; Y360-F386 AromaticContact CZ-CE1 3.95Å; Y360-F386 AromaticContact CZ-CG 3.88Å; Y360-F386 WeakPolarHBondContact OH-CB 3.47Å; Y360-F386 WeakPolarHBondContact OH-CG 3.47Å; Y360-M387 HydrophobicContact CD2-CG 4.07Å; Y360-M387 HydrophobicContact CD2-SD 4.3Å; Y360-M387 HydrophobicContact CE2-CG 4.01Å; Y360-V394 WeakPolarHBondContact O-CB 3.34Å; Y360-A412 WeakPolarHBondContact CA-O 3.43Å; Y360-A412 VanDerWaalsContact CB-O 3.31Å; Y360-A412 WeakPolarHBondContact CB-O 3.38Å; Y360-L414 HydrophobicContact CD2-CD1 4.11Å; Y360-L414 HydrophobicContact CG-CD1 4.42Å
361	G	95.1	Very high	89.3	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	-177	-174.6	0	0	0	0	0	114.2	Y411 A412 F413 L414	G361-Y411 WeakPolarHBondContact CA-OH 3.38Å; G361-Y411 PolarHBondContact N-OH 2.86Å; G361-Y411 PolarHBondContact O-OH 3.43Å; G361-A412 PolarHBondContact N-O 2.91Å; G361-F413 WeakPolarHBondContact O-CD2 3.25Å; G361-L414 WeakPolarHBondContact O-CD1 3.31Å; G361-L414 PolarHBondContact O-N 3.25Å
362	V	94.2	Very high	89.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.241	C	C	.	.			trans	-137.2	167.9	-171.7	-66.8	0	0	0	0	110.1	T368 M369 F372 M387 M395 V396 L414	V362-T368 HydrophobicContact CB-CG2 4.4Å; V362-T368 HydrophobicContact CG1-CG2 3.62Å; V362-M369 HydrophobicContact CG2-CB 3.81Å; V362-M369 HydrophobicContact CG2-CG 4.07Å; V362-F372 HydrophobicContact CG1-CD2 4.19Å; V362-F372 HydrophobicContact CG1-CE2 4.28Å; V362-M387 HydrophobicContact CG1-SD 4.13Å; V362-M387 HydrophobicContact CG2-SD 4.26Å; V362-M395 WeakPolarHBondContact O-CA 2.99Å; V362-V396 PolarHBondContact O-N 3.41Å; V362-V396 VanDerWaalsContact O-N 3.13Å; V362-L414 HydrophobicContact CG1-CB 3.8Å
363	V	90.8	Very high	89.2	Confident	32 Å²	32	50.5 Å²	50.5	19%	0.194	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-69.3	134.2	170.6	-173.6	0	0	0	0	110.3	G366 V396 K397 I399 F413	V363-G366 PolarHBondContact O-N 3.45Å; V363-V396 CarbonylContact C-O 3.53Å; V363-V396 VanDerWaalsContact CA-O 3.32Å; V363-V396 WeakPolarHBondContact CA-O 3.29Å; V363-V396 HydrophobicContact CG2-CG2 4.18Å; V363-K397 VanDerWaalsContact CG1-O 3.26Å; V363-K397 WeakPolarHBondContact CG1-O 3.05Å; V363-I399 HydrophobicContact CG2-CG1 4.09Å; V363-F413 HydrophobicContact CG2-CE2 4.01Å; V363-F413 HydrophobicContact CG2-CZ 3.56Å
364	E	84.9	Confident	89	Confident	61 Å²	61	55.2 Å²	55.2	29%	0.285	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	142	173.4	-69.5	-159.8	127.5	0	0	111.2	G366 R391 M395 V396	E364-G366 PolarHBondContact O-N 3.19Å; E364-R391 IonicContact OE1-CZ 3.01Å; E364-R391 IonicContact OE1-NE 3.78Å; E364-R391 PolarHBondContact OE1-NE 3.47Å; E364-R391 IonicContact OE1-NH2 2.69Å; E364-R391 PolarHBondContact OE1-NH2 2.97Å; E364-M395 HydrophobicContact CG-CB 3.6Å; E364-M395 HydrophobicContact CG-CG 4.5Å; E364-M395 HydrophobicContact CG-SD 4.21Å; E364-V396 PolarHBondContact N-O 3.07Å
365	D	77.3	Confident	88.9	Confident	107 Å²	107	48.3 Å²	48.3	57%	0.572	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	10.1	-179.6	-57.5	-25.6	0	0	0	115.8	M369	D365-M369 VanDerWaalsContact CA-CE 3.47Å; D365-M369 VanDerWaalsContact N-CE 3.29Å
366	G	78.7	Confident	88.9	Confident	22 Å²	22	56 Å²	56	23%	0.227	28%	0.279	C	S	.	.	S	Bend	trans	-78.5	161.4	177	0	0	0	0	0	114.3	V363 E364 T368 M369 I370	V363-G366 PolarHBondContact O-N 3.45Å; E364-G366 PolarHBondContact O-N 3.19Å; G366-T368 PolarHBondContact O-N 2.04Å; G366-M369 WeakPolarHBondContact O-CB 3.25Å; G366-M369 PolarHBondContact O-N 3.26Å; G366-M369 VanDerWaalsContact O-N 3.16Å; G366-I370 PolarHBondContact O-N 2.95Å
367	A	81	Confident	89.1	Confident	26 Å²	26	55.6 Å²	55.6	22%	0.215	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-33.9	176.5	0	0	0	0	0	112.6	I370 F371	A367-I370 PolarHBondContact O-N 3.19Å; A367-F371 PolarHBondContact O-N 3.32Å
368	T	88.1	Confident	89.2	Confident	14 Å²	14	51.1 Å²	51.1	9%	0.086	26%	0.263	C	S	.	.	H	α-helix	trans	-64.5	-41.2	175.3	-55.1	0	0	0	0	111.9	I216 V362 G366 I370 F371 F372	I216-T368 HydrophobicContact CD1-CG2 3.77Å; I216-T368 HydrophobicContact CG1-CG2 3.88Å; I216-T368 HydrophobicContact CG2-CG2 3.84Å; V362-T368 HydrophobicContact CB-CG2 4.4Å; V362-T368 HydrophobicContact CG1-CG2 3.62Å; G366-T368 PolarHBondContact O-N 2.04Å; T368-I370 PolarHBondContact O-N 3.46Å; T368-F371 WeakPolarHBondContact O-CB 3.08Å; T368-F371 PolarHBondContact O-N 3.28Å; T368-F372 HydrophobicContact CG2-CD2 4.05Å; T368-F372 HydrophobicContact CG2-CE2 3.76Å; T368-F372 WeakPolarHBondContact O-CD2 3.47Å; T368-F372 PolarHBondContact O-N 3.05Å; T368-F372 VanDerWaalsContact O-N 3.15Å
369	M	87.9	Confident	89.2	Confident	13 Å²	13	51.9 Å²	51.9	6%	0.064	27%	0.268	C	S	.	.	H	α-helix	trans	-61.9	-45.5	174.9	-173.8	-170	67.5	0	0	111.2	V362 D365 G366 F371 F372 K373 W384 M395	V362-M369 HydrophobicContact CG2-CB 3.81Å; V362-M369 HydrophobicContact CG2-CG 4.07Å; D365-M369 VanDerWaalsContact CA-CE 3.47Å; D365-M369 VanDerWaalsContact N-CE 3.29Å; G366-M369 WeakPolarHBondContact O-CB 3.25Å; G366-M369 PolarHBondContact O-N 3.26Å; G366-M369 VanDerWaalsContact O-N 3.16Å; M369-F371 VanDerWaalsContact C-N 3.28Å; M369-F371 PolarHBondContact O-N 3.49Å; M369-F372 PolarHBondContact O-N 3.2Å; M369-K373 WeakPolarHBondContact O-CB 3.23Å; M369-K373 PolarHBondContact O-N 3.1Å; M369-W384 HydrophobicContact CG-CH2 3.81Å; M369-W384 HydrophobicContact CG-CZ3 3.63Å; M369-W384 HydrophobicContact SD-CH2 4.44Å; M369-M395 HydrophobicContact CG-CE 4.42Å; M369-M395 HydrophobicContact SD-CE 4.4Å; M369-M395 HydrophobicContact SD-SD 3.93Å
370	I	86.4	Confident	89.2	Confident	62 Å²	62	51.2 Å²	51.2	32%	0.318	26%	0.264	S	S	.	.	H	α-helix	trans	-63	-36.5	178.3	-63.2	170.5	0	0	0	111.2	G366 A367 T368 K373 K374	G366-I370 PolarHBondContact O-N 2.95Å; A367-I370 PolarHBondContact O-N 3.19Å; T368-I370 PolarHBondContact O-N 3.46Å; I370-K373 PolarHBondContact O-N 3.15Å; I370-K374 HydrophobicContact CG2-CD 4.03Å; I370-K374 HydrophobicContact CG2-CG 4.48Å; I370-K374 WeakPolarHBondContact O-CB 3.49Å; I370-K374 PolarHBondContact O-N 3.35Å; I370-K374 VanDerWaalsContact O-N 3.09Å
371	F	90.1	Very high	89.2	Confident	49 Å²	49	54.1 Å²	54.1	22%	0.215	28%	0.28	C	S	.	.	H	α-helix	trans	-59.1	-52.3	174.7	169.6	-93.8	0	0	0	111.4	I216 A367 T368 M369 K373 K374 T375 Y380 I437 D438	I216-F371 HydrophobicContact CD1-CB 4.21Å; I216-F371 HydrophobicContact CD1-CD1 3.39Å; I216-F371 HydrophobicContact CD1-CD2 4.48Å; I216-F371 HydrophobicContact CD1-CE1 3.8Å; I216-F371 HydrophobicContact CD1-CG 3.78Å; I216-F371 HydrophobicContact CD1-CZ 4.49Å; A367-F371 PolarHBondContact O-N 3.32Å; T368-F371 WeakPolarHBondContact O-CB 3.08Å; T368-F371 PolarHBondContact O-N 3.28Å; M369-F371 VanDerWaalsContact C-N 3.28Å; M369-F371 PolarHBondContact O-N 3.49Å; F371-K373 VanDerWaalsContact C-N 3.33Å; F371-K373 PolarHBondContact O-N 3.1Å; F371-K374 PolarHBondContact O-N 2.98Å; F371-T375 WeakPolarHBondContact O-CB 3.28Å; F371-T375 PolarHBondContact O-N 3.18Å; F371-Y380 HydrophobicContact CE1-CD2 4.37Å; F371-Y380 HydrophobicContact CZ-CD2 4.35Å; F371-I437 HydrophobicContact CE1-CG2 4.16Å; F371-I437 HydrophobicContact CZ-CG2 4.43Å; F371-D438 HydrophobicContact CE2-CB 3.94Å; F371-D438 HydrophobicContact CZ-CB 3.98Å
372	F	91.9	Very high	89.1	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.3	-34.7	178.2	-75.1	-72.2	0	0	0	112.6	I216 V362 T368 M369 K374 T375 Y380 M383 W384 M387 L414	I216-F372 HydrophobicContact CD1-CE2 4.27Å; I216-F372 HydrophobicContact CG2-CE2 4.38Å; V362-F372 HydrophobicContact CG1-CD2 4.19Å; V362-F372 HydrophobicContact CG1-CE2 4.28Å; T368-F372 HydrophobicContact CG2-CD2 4.05Å; T368-F372 HydrophobicContact CG2-CE2 3.76Å; T368-F372 WeakPolarHBondContact O-CD2 3.47Å; T368-F372 PolarHBondContact O-N 3.05Å; T368-F372 VanDerWaalsContact O-N 3.15Å; M369-F372 PolarHBondContact O-N 3.2Å; F372-K374 VanDerWaalsContact C-N 3.3Å; F372-K374 PolarHBondContact O-N 3.39Å; F372-T375 VanDerWaalsContact O-CG2 3.3Å; F372-T375 WeakPolarHBondContact O-CG2 3.43Å; F372-Y380 HydrophobicContact CE1-CD1 4.06Å; F372-Y380 HydrophobicContact CE1-CG 4.07Å; F372-M383 HydrophobicContact CE1-SD 4.37Å; F372-W384 HydrophobicContact CB-CB 4.21Å; F372-W384 HydrophobicContact CB-CD2 4.38Å; F372-W384 HydrophobicContact CB-CE3 3.76Å; F372-W384 WeakPolarHBondContact O-CB 3.42Å; F372-M387 HydrophobicContact CB-CE 3.84Å; F372-M387 HydrophobicContact CD1-CE 3.97Å; F372-M387 HydrophobicContact CD2-CE 3.94Å; F372-M387 HydrophobicContact CG-CE 3.65Å; F372-L414 HydrophobicContact CE1-CD2 4.46Å; F372-L414 HydrophobicContact CE2-CD2 3.74Å; F372-L414 HydrophobicContact CZ-CD2 3.46Å; F372-L414 VanDerWaalsContact CZ-CD2 3.46Å
373	K	90.2	Very high	89.1	Confident	89 Å²	89	60.3 Å²	60.3	39%	0.387	31%	0.307	S	S	.	.	H	α-helix	trans	-64.3	-31	175.1	-172.9	179.6	179	-172.6	0	113.5	E171 M369 I370 F371 W384	E171-K373 IonicContact OE1-NZ 2.82Å; E171-K373 PolarHBondContact OE1-NZ 3.19Å; E171-K373 IonicContact OE2-NZ 3.77Å; E171-K373 PolarHBondContact OE2-NZ 3.04Å; M369-K373 WeakPolarHBondContact O-CB 3.23Å; M369-K373 PolarHBondContact O-N 3.1Å; I370-K373 PolarHBondContact O-N 3.15Å; F371-K373 VanDerWaalsContact C-N 3.33Å; F371-K373 PolarHBondContact O-N 3.1Å; K373-W384 HydrophobicContact CB-CD2 4.19Å; K373-W384 HydrophobicContact CB-CE3 4.45Å; K373-W384 HydrophobicContact CB-CH2 3.94Å; K373-W384 HydrophobicContact CB-CZ2 3.64Å; K373-W384 HydrophobicContact CB-CZ3 4.35Å; K373-W384 HydrophobicContact CD-CZ2 4.06Å; K373-W384 HydrophobicContact CG-CH2 4.32Å; K373-W384 HydrophobicContact CG-CZ2 3.64Å
374	K	88.6	Confident	89.3	Confident	127 Å²	127	60.2 Å²	60.2	55%	0.552	30%	0.303	S	S	*	.	H	α-helix	trans	-106.6	-9.7	-173.3	-69.2	-173.2	177.4	180	0	114.4	I370 F371 F372	I370-K374 HydrophobicContact CG2-CD 4.03Å; I370-K374 HydrophobicContact CG2-CG 4.48Å; I370-K374 WeakPolarHBondContact O-CB 3.49Å; I370-K374 PolarHBondContact O-N 3.35Å; I370-K374 VanDerWaalsContact O-N 3.09Å; F371-K374 PolarHBondContact O-N 2.98Å; F372-K374 VanDerWaalsContact C-N 3.3Å; F372-K374 PolarHBondContact O-N 3.39Å
375	T	89.6	Confident	89.8	Confident	21 Å²	21	63.2 Å²	63.2	13%	0.129	32%	0.317	C	S	.	.			trans	-62	150.4	-178.5	-167.7	0	0	0	0	111.3	F371 F372 I377	F371-T375 WeakPolarHBondContact O-CB 3.28Å; F371-T375 PolarHBondContact O-N 3.18Å; F372-T375 VanDerWaalsContact O-CG2 3.3Å; F372-T375 WeakPolarHBondContact O-CG2 3.43Å; T375-I377 PolarHBondContact OG1-N 3.16Å
376	K	90.6	Very high	90.6	Very high	204 Å²	204	59.2 Å²	59.2	89%	0.887	29%	0.294	S	S	*	.			trans	-114	6.8	174.3	-64	-172.3	177.7	-175.8	0	112.5
377	I	93	Very high	91.3	Very high	92 Å²	92	58.2 Å²	58.2	47%	0.472	28%	0.284	S	S	.	.			trans	-83.2	123.2	180	-62.2	173.3	0	0	0	108	T375 T379 Y380 D381	T375-I377 PolarHBondContact OG1-N 3.16Å; I377-T379 VanDerWaalsContact C-N 3.32Å; I377-T379 PolarHBondContact O-N 3.41Å; I377-Y380 HydrophobicContact CB-CD2 3.77Å; I377-Y380 HydrophobicContact CB-CE2 4.34Å; I377-Y380 HydrophobicContact CB-CG 4.42Å; I377-Y380 HydrophobicContact CD1-CD2 3.84Å; I377-Y380 HydrophobicContact CD1-CE2 3.79Å; I377-Y380 HydrophobicContact CG1-CD2 4.36Å; I377-Y380 HydrophobicContact CG2-CD2 3.85Å; I377-Y380 HydrophobicContact CG2-CE2 4.08Å; I377-Y380 HydrophobicContact CG2-CG 4.38Å; I377-Y380 PolarHBondContact O-N 2.88Å; I377-D381 WeakPolarHBondContact O-CB 3.39Å; I377-D381 PolarHBondContact O-N 3.37Å
378	S	92.9	Very high	91.9	Very high	84 Å²	84	59.9 Å²	59.9	59%	0.587	29%	0.294	S	S	*	.	H	α-helix	trans	-54.6	-38.4	-171.4	64.6	0	0	0	0	115.1	K382	S378-K382 WeakPolarHBondContact O-CG 3.27Å; S378-K382 PolarHBondContact O-N 3.16Å; S378-K382 VanDerWaalsContact O-N 3.15Å
379	T	93.1	Very high	92.2	Very high	29 Å²	29	63.5 Å²	63.5	18%	0.178	32%	0.32	C	S	.	.	H	α-helix	trans	-61.8	-52	174.7	-57.4	0	0	0	0	111.2	D350 A353 I377 D381 K382 M383	D350-T379 WeakPolarHBondContact OD1-CB 3.3Å; D350-T379 WeakPolarHBondContact OD1-CG2 3.45Å; D350-T379 PolarHBondContact OD1-OG1 3.39Å; A353-T379 HydrophobicContact CB-CG2 3.69Å; I377-T379 VanDerWaalsContact C-N 3.32Å; I377-T379 PolarHBondContact O-N 3.41Å; T379-D381 VanDerWaalsContact C-N 3.33Å; T379-D381 PolarHBondContact O-N 2.61Å; T379-K382 WeakPolarHBondContact O-CB 3.31Å; T379-K382 PolarHBondContact O-N 3.04Å; T379-M383 HydrophobicContact CG2-SD 4.45Å; T379-M383 WeakPolarHBondContact O-CG 2.95Å; T379-M383 PolarHBondContact O-N 3.39Å
380	Y	94.4	Very high	92.4	Very high	39 Å²	39	67.3 Å²	67.3	15%	0.153	33%	0.334	C	S	.	.	H	α-helix	trans	-72.7	-28.5	-174.6	-55.6	-31.8	0	0	0	112.6	A349 F371 F372 I377 M383 W384 I437	A349-Y380 HydrophobicContact CB-CE1 4.11Å; F371-Y380 HydrophobicContact CE1-CD2 4.37Å; F371-Y380 HydrophobicContact CZ-CD2 4.35Å; F372-Y380 HydrophobicContact CE1-CD1 4.06Å; F372-Y380 HydrophobicContact CE1-CG 4.07Å; I377-Y380 HydrophobicContact CB-CD2 3.77Å; I377-Y380 HydrophobicContact CB-CE2 4.34Å; I377-Y380 HydrophobicContact CB-CG 4.42Å; I377-Y380 HydrophobicContact CD1-CD2 3.84Å; I377-Y380 HydrophobicContact CD1-CE2 3.79Å; I377-Y380 HydrophobicContact CG1-CD2 4.36Å; I377-Y380 HydrophobicContact CG2-CD2 3.85Å; I377-Y380 HydrophobicContact CG2-CE2 4.08Å; I377-Y380 HydrophobicContact CG2-CG 4.38Å; I377-Y380 PolarHBondContact O-N 2.88Å; Y380-M383 HydrophobicContact CD1-SD 3.93Å; Y380-M383 WeakPolarHBondContact O-CB 3.35Å; Y380-M383 PolarHBondContact O-N 3.4Å; Y380-W384 PolarHBondContact O-N 3.04Å; Y380-I437 HydrophobicContact CD1-CG2 4.48Å; Y380-I437 HydrophobicContact CD2-CG2 4.49Å; Y380-I437 HydrophobicContact CE1-CG2 3.87Å; Y380-I437 HydrophobicContact CE2-CG2 3.88Å
381	D	93.8	Very high	92.5	Very high	66 Å²	66	68.3 Å²	68.3	35%	0.353	33%	0.333	S	S	.	.	H	α-helix	trans	-65.6	-45.4	172.2	-166.7	38.8	0	0	0	110.8	I377 T379 M383 W384 E385	I377-D381 WeakPolarHBondContact O-CB 3.39Å; I377-D381 PolarHBondContact O-N 3.37Å; T379-D381 VanDerWaalsContact C-N 3.33Å; T379-D381 PolarHBondContact O-N 2.61Å; D381-M383 VanDerWaalsContact C-N 3.3Å; D381-M383 PolarHBondContact O-N 3.02Å; D381-W384 CarbonylContact O-C 3.56Å; D381-W384 WeakPolarHBondContact O-CA 3.49Å; D381-W384 WeakPolarHBondContact O-CB 3.4Å; D381-W384 PolarHBondContact O-N 2.99Å; D381-E385 PolarHBondContact O-N 3.36Å
382	K	93.5	Very high	92.3	Very high	130 Å²	130	74.9 Å²	74.9	57%	0.565	36%	0.364	S	S	*	.	H	α-helix	trans	-59.8	-39.7	170.8	-72.7	175.8	-179.7	-179.4	0	112.6	S378 T379 W384 E385 F386	S378-K382 WeakPolarHBondContact O-CG 3.27Å; S378-K382 PolarHBondContact O-N 3.16Å; S378-K382 VanDerWaalsContact O-N 3.15Å; T379-K382 WeakPolarHBondContact O-CB 3.31Å; T379-K382 PolarHBondContact O-N 3.04Å; K382-W384 VanDerWaalsContact C-N 3.3Å; K382-W384 PolarHBondContact O-N 2.96Å; K382-E385 PolarHBondContact O-N 3.05Å; K382-F386 PolarHBondContact O-N 3.4Å
383	M	94.8	Very high	92	Very high	0 Å²	0	77.3 Å²	77.3	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-62.3	-40.3	174.3	-68.2	178.8	75.3	0	0	111.4	A349 L352 A353 Y360 F372 T379 Y380 D381 F386 M387 L414	A349-M383 HydrophobicContact CB-SD 4.26Å; L352-M383 HydrophobicContact CB-CE 4.46Å; A353-M383 HydrophobicContact CB-CG 3.75Å; A353-M383 HydrophobicContact CB-SD 4.4Å; Y360-M383 HydrophobicContact CD2-CE 3.92Å; Y360-M383 HydrophobicContact CE2-CB 3.87Å; Y360-M383 HydrophobicContact CE2-CE 3.79Å; Y360-M383 HydrophobicContact CE2-CG 4.05Å; F372-M383 HydrophobicContact CE1-SD 4.37Å; T379-M383 HydrophobicContact CG2-SD 4.45Å; T379-M383 WeakPolarHBondContact O-CG 2.95Å; T379-M383 PolarHBondContact O-N 3.39Å; Y380-M383 HydrophobicContact CD1-SD 3.93Å; Y380-M383 WeakPolarHBondContact O-CB 3.35Å; Y380-M383 PolarHBondContact O-N 3.4Å; D381-M383 VanDerWaalsContact C-N 3.3Å; D381-M383 PolarHBondContact O-N 3.02Å; M383-F386 PolarHBondContact O-N 3.4Å; M383-M387 HydrophobicContact CB-CE 4.25Å; M383-M387 WeakPolarHBondContact O-CE 3.42Å; M383-M387 WeakPolarHBondContact O-CG 3.36Å; M383-M387 PolarHBondContact O-N 3.09Å; M383-L414 HydrophobicContact CE-CD1 4.5Å; M383-L414 HydrophobicContact CE-CD2 3.9Å
384	W	95.2	Very high	92.1	Very high	30 Å²	30	73 Å²	73	11%	0.114	36%	0.362	C	S	.	.	H	α-helix	trans	-65.6	-43.4	175.4	177.8	-111.3	0	0	0	112.5	M369 F372 K373 Y380 D381 K382 F386 M387 S388 M395	M369-W384 HydrophobicContact CG-CH2 3.81Å; M369-W384 HydrophobicContact CG-CZ3 3.63Å; M369-W384 HydrophobicContact SD-CH2 4.44Å; F372-W384 HydrophobicContact CB-CB 4.21Å; F372-W384 HydrophobicContact CB-CD2 4.38Å; F372-W384 HydrophobicContact CB-CE3 3.76Å; F372-W384 WeakPolarHBondContact O-CB 3.42Å; K373-W384 HydrophobicContact CB-CD2 4.19Å; K373-W384 HydrophobicContact CB-CE3 4.45Å; K373-W384 HydrophobicContact CB-CH2 3.94Å; K373-W384 HydrophobicContact CB-CZ2 3.64Å; K373-W384 HydrophobicContact CB-CZ3 4.35Å; K373-W384 HydrophobicContact CD-CZ2 4.06Å; K373-W384 HydrophobicContact CG-CH2 4.32Å; K373-W384 HydrophobicContact CG-CZ2 3.64Å; Y380-W384 PolarHBondContact O-N 3.04Å; D381-W384 CarbonylContact O-C 3.56Å; D381-W384 WeakPolarHBondContact O-CA 3.49Å; D381-W384 WeakPolarHBondContact O-CB 3.4Å; D381-W384 PolarHBondContact O-N 2.99Å; K382-W384 VanDerWaalsContact C-N 3.3Å; K382-W384 PolarHBondContact O-N 2.96Å; W384-F386 VanDerWaalsContact C-N 3.3Å; W384-F386 PolarHBondContact O-N 3.13Å; W384-M387 HydrophobicContact CE3-CE 4.25Å; W384-M387 PolarHBondContact O-N 3.46Å; W384-S388 WeakPolarHBondContact O-CB 3.44Å; W384-S388 PolarHBondContact O-N 3.32Å; W384-M395 HydrophobicContact CH2-CE 3.95Å; W384-M395 HydrophobicContact CZ3-CE 3.73Å
385	E	93.8	Very high	92.2	Very high	123 Å²	123	67.6 Å²	67.6	58%	0.575	34%	0.339	S	S	*	.	H	α-helix	trans	-56.9	-44.8	174.4	-71.9	-176.8	160.5	0	0	111.4	D381 K382 S388 S389	D381-E385 PolarHBondContact O-N 3.36Å; K382-E385 PolarHBondContact O-N 3.05Å; E385-S388 PolarHBondContact O-N 2.86Å; E385-S389 WeakPolarHBondContact O-CB 3.42Å; E385-S389 PolarHBondContact O-N 3.42Å; E385-S389 PolarHBondContact O-OG 2.89Å
386	F	94.5	Very high	92.3	Very high	24 Å²	24	66.6 Å²	66.6	11%	0.105	33%	0.333	C	S	.	.	H	α-helix	trans	-59.6	-51.4	174	178	-92.1	0	0	0	111.6	Y360 K382 M383 W384 S388 S389 R390 V394	Y360-F386 HydrophobicContact CD1-CD1 4.45Å; Y360-F386 HydrophobicContact CD1-CE1 4.2Å; Y360-F386 HydrophobicContact CD2-CD1 4.25Å; Y360-F386 AromaticContact CE1-CD1 3.88Å; Y360-F386 HydrophobicContact CE1-CD1 3.88Å; Y360-F386 AromaticContact CE1-CE1 3.93Å; Y360-F386 HydrophobicContact CE1-CE1 3.93Å; Y360-F386 HydrophobicContact CE1-CG 4.45Å; Y360-F386 AromaticContact CE2-CD1 3.62Å; Y360-F386 HydrophobicContact CE2-CD1 3.62Å; Y360-F386 HydrophobicContact CE2-CE1 4.24Å; Y360-F386 HydrophobicContact CE2-CG 4.36Å; Y360-F386 HydrophobicContact CG-CE1 4.48Å; Y360-F386 AromaticContact CZ-CD1 3.41Å; Y360-F386 VanDerWaalsContact CZ-CD1 3.41Å; Y360-F386 AromaticContact CZ-CE1 3.95Å; Y360-F386 AromaticContact CZ-CG 3.88Å; Y360-F386 WeakPolarHBondContact OH-CB 3.47Å; Y360-F386 WeakPolarHBondContact OH-CG 3.47Å; K382-F386 PolarHBondContact O-N 3.4Å; M383-F386 PolarHBondContact O-N 3.4Å; W384-F386 VanDerWaalsContact C-N 3.3Å; W384-F386 PolarHBondContact O-N 3.13Å; F386-S388 VanDerWaalsContact C-N 3.34Å; F386-S388 PolarHBondContact O-N 3.41Å; F386-S389 PolarHBondContact O-N 3.41Å; F386-S389 PolarHBondContact O-OG 3.42Å; F386-R390 PolarHBondContact O-N 2.86Å; F386-V394 HydrophobicContact CE1-CG1 4.25Å
387	M	94.9	Very high	92.2	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.4	-39	-179.6	-73.3	-175	-73.7	0	0	112.6	Y360 V362 F372 M383 W384 R390 R391 V394 M395	Y360-M387 HydrophobicContact CD2-CG 4.07Å; Y360-M387 HydrophobicContact CD2-SD 4.3Å; Y360-M387 HydrophobicContact CE2-CG 4.01Å; V362-M387 HydrophobicContact CG1-SD 4.13Å; V362-M387 HydrophobicContact CG2-SD 4.26Å; F372-M387 HydrophobicContact CB-CE 3.84Å; F372-M387 HydrophobicContact CD1-CE 3.97Å; F372-M387 HydrophobicContact CD2-CE 3.94Å; F372-M387 HydrophobicContact CG-CE 3.65Å; M383-M387 HydrophobicContact CB-CE 4.25Å; M383-M387 WeakPolarHBondContact O-CE 3.42Å; M383-M387 WeakPolarHBondContact O-CG 3.36Å; M383-M387 PolarHBondContact O-N 3.09Å; W384-M387 HydrophobicContact CE3-CE 4.25Å; W384-M387 PolarHBondContact O-N 3.46Å; M387-R390 CarbonylContact O-C 3.52Å; M387-R390 PolarHBondContact O-N 3.18Å; M387-R391 WeakPolarHBondContact O-CA 3.45Å; M387-R391 PolarHBondContact O-N 2.9Å; M387-R391 VanDerWaalsContact O-N 3.11Å; M387-V394 HydrophobicContact CB-CG2 4.24Å; M387-V394 HydrophobicContact CG-CG2 4.32Å; M387-M395 HydrophobicContact CB-CE 4.23Å
388	S	93.1	Very high	91.9	Very high	61 Å²	61	64.3 Å²	64.3	43%	0.427	33%	0.325	S	S	.	.	H	α-helix	trans	-69	-42.1	179.8	-173.9	0	0	0	0	111.3	W384 E385 F386 R390 R391	W384-S388 WeakPolarHBondContact O-CB 3.44Å; W384-S388 PolarHBondContact O-N 3.32Å; E385-S388 PolarHBondContact O-N 2.86Å; F386-S388 VanDerWaalsContact C-N 3.34Å; F386-S388 PolarHBondContact O-N 3.41Å; S388-R390 PolarHBondContact O-N 3.29Å; S388-R391 PolarHBondContact O-N 2.92Å
389	S	93.4	Very high	91.8	Very high	91 Å²	91	62.1 Å²	62.1	64%	0.636	31%	0.306	S	S	*	.	H	α-helix	trans	-63.8	-27.1	176.8	73.7	0	0	0	0	113.3	E385 F386	E385-S389 WeakPolarHBondContact O-CB 3.42Å; E385-S389 PolarHBondContact O-N 3.42Å; E385-S389 PolarHBondContact O-OG 2.89Å; F386-S389 PolarHBondContact O-N 3.41Å; F386-S389 PolarHBondContact O-OG 3.42Å
390	R	92.6	Very high	91.7	Very high	93 Å²	93	67 Å²	67	35%	0.351	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	30.8	-177.9	-62.9	-175.6	-175.1	-168.4	4.9	113.1	E359 F386 M387 S388 H392 S393 V394	E359-R390 IonicContact OE1-NH1 3.2Å; F386-R390 PolarHBondContact O-N 2.86Å; M387-R390 CarbonylContact O-C 3.52Å; M387-R390 PolarHBondContact O-N 3.18Å; S388-R390 PolarHBondContact O-N 3.29Å; R390-H392 VanDerWaalsContact C-N 3.35Å; R390-H392 PolarHBondContact O-N 3.43Å; R390-H392 VanDerWaalsContact O-N 3.15Å; R390-S393 WeakPolarHBondContact O-CA 3.41Å; R390-S393 PolarHBondContact O-N 3.3Å; R390-V394 HydrophobicContact CB-CG1 3.86Å; R390-V394 HydrophobicContact CB-CG2 4.22Å; R390-V394 WeakPolarHBondContact O-CG2 3.05Å; R390-V394 PolarHBondContact O-N 3.25Å
391	R	88.3	Confident	91.6	Very high	83 Å²	83	69.5 Å²	69.5	31%	0.313	34%	0.339	S	S	.	.	H	α-helix	trans	-45.4	-52.9	-171.2	-170.9	178.6	178.2	103.6	-0.4	114.1	E364 M387 S388 S393 M395	E364-R391 IonicContact OE1-CZ 3.01Å; E364-R391 IonicContact OE1-NE 3.78Å; E364-R391 PolarHBondContact OE1-NE 3.47Å; E364-R391 IonicContact OE1-NH2 2.69Å; E364-R391 PolarHBondContact OE1-NH2 2.97Å; M387-R391 WeakPolarHBondContact O-CA 3.45Å; M387-R391 PolarHBondContact O-N 2.9Å; M387-R391 VanDerWaalsContact O-N 3.11Å; S388-R391 PolarHBondContact O-N 2.92Å; R391-S393 PolarHBondContact O-N 3.49Å; R391-M395 HydrophobicContact CG-CE 4.12Å; R391-M395 HydrophobicContact CG-CG 4.24Å; R391-M395 HydrophobicContact CG-SD 3.69Å; R391-M395 WeakPolarHBondContact O-CB 3.32Å; R391-M395 PolarHBondContact O-N 2.82Å; R391-M395 VanDerWaalsContact O-N 3.12Å
392	H	85.4	Confident	91.6	Very high	187 Å²	187	66.3 Å²	66.3	87%	0.866	32%	0.323	S	S	*	.	H	α-helix	trans	-67.9	-22.5	-178.6	-63.7	-60.9	0	0	0	114.4	R390	R390-H392 VanDerWaalsContact C-N 3.35Å; R390-H392 PolarHBondContact O-N 3.43Å; R390-H392 VanDerWaalsContact O-N 3.15Å
393	S	86.4	Confident	91.6	Very high	50 Å²	50	61.5 Å²	61.5	35%	0.35	30%	0.303	S	S	.	.	H	α-helix	trans	-91.7	-41.2	-179	171.9	0	0	0	0	110.9	R390 R391 R405	R390-S393 WeakPolarHBondContact O-CA 3.41Å; R390-S393 PolarHBondContact O-N 3.3Å; R391-S393 PolarHBondContact O-N 3.49Å; S393-R405 PolarHBondContact O-NH1 3.06Å; S393-R405 PolarHBondContact O-NH2 3.04Å
394	V	91.5	Very high	91.6	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-101.4	-25.4	-169.7	-59.6	0	0	0	0	114.9	E359 Y360 F386 M387 R390 Y411	E359-V394 HydrophobicContact CB-CG1 4.45Å; Y360-V394 WeakPolarHBondContact O-CB 3.34Å; F386-V394 HydrophobicContact CE1-CG1 4.25Å; M387-V394 HydrophobicContact CB-CG2 4.24Å; M387-V394 HydrophobicContact CG-CG2 4.32Å; R390-V394 HydrophobicContact CB-CG1 3.86Å; R390-V394 HydrophobicContact CB-CG2 4.22Å; R390-V394 WeakPolarHBondContact O-CG2 3.05Å; R390-V394 PolarHBondContact O-N 3.25Å; V394-Y411 PolarHBondContact O-OH 3.5Å
395	M	91.9	Very high	91.6	Very high	12 Å²	12	68.5 Å²	68.5	6%	0.059	33%	0.334	C	S	.	.			trans	-82	146.4	179.6	-58.1	-166.3	-178.5	0	0	111	V362 E364 M369 W384 M387 R391	V362-M395 WeakPolarHBondContact O-CA 2.99Å; E364-M395 HydrophobicContact CG-CB 3.6Å; E364-M395 HydrophobicContact CG-CG 4.5Å; E364-M395 HydrophobicContact CG-SD 4.21Å; M369-M395 HydrophobicContact CG-CE 4.42Å; M369-M395 HydrophobicContact SD-CE 4.4Å; M369-M395 HydrophobicContact SD-SD 3.93Å; W384-M395 HydrophobicContact CH2-CE 3.95Å; W384-M395 HydrophobicContact CZ3-CE 3.73Å; M387-M395 HydrophobicContact CB-CE 4.23Å; R391-M395 HydrophobicContact CG-CE 4.12Å; R391-M395 HydrophobicContact CG-CG 4.24Å; R391-M395 HydrophobicContact CG-SD 3.69Å; R391-M395 WeakPolarHBondContact O-CB 3.32Å; R391-M395 PolarHBondContact O-N 2.82Å; R391-M395 VanDerWaalsContact O-N 3.12Å
396	V	92.3	Very high	91.6	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.006	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-117.5	155	179.5	-63.4	0	0	0	0	110.4	V362 V363 E364 E401 F413	V362-V396 PolarHBondContact O-N 3.41Å; V362-V396 VanDerWaalsContact O-N 3.13Å; V363-V396 CarbonylContact C-O 3.53Å; V363-V396 VanDerWaalsContact CA-O 3.32Å; V363-V396 WeakPolarHBondContact CA-O 3.29Å; V363-V396 HydrophobicContact CG2-CG2 4.18Å; E364-V396 PolarHBondContact N-O 3.07Å; V396-E401 HydrophobicContact CB-CB 4.43Å; V396-E401 HydrophobicContact CB-CG 4.26Å; V396-E401 HydrophobicContact CG1-CG 4.28Å; V396-F413 HydrophobicContact CG2-CD2 4.35Å; V396-F413 HydrophobicContact CG2-CE2 3.44Å; V396-F413 VanDerWaalsContact CG2-CE2 3.44Å; V396-F413 HydrophobicContact CG2-CZ 3.65Å
397	K	88	Confident	91.6	Very high	149 Å²	149	64.6 Å²	64.6	65%	0.648	32%	0.318	S	S	*	.	S	Bend	trans	-81.3	-41.6	-177.7	-64.5	179.2	-179.1	177	0	112.2	V363 E401	V363-K397 VanDerWaalsContact CG1-O 3.26Å; V363-K397 WeakPolarHBondContact CG1-O 3.05Å; K397-E401 WeakPolarHBondContact CB-OE2 3.4Å; K397-E401 PolarHBondContact N-OE2 2.96Å
398	N	87.2	Confident	91.4	Very high	99 Å²	99	69 Å²	69	53%	0.529	35%	0.345	S	S	.	.	S	Bend	trans	-130.4	164	-175.7	-64.4	3.1	0	0	0	111.1	E401 G402	N398-E401 PolarHBondContact O-N 3.5Å; N398-G402 PolarHBondContact O-N 3.41Å
399	I	89.8	Confident	91.3	Very high	38 Å²	38	68.2 Å²	68.2	20%	0.195	34%	0.339	C	S	.	.	H	α-helix	trans	-64.7	-40.5	179.2	-64.2	174.3	0	0	0	110.7	V363 E401 G402 I403 F413 M415 T419	V363-I399 HydrophobicContact CG2-CG1 4.09Å; I399-E401 VanDerWaalsContact C-N 3.34Å; I399-E401 PolarHBondContact O-N 2.89Å; I399-G402 PolarHBondContact O-N 3.46Å; I399-G402 VanDerWaalsContact O-N 3.15Å; I399-I403 HydrophobicContact CG2-CD1 3.81Å; I399-I403 HydrophobicContact CG2-CG1 4.33Å; I399-I403 WeakPolarHBondContact O-CG1 3.31Å; I399-I403 PolarHBondContact O-N 3.49Å; I399-F413 HydrophobicContact CG2-CE1 4.46Å; I399-M415 HydrophobicContact CG2-CE 4.37Å; I399-T419 HydrophobicContact CD1-CG2 4.48Å; I399-T419 HydrophobicContact CG2-CG2 4.12Å
400	E	91.3	Very high	91.1	Very high	130 Å²	130	67.4 Å²	67.4	61%	0.607	33%	0.328	S	S	*	.	H	α-helix	trans	-62.8	-39.2	-179.5	-64.9	72.1	-156.1	0	0	112.3	G402 I403 H404	E400-G402 VanDerWaalsContact C-N 3.34Å; E400-I403 PolarHBondContact O-N 2.99Å; E400-H404 WeakPolarHBondContact O-CB 3.46Å; E400-H404 PolarHBondContact O-N 3.33Å
401	E	92.8	Very high	91.2	Very high	92 Å²	92	63 Å²	63	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-62.8	-43.6	175.1	-178	-177.6	-170.6	0	0	110.7	V396 K397 N398 I399 H404 R405	V396-E401 HydrophobicContact CB-CB 4.43Å; V396-E401 HydrophobicContact CB-CG 4.26Å; V396-E401 HydrophobicContact CG1-CG 4.28Å; K397-E401 WeakPolarHBondContact CB-OE2 3.4Å; K397-E401 PolarHBondContact N-OE2 2.96Å; N398-E401 PolarHBondContact O-N 3.5Å; I399-E401 VanDerWaalsContact C-N 3.34Å; I399-E401 PolarHBondContact O-N 2.89Å; E401-H404 PolarHBondContact O-N 3.39Å; E401-R405 WeakPolarHBondContact O-CB 3.43Å; E401-R405 PolarHBondContact O-N 2.91Å
402	G	93.2	Very high	91.5	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.5	-45.9	174.8	0	0	0	0	0	112.7	N398 I399 E400 R405 V406	N398-G402 PolarHBondContact O-N 3.41Å; I399-G402 PolarHBondContact O-N 3.46Å; I399-G402 VanDerWaalsContact O-N 3.15Å; E400-G402 VanDerWaalsContact C-N 3.34Å; G402-R405 PolarHBondContact O-N 2.84Å; G402-V406 WeakPolarHBondContact O-CG2 3.27Å; G402-V406 PolarHBondContact O-N 3.36Å
403	I	94.3	Very high	92	Very high	28 Å²	28	50.1 Å²	50.1	14%	0.144	26%	0.255	C	S	.	.	H	α-helix	trans	-61.6	-47.6	177.2	-65.7	165.3	0	0	0	110.9	L219 I399 E400 R405 V406 L407 M415 V423 L430	L219-I403 HydrophobicContact CD2-CG1 4.09Å; I399-I403 HydrophobicContact CG2-CD1 3.81Å; I399-I403 HydrophobicContact CG2-CG1 4.33Å; I399-I403 WeakPolarHBondContact O-CG1 3.31Å; I399-I403 PolarHBondContact O-N 3.49Å; E400-I403 PolarHBondContact O-N 2.99Å; I403-R405 PolarHBondContact O-N 3.22Å; I403-V406 PolarHBondContact O-N 2.56Å; I403-L407 HydrophobicContact CG2-CD1 4.29Å; I403-L407 WeakPolarHBondContact O-CG 3.47Å; I403-L407 PolarHBondContact O-N 3.36Å; I403-M415 HydrophobicContact CG1-CE 4.02Å; I403-V423 HydrophobicContact CD1-CG1 4.08Å; I403-V423 HydrophobicContact CD1-CG2 3.63Å; I403-V423 HydrophobicContact CG1-CG1 4.38Å; I403-V423 HydrophobicContact CG2-CG1 4.21Å; I403-L430 HydrophobicContact CG2-CD1 3.91Å
404	H	94.3	Very high	92.5	Very high	124 Å²	124	47.9 Å²	47.9	57%	0.574	24%	0.239	S	C	*	.	H	α-helix	trans	-60.4	-37.3	178.2	-177.7	-89.6	0	0	0	111.8	E400 E401 L407 T408	E400-H404 WeakPolarHBondContact O-CB 3.46Å; E400-H404 PolarHBondContact O-N 3.33Å; E401-H404 PolarHBondContact O-N 3.39Å; H404-L407 PolarHBondContact O-N 3.1Å; H404-T408 WeakPolarHBondContact O-CG2 3.28Å; H404-T408 PolarHBondContact O-N 2.97Å; H404-T408 VanDerWaalsContact O-N 3.16Å; H404-T408 PolarHBondContact O-OG1 3.22Å
405	R	94.3	Very high	92.5	Very high	53 Å²	53	48.2 Å²	48.2	20%	0.2	24%	0.241	C	C	.	.	H	α-helix	trans	-68.1	-40.9	177.6	-171.8	174	-179.9	163.3	-3.8	113.3	E359 S393 E401 G402 I403 L407 T408 S409 Y411	E359-R405 IonicContact OE2-NH2 2.94Å; E359-R405 PolarHBondContact OE2-NH2 3.37Å; S393-R405 PolarHBondContact O-NH1 3.06Å; S393-R405 PolarHBondContact O-NH2 3.04Å; E401-R405 WeakPolarHBondContact O-CB 3.43Å; E401-R405 PolarHBondContact O-N 2.91Å; G402-R405 PolarHBondContact O-N 2.84Å; I403-R405 PolarHBondContact O-N 3.22Å; R405-L407 PolarHBondContact O-N 3.34Å; R405-T408 WeakPolarHBondContact CA-OG1 3.41Å; R405-T408 PolarHBondContact O-N 2.96Å; R405-T408 PolarHBondContact O-OG1 3.32Å; R405-S409 WeakPolarHBondContact CG-OG 3.29Å; R405-S409 PolarHBondContact O-N 3.11Å; R405-S409 PolarHBondContact O-OG 3.39Å; R405-Y411 HydrophobicContact CB-CD1 4.11Å; R405-Y411 HydrophobicContact CG-CD1 3.76Å; R405-Y411 HydrophobicContact CG-CE1 4.36Å; R405-Y411 HydrophobicContact CG-CG 3.95Å
406	V	94.6	Very high	92.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-37.1	174.7	175.6	0	0	0	0	111	L219 F220 R221 G402 I403 Y411 F413 L430	L219-V406 HydrophobicContact CD2-CG2 4.33Å; L219-V406 HydrophobicContact CG-CG1 4.47Å; F220-V406 VanDerWaalsContact C-CG1 3.5Å; R221-V406 HydrophobicContact CB-CG1 4.4Å; R221-V406 VanDerWaalsContact N-CG1 3.34Å; G402-V406 WeakPolarHBondContact O-CG2 3.27Å; G402-V406 PolarHBondContact O-N 3.36Å; I403-V406 PolarHBondContact O-N 2.56Å; V406-Y411 HydrophobicContact CG2-CD1 3.82Å; V406-Y411 HydrophobicContact CG2-CE1 4.33Å; V406-F413 HydrophobicContact CG2-CB 3.4Å; V406-F413 VanDerWaalsContact CG2-CB 3.4Å; V406-F413 HydrophobicContact CG2-CG 4.44Å; V406-L430 HydrophobicContact CB-CD2 4.23Å; V406-L430 HydrophobicContact CG1-CD2 3.54Å
407	L	93.1	Very high	92.6	Very high	65 Å²	65	49.6 Å²	49.6	34%	0.34	25%	0.249	S	C	.	.	H	α-helix	trans	-71.2	-31.5	178.5	-70.6	168	0	0	0	113.4	I403 H404 R405 N427 N429 L430	I403-L407 HydrophobicContact CG2-CD1 4.29Å; I403-L407 WeakPolarHBondContact O-CG 3.47Å; I403-L407 PolarHBondContact O-N 3.36Å; H404-L407 PolarHBondContact O-N 3.1Å; R405-L407 PolarHBondContact O-N 3.34Å; L407-N427 WeakPolarHBondContact CD1-ND2 3.38Å; L407-N429 HydrophobicContact CD2-CB 3.97Å; L407-L430 HydrophobicContact CD2-CD1 4.28Å; L407-L430 HydrophobicContact CD2-CD2 3.67Å; L407-L430 HydrophobicContact CD2-CG 3.82Å; L407-L430 HydrophobicContact CG-CD1 4.49Å; L407-L430 HydrophobicContact CG-CD2 4.03Å; L407-L430 HydrophobicContact CG-CG 4.43Å
408	T	91.8	Very high	92.9	Very high	93 Å²	93	42.6 Å²	42.6	57%	0.571	22%	0.218	S	C	*	.	H	α-helix	trans	-98.2	-24.1	-171.1	48.7	0	0	0	0	114.1	H404 R405	H404-T408 WeakPolarHBondContact O-CG2 3.28Å; H404-T408 PolarHBondContact O-N 2.97Å; H404-T408 VanDerWaalsContact O-N 3.16Å; H404-T408 PolarHBondContact O-OG1 3.22Å; R405-T408 WeakPolarHBondContact CA-OG1 3.41Å; R405-T408 PolarHBondContact O-N 2.96Å; R405-T408 PolarHBondContact O-OG1 3.32Å
409	S	90.3	Very high	93.1	Very high	44 Å²	44	38.3 Å²	38.3	31%	0.308	20%	0.196	S	C	.	.	S	Bend	trans	-136.3	163.9	-173.6	64.5	0	0	0	0	112.2	R405 Y411	R405-S409 WeakPolarHBondContact CG-OG 3.29Å; R405-S409 PolarHBondContact O-N 3.11Å; R405-S409 PolarHBondContact O-OG 3.39Å; S409-Y411 PolarHBondContact O-N 3.19Å; S409-Y411 WeakPolarHBondContact OG-CB 3.48Å
410	D	90.3	Very high	93.3	Very high	75 Å²	75	36.5 Å²	36.5	40%	0.401	19%	0.186	S	C	.	.	S	Bend	trans	-75.2	69.6	171.7	-76.7	-25.3	0	0	0	110.4	R221 E359	R221-D410 IonicContact CZ-OD1 2.89Å; R221-D410 IonicContact NE-OD1 2.82Å; R221-D410 PolarHBondContact NE-OD1 3.44Å; R221-D410 IonicContact NH2-OD1 3.69Å; R221-D410 PolarHBondContact NH2-OD1 3.31Å; R221-D410 IonicContact NH2-OD2 2.71Å; E359-D410 PolarHBondContact N-O 3.2Å
411	Y	94.3	Very high	93.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	132.8	-177.1	175.3	-102.5	0	0	0	110.3	F220 E359 G361 V394 R405 V406 S409 F413	F220-Y411 WeakPolarHBondContact CD2-O 3.47Å; E359-Y411 HydrophobicContact CB-CD2 3.88Å; E359-Y411 CarbonylContact O-C 3.53Å; E359-Y411 VanDerWaalsContact O-CA 3.28Å; E359-Y411 WeakPolarHBondContact O-CA 3.46Å; E359-Y411 WeakPolarHBondContact O-CD2 3.3Å; G361-Y411 WeakPolarHBondContact CA-OH 3.38Å; G361-Y411 PolarHBondContact N-OH 2.86Å; G361-Y411 PolarHBondContact O-OH 3.43Å; V394-Y411 PolarHBondContact O-OH 3.5Å; R405-Y411 HydrophobicContact CB-CD1 4.11Å; R405-Y411 HydrophobicContact CG-CD1 3.76Å; R405-Y411 HydrophobicContact CG-CE1 4.36Å; R405-Y411 HydrophobicContact CG-CG 3.95Å; V406-Y411 HydrophobicContact CG2-CD1 3.82Å; V406-Y411 HydrophobicContact CG2-CE1 4.33Å; S409-Y411 PolarHBondContact O-N 3.19Å; S409-Y411 WeakPolarHBondContact OG-CB 3.48Å; Y411-F413 HydrophobicContact CD1-CB 4.3Å; Y411-F413 HydrophobicContact CE1-CB 3.72Å; Y411-F413 HydrophobicContact CE1-CD2 4.05Å; Y411-F413 HydrophobicContact CE1-CG 4.12Å
412	A	95.1	Very high	93.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.7	175.3	0	0	0	0	0	110.2	I218 F220 I346 L352 I358 E359 Y360 G361	I218-A412 HydrophobicContact CG2-CB 3.9Å; F220-A412 HydrophobicContact CD2-CB 3.89Å; F220-A412 HydrophobicContact CE2-CB 4.43Å; I346-A412 HydrophobicContact CD1-CB 4.3Å; L352-A412 HydrophobicContact CD1-CB 4.16Å; L352-A412 HydrophobicContact CD2-CB 4.12Å; I358-A412 HydrophobicContact CG2-CB 4.12Å; E359-A412 PolarHBondContact O-N 3.22Å; Y360-A412 WeakPolarHBondContact CA-O 3.43Å; Y360-A412 VanDerWaalsContact CB-O 3.31Å; Y360-A412 WeakPolarHBondContact CB-O 3.38Å; G361-A412 PolarHBondContact N-O 2.91Å
413	F	96.1	Very high	93.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	121.2	-174.2	-173.2	-148.6	0	0	0	110.9	L219 G361 V363 V396 I399 V406 Y411 M415	L219-F413 HydrophobicContact CB-CB 4.37Å; L219-F413 PolarHBondContact N-O 3.46Å; L219-F413 PolarHBondContact O-N 3.13Å; G361-F413 WeakPolarHBondContact O-CD2 3.25Å; V363-F413 HydrophobicContact CG2-CE2 4.01Å; V363-F413 HydrophobicContact CG2-CZ 3.56Å; V396-F413 HydrophobicContact CG2-CD2 4.35Å; V396-F413 HydrophobicContact CG2-CE2 3.44Å; V396-F413 VanDerWaalsContact CG2-CE2 3.44Å; V396-F413 HydrophobicContact CG2-CZ 3.65Å; I399-F413 HydrophobicContact CG2-CE1 4.46Å; V406-F413 HydrophobicContact CG2-CB 3.4Å; V406-F413 VanDerWaalsContact CG2-CB 3.4Å; V406-F413 HydrophobicContact CG2-CG 4.44Å; Y411-F413 HydrophobicContact CD1-CB 4.3Å; Y411-F413 HydrophobicContact CE1-CB 3.72Å; Y411-F413 HydrophobicContact CE1-CD2 4.05Å; Y411-F413 HydrophobicContact CE1-CG 4.12Å; F413-M415 HydrophobicContact CD1-CE 3.12Å; F413-M415 HydrophobicContact CE1-CB 4.43Å; F413-M415 HydrophobicContact CE1-CE 3.3Å; F413-M415 HydrophobicContact CG-CE 4.19Å; F413-M415 HydrophobicContact CZ-CE 4.46Å
414	L	95.4	Very high	93	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	114.5	178	-64.7	98.1	0	0	0	109.7	I216 S217 Y360 G361 V362 F372 M383 I437	I216-L414 HydrophobicContact CG2-CB 4.16Å; I216-L414 HydrophobicContact CG2-CD2 4.38Å; S217-L414 WeakPolarHBondContact O-CA 3.25Å; Y360-L414 HydrophobicContact CD2-CD1 4.11Å; Y360-L414 HydrophobicContact CG-CD1 4.42Å; G361-L414 WeakPolarHBondContact O-CD1 3.31Å; G361-L414 PolarHBondContact O-N 3.25Å; V362-L414 HydrophobicContact CG1-CB 3.8Å; F372-L414 HydrophobicContact CE1-CD2 4.46Å; F372-L414 HydrophobicContact CE2-CD2 3.74Å; F372-L414 HydrophobicContact CZ-CD2 3.46Å; F372-L414 VanDerWaalsContact CZ-CD2 3.46Å; M383-L414 HydrophobicContact CE-CD1 4.5Å; M383-L414 HydrophobicContact CE-CD2 3.9Å; L414-I437 HydrophobicContact CD2-CD1 3.95Å
415	M	92.9	Very high	92.7	Very high	8 Å²	8	27 Å²	27	4%	0.039	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	178.5	-179.4	64.8	159.9	81.7	0	0	110.4	I216 S217 L219 I399 I403 F413 T419 I420	I216-M415 WeakPolarHBondContact CA-O 3.28Å; S217-M415 PolarHBondContact N-O 3.01Å; S217-M415 PolarHBondContact O-N 2.98Å; S217-M415 VanDerWaalsContact O-N 3.16Å; S217-M415 VanDerWaalsContact O-O 3.13Å; L219-M415 HydrophobicContact CB-CE 4.08Å; L219-M415 HydrophobicContact CD2-CE 3.43Å; L219-M415 VanDerWaalsContact CD2-CE 3.43Å; L219-M415 HydrophobicContact CG-CE 4.31Å; I399-M415 HydrophobicContact CG2-CE 4.37Å; I403-M415 HydrophobicContact CG1-CE 4.02Å; F413-M415 HydrophobicContact CD1-CE 3.12Å; F413-M415 HydrophobicContact CE1-CB 4.43Å; F413-M415 HydrophobicContact CE1-CE 3.3Å; F413-M415 HydrophobicContact CG-CE 4.19Å; F413-M415 HydrophobicContact CZ-CE 4.46Å; M415-T419 HydrophobicContact SD-CG2 3.88Å; M415-I420 HydrophobicContact CG-CD1 3.66Å; M415-I420 HydrophobicContact CG-CG1 3.28Å; M415-I420 HydrophobicContact SD-CB 4.38Å; M415-I420 HydrophobicContact SD-CD1 4.37Å; M415-I420 HydrophobicContact SD-CG1 3.37Å; M415-I420 WeakPolarHBondContact SD-CG1 3.25Å
416	E	92.3	Very high	92.4	Very high	30 Å²	30	29.8 Å²	29.8	14%	0.14	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	138.3	178.5	-71.3	166.3	148	0	0	111.4	L214 G215 T418 T419 I420 Y442	L214-E416 HydrophobicContact CD1-CB 3.66Å; L214-E416 HydrophobicContact CD1-CG 3.57Å; G215-E416 CarbonylContact O-C 3.55Å; E416-T418 PolarHBondContact O-N 3Å; E416-T419 WeakPolarHBondContact O-CB 3.43Å; E416-T419 PolarHBondContact O-N 2.98Å; E416-I420 PolarHBondContact O-N 3.5Å; E416-I420 VanDerWaalsContact O-N 3.08Å; E416-Y442 PolarHBondContact OE2-OH 2.96Å
417	S	94.3	Very high	92.1	Very high	12 Å²	12	31.8 Å²	31.8	8%	0.084	17%	0.166	C	C	.	.	H	α-helix	trans	-60.6	-32.3	-172.6	60.8	0	0	0	0	113.4	G215 T419 I420 E421 L436	G215-S417 PolarHBondContact N-OG 2.89Å; G215-S417 WeakPolarHBondContact O-CB 3.49Å; G215-S417 PolarHBondContact O-N 2.95Å; G215-S417 PolarHBondContact O-OG 3.34Å; S417-T419 VanDerWaalsContact C-N 3.33Å; S417-I420 PolarHBondContact O-N 3.1Å; S417-E421 WeakPolarHBondContact O-CB 3.49Å; S417-E421 PolarHBondContact O-N 2.87Å; S417-L436 WeakPolarHBondContact OG-CD2 3.47Å
418	T	92.8	Very high	91.9	Very high	2 Å²	2	31 Å²	31	1%	0.012	17%	0.166	C	C	.	.	H	α-helix	trans	-66	-38.8	176.8	49.2	0	0	0	0	111.3	Y121 M212 L214 E416 F422 W477	Y121-T418 WeakPolarHBondContact OH-CB 3.19Å; Y121-T418 PolarHBondContact OH-OG1 3.3Å; M212-T418 HydrophobicContact CG-CG2 4.23Å; M212-T418 HydrophobicContact SD-CG2 3.62Å; L214-T418 HydrophobicContact CB-CG2 3.77Å; E416-T418 PolarHBondContact O-N 3Å; T418-F422 WeakPolarHBondContact O-CB 3.42Å; T418-F422 PolarHBondContact O-N 3.49Å; T418-F422 VanDerWaalsContact O-N 3.08Å; T418-W477 PolarHBondContact O-NE1 3.29Å
419	T	91.7	Very high	91.8	Very high	9 Å²	9	31.6 Å²	31.6	6%	0.055	17%	0.165	C	C	.	.	H	α-helix	trans	-69.8	-39.5	175.8	-49.2	0	0	0	0	110.6	I399 M415 E416 S417 F422 V423	I399-T419 HydrophobicContact CD1-CG2 4.48Å; I399-T419 HydrophobicContact CG2-CG2 4.12Å; M415-T419 HydrophobicContact SD-CG2 3.88Å; E416-T419 WeakPolarHBondContact O-CB 3.43Å; E416-T419 PolarHBondContact O-N 2.98Å; S417-T419 VanDerWaalsContact C-N 3.33Å; T419-F422 WeakPolarHBondContact O-CB 3.39Å; T419-F422 PolarHBondContact O-N 3.46Å; T419-V423 WeakPolarHBondContact O-CB 3.48Å; T419-V423 VanDerWaalsContact O-CG2 3.23Å; T419-V423 WeakPolarHBondContact O-CG2 3.48Å; T419-V423 PolarHBondContact O-N 3.46Å
420	I	93.5	Very high	91.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-58.5	-53.5	172.9	-63.8	-179.9	0	0	0	110.6	S217 L219 M415 E416 S417 F422 V423 T424 Q432	S217-I420 VanDerWaalsContact C-CD1 3.5Å; L219-I420 HydrophobicContact CB-CD1 4.14Å; L219-I420 HydrophobicContact CB-CG1 4.16Å; L219-I420 HydrophobicContact CD1-CG1 4.41Å; L219-I420 HydrophobicContact CD1-CG2 3.85Å; M415-I420 HydrophobicContact CG-CD1 3.66Å; M415-I420 HydrophobicContact CG-CG1 3.28Å; M415-I420 HydrophobicContact SD-CB 4.38Å; M415-I420 HydrophobicContact SD-CD1 4.37Å; M415-I420 HydrophobicContact SD-CG1 3.37Å; M415-I420 WeakPolarHBondContact SD-CG1 3.25Å; E416-I420 PolarHBondContact O-N 3.5Å; E416-I420 VanDerWaalsContact O-N 3.08Å; S417-I420 PolarHBondContact O-N 3.1Å; I420-F422 PolarHBondContact O-N 3.39Å; I420-V423 PolarHBondContact O-N 3.08Å; I420-V423 VanDerWaalsContact O-N 3.08Å; I420-T424 HydrophobicContact CG2-CG2 3.9Å; I420-T424 WeakPolarHBondContact O-CG2 3.44Å; I420-T424 PolarHBondContact O-N 2.98Å; I420-T424 PolarHBondContact O-OG1 3.35Å; I420-Q432 HydrophobicContact CG2-CB 3.61Å; I420-Q432 HydrophobicContact CG2-CG 3.89Å
421	E	92.1	Very high	91.8	Very high	58 Å²	58	27.6 Å²	27.6	27%	0.271	14%	0.141	S	C	.	.	H	α-helix	trans	-53	-45.3	180	-172.8	-176	167.9	0	0	110.9	S417 T424 Q425 K473	S417-E421 WeakPolarHBondContact O-CB 3.49Å; S417-E421 PolarHBondContact O-N 2.87Å; E421-T424 PolarHBondContact O-OG1 2.96Å; E421-T424 VanDerWaalsContact O-OG1 3.1Å; E421-Q425 VanDerWaalsContact O-CG 3.31Å; E421-Q425 WeakPolarHBondContact O-CG 3.41Å; E421-Q425 PolarHBondContact O-N 3.3Å; E421-K473 IonicContact OE1-NZ 3.73Å; E421-K473 PolarHBondContact OE1-NZ 3.5Å; E421-K473 WeakPolarHBondContact OE2-CE 3.3Å; E421-K473 IonicContact OE2-NZ 2.87Å; E421-K473 PolarHBondContact OE2-NZ 2.95Å
422	F	91.6	Very high	91.7	Very high	14 Å²	14	31.3 Å²	31.3	6%	0.061	16%	0.159	C	C	.	.	H	α-helix	trans	-61.6	-44.6	178.1	178.5	-104	0	0	0	113.4	E119 P120 T418 T419 I420 R426	E119-F422 HydrophobicContact CB-CE1 4.1Å; E119-F422 HydrophobicContact CB-CZ 4.14Å; P120-F422 HydrophobicContact CB-CD2 3.96Å; P120-F422 HydrophobicContact CB-CE2 3.37Å; P120-F422 HydrophobicContact CB-CZ 3.9Å; P120-F422 HydrophobicContact CG-CD2 3.45Å; P120-F422 VanDerWaalsContact CG-CD2 3.45Å; P120-F422 HydrophobicContact CG-CE2 3.44Å; P120-F422 VanDerWaalsContact CG-CE2 3.44Å; P120-F422 HydrophobicContact CG-CG 4.18Å; P120-F422 HydrophobicContact CG-CZ 4.19Å; T418-F422 WeakPolarHBondContact O-CB 3.42Å; T418-F422 PolarHBondContact O-N 3.49Å; T418-F422 VanDerWaalsContact O-N 3.08Å; T419-F422 WeakPolarHBondContact O-CB 3.39Å; T419-F422 PolarHBondContact O-N 3.46Å; I420-F422 PolarHBondContact O-N 3.39Å; F422-R426 PolarHBondContact O-NH1 3.34Å
423	V	91.5	Very high	91.5	Very high	17 Å²	17	32 Å²	32	10%	0.103	16%	0.162	C	C	.	.	H	α-helix	trans	-73	-42.8	-177.8	172.4	0	0	0	0	110.9	I403 T419 I420 Q425 R426 N427 L430	I403-V423 HydrophobicContact CD1-CG1 4.08Å; I403-V423 HydrophobicContact CD1-CG2 3.63Å; I403-V423 HydrophobicContact CG1-CG1 4.38Å; I403-V423 HydrophobicContact CG2-CG1 4.21Å; T419-V423 WeakPolarHBondContact O-CB 3.48Å; T419-V423 VanDerWaalsContact O-CG2 3.23Å; T419-V423 WeakPolarHBondContact O-CG2 3.48Å; T419-V423 PolarHBondContact O-N 3.46Å; I420-V423 PolarHBondContact O-N 3.08Å; I420-V423 VanDerWaalsContact O-N 3.08Å; V423-Q425 VanDerWaalsContact C-N 3.29Å; V423-Q425 PolarHBondContact O-N 3.01Å; V423-R426 PolarHBondContact O-N 3.11Å; V423-R426 VanDerWaalsContact O-N 3.08Å; V423-N427 PolarHBondContact O-N 3.45Å; V423-L430 HydrophobicContact CG1-CD1 3.48Å; V423-L430 VanDerWaalsContact CG1-CD1 3.48Å
424	T	90.6	Very high	91.1	Very high	30 Å²	30	33.8 Å²	33.8	18%	0.184	18%	0.181	C	C	.	.	H	α-helix	trans	-66.1	-30.1	-179.6	52.7	0	0	0	0	112.8	L219 I420 E421 R426 L430 C482	L219-T424 HydrophobicContact CD1-CG2 3.99Å; I420-T424 HydrophobicContact CG2-CG2 3.9Å; I420-T424 WeakPolarHBondContact O-CG2 3.44Å; I420-T424 PolarHBondContact O-N 2.98Å; I420-T424 PolarHBondContact O-OG1 3.35Å; E421-T424 PolarHBondContact O-OG1 2.96Å; E421-T424 VanDerWaalsContact O-OG1 3.1Å; T424-R426 PolarHBondContact O-N 3.02Å; T424-L430 HydrophobicContact CG2-CB 4.18Å; T424-C482 PolarHBondContact O-SG 2.98Å
425	Q	87.8	Confident	90.8	Very high	54 Å²	54	36.3 Å²	36.3	25%	0.252	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-17	174.6	-73.7	-172.1	19	0	0	113.7	E421 V423 W477 C482	E421-Q425 VanDerWaalsContact O-CG 3.31Å; E421-Q425 WeakPolarHBondContact O-CG 3.41Å; E421-Q425 PolarHBondContact O-N 3.3Å; V423-Q425 VanDerWaalsContact C-N 3.29Å; V423-Q425 PolarHBondContact O-N 3.01Å; Q425-W477 PolarHBondContact OE1-O 2.78Å; Q425-C482 PolarHBondContact O-N 3.46Å
426	R	88.5	Confident	90.8	Very high	112 Å²	112	40.6 Å²	40.6	42%	0.423	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-29.3	178.1	-73	169.6	175.8	64.7	4.8	112.7	F422 V423 T424 W477	F422-R426 PolarHBondContact O-NH1 3.34Å; V423-R426 PolarHBondContact O-N 3.11Å; V423-R426 VanDerWaalsContact O-N 3.08Å; T424-R426 PolarHBondContact O-N 3.02Å; R426-W477 PolarHBondContact NH1-O 3.21Å
427	N	88.6	Confident	90.8	Very high	43 Å²	43	40.3 Å²	40.3	23%	0.23	23%	0.229	C	C	.	.			trans	-127.2	104.1	-177.8	-171.6	-12.9	0	0	0	110.8	L407 V423 N429 L430	L407-N427 WeakPolarHBondContact CD1-ND2 3.38Å; V423-N427 PolarHBondContact O-N 3.45Å; N427-N429 PolarHBondContact O-N 2.94Å; N427-N429 WeakPolarHBondContact OD1-CB 3.39Å; N427-N429 PolarHBondContact OD1-N 3.49Å; N427-L430 HydrophobicContact CB-CD1 4.07Å; N427-L430 PolarHBondContact O-N 3.48Å
428	C	87.8	Confident	90.6	Very high	49 Å²	49	40.9 Å²	40.9	33%	0.331	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-7.5	-172.6	-33.6	0	0	0	0	113.5	K222 L430 C482	K222-C428 WeakPolarHBondContact CD-O 3.41Å; C428-L430 PolarHBondContact O-N 2.85Å; C428-C482 WeakPolarHBondContact CA-SG 3.36Å; C428-C482 HydrophobicContact CB-CB 4.07Å; C428-C482 WeakPolarHBondContact CB-SG 3.15Å; C428-C482 PolarHBondContact N-SG 3.48Å; C428-C482 WeakPolarHBondContact SG-CA 3.37Å; C428-C482 WeakPolarHBondContact SG-CB 3.34Å; C428-C482 CovalentContact SG-SG 2.04Å; C428-C482 PolarHBondContact SG-SG 3Å
429	N	89.6	Confident	90.5	Very high	104 Å²	104	46.3 Å²	46.3	56%	0.556	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	0.1	172.7	-63.4	-25.5	0	0	0	112.1	R221 K222 L407 N427	R221-N429 CarbonylContact C-O 3.54Å; R221-N429 WeakPolarHBondContact CA-O 3.49Å; K222-N429 PolarHBondContact N-O 3.36Å; L407-N429 HydrophobicContact CD2-CB 3.97Å; N427-N429 PolarHBondContact O-N 2.94Å; N427-N429 WeakPolarHBondContact OD1-CB 3.39Å; N427-N429 PolarHBondContact OD1-N 3.49Å
430	L	91.3	Very high	90.3	Very high	5 Å²	5	47 Å²	47	3%	0.026	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	147.9	179.4	-63.8	170.9	0	0	0	110	L219 F220 I403 V406 L407 V423 T424 N427 C428	L219-L430 HydrophobicContact CD1-CB 4Å; L219-L430 HydrophobicContact CD1-CD1 4.42Å; L219-L430 HydrophobicContact CD2-CD1 4.26Å; L219-L430 HydrophobicContact CD2-CD2 4.41Å; L219-L430 HydrophobicContact CG-CD2 4.39Å; F220-L430 WeakPolarHBondContact O-CA 3.22Å; I403-L430 HydrophobicContact CG2-CD1 3.91Å; V406-L430 HydrophobicContact CB-CD2 4.23Å; V406-L430 HydrophobicContact CG1-CD2 3.54Å; L407-L430 HydrophobicContact CD2-CD1 4.28Å; L407-L430 HydrophobicContact CD2-CD2 3.67Å; L407-L430 HydrophobicContact CD2-CG 3.82Å; L407-L430 HydrophobicContact CG-CD1 4.49Å; L407-L430 HydrophobicContact CG-CD2 4.03Å; L407-L430 HydrophobicContact CG-CG 4.43Å; V423-L430 HydrophobicContact CG1-CD1 3.48Å; V423-L430 VanDerWaalsContact CG1-CD1 3.48Å; T424-L430 HydrophobicContact CG2-CB 4.18Å; N427-L430 HydrophobicContact CB-CD1 4.07Å; N427-L430 PolarHBondContact O-N 3.48Å; C428-L430 PolarHBondContact O-N 2.85Å
431	T	90.6	Very high	90.3	Very high	31 Å²	31	47.7 Å²	47.7	19%	0.19	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	143.5	178.6	45.3	0	0	0	0	110.1	F220 K222	F220-T431 PolarHBondContact N-O 3.4Å; F220-T431 PolarHBondContact O-N 3.21Å; F220-T431 VanDerWaalsContact O-O 3.1Å; F220-T431 PolarHBondContact O-OG1 3.16Å; K222-T431 HydrophobicContact CB-CG2 3.71Å; K222-T431 HydrophobicContact CD-CG2 3.79Å; K222-T431 HydrophobicContact CG-CG2 3.59Å
432	Q	92.3	Very high	90.5	Very high	78 Å²	78	45 Å²	45	36%	0.364	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	130.9	165.6	-172.5	178.6	-39.6	0	0	109.4	S217 I218 I420 G434	S217-Q432 VanDerWaalsContact OG-CD 3.28Å; S217-Q432 WeakPolarHBondContact OG-CG 3.22Å; S217-Q432 PolarHBondContact OG-NE2 3.02Å; I218-Q432 WeakPolarHBondContact O-CA 3.38Å; I420-Q432 HydrophobicContact CG2-CB 3.61Å; I420-Q432 HydrophobicContact CG2-CG 3.89Å; Q432-G434 PolarHBondContact NE2-O 3.43Å
433	I	90.8	Very high	90.7	Very high	14 Å²	14	44.3 Å²	44.3	7%	0.072	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	133.8	174.1	-59.2	-58	0	0	0	109.8	I218 F220 I346	I218-I433 HydrophobicContact CB-CB 4.24Å; I218-I433 HydrophobicContact CG2-CB 4.31Å; I218-I433 PolarHBondContact O-N 3.5Å; F220-I433 HydrophobicContact CB-CG1 3.75Å; I346-I433 HydrophobicContact CB-CG2 4.48Å; I346-I433 HydrophobicContact CD1-CG1 4.39Å; I346-I433 HydrophobicContact CD1-CG2 4.3Å; I346-I433 HydrophobicContact CG1-CG1 4.4Å; I346-I433 HydrophobicContact CG1-CG2 4.09Å; I346-I433 WeakPolarHBondContact O-CG2 3.22Å
434	G	87.8	Confident	91	Very high	38 Å²	38	43.5 Å²	43.5	39%	0.392	26%	0.256	S	S	.	.	S	Bend	trans	71.3	-175.3	176.9	0	0	0	0	0	114.6	D347 Q432	D347-G434 WeakPolarHBondContact O-CA 2.96Å; D347-G434 PolarHBondContact O-N 3.41Å; Q432-G434 PolarHBondContact NE2-O 3.43Å
435	G	89.6	Confident	91.2	Very high	55 Å²	55	42 Å²	42	57%	0.567	25%	0.248	S	C	*	.	S	Bend	trans	-89.4	-169.7	176	0	0	0	0	0	113.2	I437	G435-I437 PolarHBondContact O-N 3.07Å
436	L	92	Very high	91.7	Very high	97 Å²	97	39.5 Å²	39.5	51%	0.508	24%	0.236	S	C	.	.			trans	-73.6	124.3	173.2	-55.6	177.7	0	0	0	110	S417 D438	S417-L436 WeakPolarHBondContact OG-CD2 3.47Å; L436-D438 WeakPolarHBondContact CB-O 3.32Å
437	I	92.3	Very high	92	Very high	24 Å²	24	34.5 Å²	34.5	12%	0.123	22%	0.218	C	C	.	.	S	Bend	trans	-71.2	-35	177.7	-69.4	173.8	0	0	0	111	I216 I218 A349 F371 Y380 L414 G435	I216-I437 HydrophobicContact CB-CB 4.17Å; I216-I437 HydrophobicContact CG2-CD1 4.09Å; I216-I437 WeakPolarHBondContact O-CB 3.27Å; I216-I437 PolarHBondContact O-N 3.23Å; I218-I437 HydrophobicContact CG1-CD1 4.3Å; A349-I437 HydrophobicContact CB-CD1 3.97Å; A349-I437 HydrophobicContact CB-CG1 4.27Å; F371-I437 HydrophobicContact CE1-CG2 4.16Å; F371-I437 HydrophobicContact CZ-CG2 4.43Å; Y380-I437 HydrophobicContact CD1-CG2 4.48Å; Y380-I437 HydrophobicContact CD2-CG2 4.49Å; Y380-I437 HydrophobicContact CE1-CG2 3.87Å; Y380-I437 HydrophobicContact CE2-CG2 3.88Å; L414-I437 HydrophobicContact CD2-CD1 3.95Å; G435-I437 PolarHBondContact O-N 3.07Å
438	D	90.8	Very high	92.2	Very high	24 Å²	24	38.4 Å²	38.4	13%	0.128	24%	0.236	C	C	.	.	S	Bend	trans	-134.4	173.2	176	70.3	-5.6	0	0	0	111.2	G215 I216 F371 L436 K440	G215-D438 WeakPolarHBondContact CA-O 3.29Å; G215-D438 WeakPolarHBondContact CA-OD1 3.5Å; I216-D438 VanDerWaalsContact CD1-OD2 3.29Å; I216-D438 WeakPolarHBondContact CD1-OD2 3.31Å; I216-D438 WeakPolarHBondContact CG1-OD1 3.35Å; I216-D438 PolarHBondContact N-OD1 2.76Å; F371-D438 HydrophobicContact CE2-CB 3.94Å; F371-D438 HydrophobicContact CZ-CB 3.98Å; L436-D438 WeakPolarHBondContact CB-O 3.32Å; D438-K440 WeakPolarHBondContact OD2-CD 3.41Å; D438-K440 WeakPolarHBondContact OD2-CE 3.42Å; D438-K440 IonicContact OD2-NZ 3.48Å; D438-K440 PolarHBondContact OD2-NZ 3.31Å
439	S	89.1	Confident	92.3	Very high	116 Å²	116	39 Å²	39	81%	0.811	25%	0.251	S	S	*	.			trans	-116.3	107.3	172.9	-172.2	0	0	0	0	108.5
440	K	89.3	Confident	92.3	Very high	25 Å²	25	34.9 Å²	34.9	11%	0.109	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	169	177.6	-79.3	175.5	173	142.5	0	110	L214 D438	L214-K440 HydrophobicContact CG-CB 4.33Å; L214-K440 PolarHBondContact N-O 3.43Å; L214-K440 CarbonylContact O-C 3.42Å; L214-K440 WeakPolarHBondContact O-CA 3.5Å; L214-K440 PolarHBondContact O-N 2.91Å; D438-K440 WeakPolarHBondContact OD2-CD 3.41Å; D438-K440 WeakPolarHBondContact OD2-CE 3.42Å; D438-K440 IonicContact OD2-NZ 3.48Å; D438-K440 PolarHBondContact OD2-NZ 3.31Å
441	A	93.6	Very high	92	Very high	14 Å²	14	39 Å²	39	12%	0.116	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	151.9	173.4	0	0	0	0	0	111.5	I197 P210 M212 T213	I197-A441 HydrophobicContact CD1-CB 4.48Å; I197-A441 PolarHBondContact N-O 3.42Å; P210-A441 HydrophobicContact CB-CB 3.35Å; P210-A441 HydrophobicContact CG-CB 4.11Å; M212-A441 CarbonylContact O-C 3.53Å; M212-A441 VanDerWaalsContact O-CA 3.25Å; M212-A441 WeakPolarHBondContact O-CA 3.49Å; M212-A441 WeakPolarHBondContact O-CB 3.19Å; T213-A441 HydrophobicContact CG2-CB 4.34Å
442	Y	95.3	Very high	91.9	Very high	0 Å²	0	39 Å²	39	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	136.1	167.5	-61.3	-34.3	0	0	0	110.3	Y121 P194 A196 P210 F211 M212 L214 E416	Y121-Y442 HydrophobicContact CE1-CD2 4.27Å; Y121-Y442 HydrophobicContact CE1-CE2 4.01Å; Y121-Y442 AromaticContact CZ-CE2 3.83Å; Y121-Y442 WeakPolarHBondContact OH-CE2 3.36Å; P194-Y442 VanDerWaalsContact C-CD1 3.48Å; P194-Y442 HydrophobicContact CB-CD1 4.38Å; P194-Y442 HydrophobicContact CB-CD2 3.89Å; P194-Y442 HydrophobicContact CB-CE1 4.09Å; P194-Y442 HydrophobicContact CB-CE2 3.54Å; P194-Y442 HydrophobicContact CB-CG 4.31Å; P194-Y442 VanDerWaalsContact O-CE1 3.31Å; P194-Y442 WeakPolarHBondContact O-CE1 3.4Å; A196-Y442 HydrophobicContact CB-CD1 4.33Å; A196-Y442 HydrophobicContact CB-CE1 4.21Å; P210-Y442 CarbonylContact C-O 3.59Å; P210-Y442 WeakPolarHBondContact CA-O 3.32Å; P210-Y442 WeakPolarHBondContact CB-O 3.45Å; F211-Y442 WeakPolarHBondContact CD1-O 3.24Å; F211-Y442 HydrophobicContact CZ-CD2 4.46Å; F211-Y442 HydrophobicContact CZ-CG 4.34Å; F211-Y442 PolarHBondContact N-O 3.43Å; M212-Y442 HydrophobicContact CB-CD2 4.42Å; M212-Y442 PolarHBondContact O-N 2.93Å; M212-Y442 HydrophobicContact SD-CD2 4.27Å; L214-Y442 HydrophobicContact CD1-CE1 3.88Å; L214-Y442 HydrophobicContact CD1-CE2 4.26Å; L214-Y442 HydrophobicContact CD2-CD1 3.67Å; L214-Y442 HydrophobicContact CD2-CD2 3.49Å; L214-Y442 VanDerWaalsContact CD2-CD2 3.49Å; L214-Y442 HydrophobicContact CD2-CE1 3.67Å; L214-Y442 HydrophobicContact CD2-CE2 3.5Å; L214-Y442 HydrophobicContact CD2-CG 3.57Å; L214-Y442 HydrophobicContact CG-CE1 4.42Å; E416-Y442 PolarHBondContact OE2-OH 2.96Å
443	G	95.6	Very high	91.9	Very high	0 Å²	0	39 Å²	39	0%	0	25%	0.25	C	C	.	.			trans	-133.1	161.9	175.8	0	0	0	0	0	110.4	L195	L195-G443 PolarHBondContact O-N 2.88Å
444	V	97.2	Very high	91.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	27%	0.268	C	S	.	.			trans	-80.7	124.8	172.6	179.6	0	0	0	0	107.9	L148 L190 A191 V192 F207 S208 F211 I456 I460	L148-V444 HydrophobicContact CD1-CG2 4.48Å; L190-V444 HydrophobicContact CD1-CG1 3.37Å; L190-V444 HydrophobicContact CD2-CG1 4.06Å; L190-V444 HydrophobicContact CG-CG1 3.67Å; A191-V444 WeakPolarHBondContact O-CG1 3.35Å; V192-V444 HydrophobicContact CG2-CG1 3.96Å; V192-V444 HydrophobicContact CG2-CG2 4.43Å; F207-V444 WeakPolarHBondContact CA-O 3.11Å; S208-V444 PolarHBondContact N-O 3.5Å; S208-V444 WeakPolarHBondContact OG-CB 3.37Å; S208-V444 PolarHBondContact OG-N 3.49Å; F211-V444 HydrophobicContact CD1-CG2 4.17Å; F211-V444 HydrophobicContact CE1-CG2 4.37Å; V444-I456 HydrophobicContact CB-CG2 4.07Å; V444-I456 HydrophobicContact CG1-CD1 4.49Å; V444-I456 HydrophobicContact CG1-CG2 4.16Å; V444-I456 HydrophobicContact CG2-CG2 4.24Å; V444-I460 HydrophobicContact CB-CD1 4.5Å; V444-I460 HydrophobicContact CG2-CD1 3.87Å
445	G	96.5	Very high	92.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	138.3	178.7	0	0	0	0	0	111.4	A191	A191-G445 PolarHBondContact N-O 3.48Å; A191-G445 PolarHBondContact O-N 3.46Å
446	T	96.7	Very high	92.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	151.9	176.7	52.6	0	0	0	0	110.2	L190 D206 R453 I456	L190-T446 HydrophobicContact CD1-CG2 3.51Å; D206-T446 WeakPolarHBondContact CB-OG1 3.25Å; D206-T446 PolarHBondContact N-O 2.92Å; D206-T446 PolarHBondContact O-N 3.37Å; D206-T446 VanDerWaalsContact O-O 3.1Å; D206-T446 PolarHBondContact O-OG1 3.41Å; T446-R453 HydrophobicContact CG2-CB 4.44Å; T446-I456 HydrophobicContact CG2-CD1 4.48Å
447	P	95.9	Very high	92.5	Very high	7 Å²	7	37.3 Å²	37.3	5%	0.045	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	148.3	169.8	-23.2	34.6	0	0	0	111.1	L183 H186 D189 G449 S450	L183-P447 HydrophobicContact CD2-CG 4.3Å; H186-P447 VanDerWaalsContact CE1-CB 3.44Å; H186-P447 WeakPolarHBondContact CE1-CB 3.33Å; H186-P447 WeakPolarHBondContact ND1-CB 3.22Å; D189-P447 WeakPolarHBondContact O-CD 3.26Å; P447-G449 PolarHBondContact O-N 3.43Å; P447-S450 WeakPolarHBondContact O-CB 3.41Å; P447-S450 PolarHBondContact O-N 3.03Å
448	M	93.3	Very high	92.6	Very high	126 Å²	126	41.6 Å²	41.6	62%	0.621	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	129.7	-176.1	-166.8	176.2	-168.7	0	0	111.4	S450	M448-S450 VanDerWaalsContact C-N 3.27Å; M448-S450 PolarHBondContact O-N 3.38Å
449	G	88.4	Confident	92.8	Very high	62 Å²	62	40.5 Å²	40.5	64%	0.639	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	74	13.7	-178.2	0	0	0	0	0	114.7	D206 P447	D206-G449 PolarHBondContact OD2-N 3.48Å; P447-G449 PolarHBondContact O-N 3.43Å
450	S	89.1	Confident	93.2	Very high	16 Å²	16	35.1 Å²	35.1	11%	0.112	20%	0.196	C	C	.	.			trans	-63	132.6	179.6	175.6	0	0	0	0	112.1	P447 M448 Y452 R453	P447-S450 WeakPolarHBondContact O-CB 3.41Å; P447-S450 PolarHBondContact O-N 3.03Å; M448-S450 VanDerWaalsContact C-N 3.27Å; M448-S450 PolarHBondContact O-N 3.38Å; S450-Y452 PolarHBondContact O-N 3.4Å; S450-Y452 VanDerWaalsContact O-N 3.13Å; S450-Y452 VanDerWaalsContact OG-CD2 3.28Å; S450-Y452 WeakPolarHBondContact OG-CD2 3.26Å; S450-Y452 PolarHBondContact OG-N 2.99Å; S450-R453 PolarHBondContact O-N 3.12Å
451	P	86.4	Confident	93.5	Very high	91 Å²	91	37.9 Å²	37.9	59%	0.591	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-7.7	175.9	31	-36.3	0	0	0	113.1
452	Y	88.2	Confident	93.7	Very high	32 Å²	32	40.8 Å²	40.8	13%	0.125	22%	0.223	C	C	.	.	H	α-helix	trans	-83	-26.2	-179.3	-51.9	-41	0	0	0	113	L106 R109 L111 S450 D454 K455 I456	L106-Y452 HydrophobicContact CD1-CD1 4.44Å; L106-Y452 HydrophobicContact CD2-CD1 3.66Å; L106-Y452 HydrophobicContact CD2-CE1 3.67Å; L106-Y452 HydrophobicContact CD2-CG 4.46Å; L106-Y452 HydrophobicContact CG-CD1 4.3Å; R109-Y452 PolarHBondContact NH1-OH 3.37Å; L111-Y452 HydrophobicContact CD2-CD2 4.43Å; L111-Y452 HydrophobicContact CD2-CE2 3.84Å; S450-Y452 PolarHBondContact O-N 3.4Å; S450-Y452 VanDerWaalsContact O-N 3.13Å; S450-Y452 VanDerWaalsContact OG-CD2 3.28Å; S450-Y452 WeakPolarHBondContact OG-CD2 3.26Å; S450-Y452 PolarHBondContact OG-N 2.99Å; Y452-D454 VanDerWaalsContact C-N 3.34Å; Y452-D454 PolarHBondContact O-N 3.17Å; Y452-K455 PolarHBondContact O-N 3.47Å; Y452-I456 WeakPolarHBondContact O-CB 3.19Å; Y452-I456 VanDerWaalsContact O-CG1 3.31Å; Y452-I456 WeakPolarHBondContact O-CG1 3.36Å; Y452-I456 PolarHBondContact O-N 3.02Å
453	R	92.5	Very high	93.7	Very high	77 Å²	77	40.8 Å²	40.8	29%	0.291	22%	0.223	S	C	.	.	H	α-helix	trans	-53.4	-47.9	-175	-176.6	-159.4	68.1	-155.8	-2.3	112.8	D206 T446 S450 I456 T457	D206-R453 IonicContact OD2-NH1 3.24Å; D206-R453 PolarHBondContact OD2-NH1 3.48Å; T446-R453 HydrophobicContact CG2-CB 4.44Å; S450-R453 PolarHBondContact O-N 3.12Å; R453-I456 PolarHBondContact O-N 3.46Å; R453-T457 VanDerWaalsContact O-CB 3.27Å; R453-T457 WeakPolarHBondContact O-CB 3.5Å; R453-T457 PolarHBondContact O-N 3.22Å; R453-T457 PolarHBondContact O-OG1 3.43Å
454	D	91.3	Very high	93.7	Very high	84 Å²	84	46.3 Å²	46.3	45%	0.449	25%	0.249	S	C	.	.	H	α-helix	trans	-70.9	-38.6	-174.8	-65.9	-18.4	0	0	0	111.5	Y452 T457 I458	Y452-D454 VanDerWaalsContact C-N 3.34Å; Y452-D454 PolarHBondContact O-N 3.17Å; D454-T457 WeakPolarHBondContact O-CB 3.39Å; D454-T457 PolarHBondContact O-N 3.29Å; D454-I458 VanDerWaalsContact O-CG1 3.29Å; D454-I458 WeakPolarHBondContact O-CG1 3.29Å; D454-I458 PolarHBondContact O-N 2.82Å
455	K	91.3	Very high	93.6	Very high	63 Å²	63	54.7 Å²	54.7	27%	0.274	29%	0.288	S	S	.	.	H	α-helix	trans	-65.2	-44	175.9	-65.3	-177.5	-178.1	168	0	111.7	D104 L106 L152 Y452 T457 I458 A459	D104-K455 PolarHBondContact O-NZ 3.21Å; L106-K455 HydrophobicContact CD1-CB 4.25Å; L106-K455 HydrophobicContact CD1-CD 3.86Å; L106-K455 HydrophobicContact CG-CD 4.39Å; L152-K455 HydrophobicContact CD1-CB 4.44Å; L152-K455 HydrophobicContact CD2-CB 4.05Å; Y452-K455 PolarHBondContact O-N 3.47Å; K455-T457 VanDerWaalsContact C-N 3.32Å; K455-I458 PolarHBondContact O-N 3.06Å; K455-A459 WeakPolarHBondContact O-CB 3.42Å; K455-A459 PolarHBondContact O-N 3.02Å
456	I	94.4	Very high	93.6	Very high	1 Å²	1	59 Å²	59	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-65.1	-40.6	176.5	-67.6	176.3	0	0	0	110.5	L148 L152 L190 V444 T446 Y452 R453 I458 A459 I460	L148-I456 HydrophobicContact CD1-CG2 4.45Å; L152-I456 HydrophobicContact CD1-CG1 3.91Å; L190-I456 HydrophobicContact CD1-CD1 3.29Å; L190-I456 HydrophobicContact CD2-CD1 3.88Å; L190-I456 HydrophobicContact CG-CD1 4.23Å; V444-I456 HydrophobicContact CB-CG2 4.07Å; V444-I456 HydrophobicContact CG1-CD1 4.49Å; V444-I456 HydrophobicContact CG1-CG2 4.16Å; V444-I456 HydrophobicContact CG2-CG2 4.24Å; T446-I456 HydrophobicContact CG2-CD1 4.48Å; Y452-I456 WeakPolarHBondContact O-CB 3.19Å; Y452-I456 VanDerWaalsContact O-CG1 3.31Å; Y452-I456 WeakPolarHBondContact O-CG1 3.36Å; Y452-I456 PolarHBondContact O-N 3.02Å; R453-I456 PolarHBondContact O-N 3.46Å; I456-I458 PolarHBondContact O-N 2.93Å; I456-A459 PolarHBondContact O-N 3.15Å; I456-I460 HydrophobicContact CG2-CD1 3.77Å; I456-I460 HydrophobicContact CG2-CG1 4.32Å; I456-I460 VanDerWaalsContact O-CG1 3.29Å; I456-I460 WeakPolarHBondContact O-CG1 3.16Å; I456-I460 PolarHBondContact O-N 3.31Å
457	T	95.2	Very high	93.5	Very high	21 Å²	21	60.3 Å²	60.3	13%	0.129	32%	0.322	C	S	.	.	H	α-helix	trans	-58.2	-47.8	174.7	-69.5	0	0	0	0	111.9	S208 K209 R453 D454 K455 I460 L461	S208-T457 WeakPolarHBondContact CA-OG1 2.95Å; K209-T457 HydrophobicContact CB-CG2 3.88Å; K209-T457 HydrophobicContact CG-CG2 3.34Å; K209-T457 PolarHBondContact N-OG1 2.73Å; R453-T457 VanDerWaalsContact O-CB 3.27Å; R453-T457 WeakPolarHBondContact O-CB 3.5Å; R453-T457 PolarHBondContact O-N 3.22Å; R453-T457 PolarHBondContact O-OG1 3.43Å; D454-T457 WeakPolarHBondContact O-CB 3.39Å; D454-T457 PolarHBondContact O-N 3.29Å; K455-T457 VanDerWaalsContact C-N 3.32Å; T457-I460 PolarHBondContact O-N 3.29Å; T457-L461 HydrophobicContact CG2-CD1 4.3Å; T457-L461 WeakPolarHBondContact O-CG 3.33Å; T457-L461 PolarHBondContact O-N 2.96Å
458	I	94.9	Very high	93.5	Very high	114 Å²	114	62.8 Å²	62.8	59%	0.585	33%	0.332	S	S	*	.	H	α-helix	trans	-63.7	-42.5	177.8	-66.4	163.4	0	0	0	110.7	D454 K455 I456 I460 L461 Q462	D454-I458 VanDerWaalsContact O-CG1 3.29Å; D454-I458 WeakPolarHBondContact O-CG1 3.29Å; D454-I458 PolarHBondContact O-N 2.82Å; K455-I458 PolarHBondContact O-N 3.06Å; I456-I458 PolarHBondContact O-N 2.93Å; I458-I460 PolarHBondContact O-N 2.8Å; I458-L461 PolarHBondContact O-N 3.2Å; I458-Q462 PolarHBondContact O-N 3.39Å
459	A	95.4	Very high	93.6	Very high	2 Å²	2	57 Å²	57	2%	0.017	30%	0.303	C	S	.	.	H	α-helix	trans	-64.2	-39.4	177.6	0	0	0	0	0	112.7	L148 I151 L152 K455 I456 L461 Q462 L463	L148-A459 HydrophobicContact CD2-CB 3.7Å; I151-A459 HydrophobicContact CG2-CB 4.13Å; L152-A459 HydrophobicContact CD1-CB 4.09Å; L152-A459 HydrophobicContact CD2-CB 4.25Å; L152-A459 HydrophobicContact CG-CB 4.14Å; K455-A459 WeakPolarHBondContact O-CB 3.42Å; K455-A459 PolarHBondContact O-N 3.02Å; I456-A459 PolarHBondContact O-N 3.15Å; A459-L461 VanDerWaalsContact C-N 3.35Å; A459-Q462 WeakPolarHBondContact O-CB 3.49Å; A459-Q462 PolarHBondContact O-N 3.21Å; A459-L463 WeakPolarHBondContact O-CG 3.38Å; A459-L463 PolarHBondContact O-N 3.21Å
460	I	96.9	Very high	93.9	Very high	2 Å²	2	60 Å²	60	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-63.3	-42.3	174.4	-71.1	168.9	0	0	0	110.8	L148 S208 F211 V444 I456 T457 I458 Q462 L463 Q464 L469	L148-I460 HydrophobicContact CD2-CG1 4.08Å; S208-I460 VanDerWaalsContact OG-CD1 3.23Å; S208-I460 WeakPolarHBondContact OG-CD1 2.9Å; F211-I460 HydrophobicContact CB-CD1 4.49Å; F211-I460 HydrophobicContact CB-CG2 3.95Å; V444-I460 HydrophobicContact CB-CD1 4.5Å; V444-I460 HydrophobicContact CG2-CD1 3.87Å; I456-I460 HydrophobicContact CG2-CD1 3.77Å; I456-I460 HydrophobicContact CG2-CG1 4.32Å; I456-I460 VanDerWaalsContact O-CG1 3.29Å; I456-I460 WeakPolarHBondContact O-CG1 3.16Å; I456-I460 PolarHBondContact O-N 3.31Å; T457-I460 PolarHBondContact O-N 3.29Å; I458-I460 PolarHBondContact O-N 2.8Å; I460-Q462 VanDerWaalsContact C-N 3.34Å; I460-Q462 PolarHBondContact O-N 3.06Å; I460-L463 PolarHBondContact O-N 3.27Å; I460-Q464 WeakPolarHBondContact O-CB 3.42Å; I460-Q464 PolarHBondContact O-N 3.39Å; I460-L469 HydrophobicContact CG2-CD1 4.25Å
461	L	96.1	Very high	94.2	Very high	83 Å²	83	64.8 Å²	64.8	44%	0.435	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-42	176.2	-69.6	171.7	0	0	0	111.4	T457 I458 A459 L463 Q464 E465	T457-L461 HydrophobicContact CG2-CD1 4.3Å; T457-L461 WeakPolarHBondContact O-CG 3.33Å; T457-L461 PolarHBondContact O-N 2.96Å; I458-L461 PolarHBondContact O-N 3.2Å; A459-L461 VanDerWaalsContact C-N 3.35Å; L461-L463 PolarHBondContact O-N 3.07Å; L461-Q464 WeakPolarHBondContact O-CB 3.36Å; L461-Q464 PolarHBondContact O-N 2.97Å; L461-E465 WeakPolarHBondContact O-CG 3.35Å; L461-E465 PolarHBondContact O-N 3.29Å
462	Q	96.3	Very high	94.6	Very high	76 Å²	76	61.3 Å²	61.3	36%	0.355	30%	0.298	S	S	.	.	H	α-helix	trans	-59.7	-46.4	173.6	-176.9	-176.9	-13.5	0	0	111.7	I458 A459 I460 Q464 E465 E466	I458-Q462 PolarHBondContact O-N 3.39Å; A459-Q462 WeakPolarHBondContact O-CB 3.49Å; A459-Q462 PolarHBondContact O-N 3.21Å; I460-Q462 VanDerWaalsContact C-N 3.34Å; I460-Q462 PolarHBondContact O-N 3.06Å; Q462-Q464 VanDerWaalsContact C-N 3.26Å; Q462-Q464 PolarHBondContact O-N 3.44Å; Q462-E465 PolarHBondContact O-N 2.86Å; Q462-E466 WeakPolarHBondContact CG-OE1 3.46Å; Q462-E466 PolarHBondContact NE2-OE1 3.35Å; Q462-E466 WeakPolarHBondContact O-CB 3.16Å; Q462-E466 WeakPolarHBondContact O-CG 3.42Å; Q462-E466 PolarHBondContact O-N 3.35Å
463	L	96.7	Very high	94.9	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-31.5	176.9	-69	175	0	0	0	112.9	L144 E147 L148 I151 A459 I460 L461 G467 K468 L469	L144-L463 HydrophobicContact CD1-CD1 3.83Å; E147-L463 HydrophobicContact CB-CD1 4.09Å; E147-L463 HydrophobicContact CB-CD2 4.02Å; E147-L463 HydrophobicContact CG-CD2 4.43Å; L148-L463 HydrophobicContact CD2-CD1 4.03Å; L148-L463 HydrophobicContact CG-CD1 4.43Å; I151-L463 HydrophobicContact CD1-CD1 4.42Å; I151-L463 HydrophobicContact CD1-CD2 3.65Å; I151-L463 HydrophobicContact CD1-CG 3.87Å; A459-L463 WeakPolarHBondContact O-CG 3.38Å; A459-L463 PolarHBondContact O-N 3.21Å; I460-L463 PolarHBondContact O-N 3.27Å; L461-L463 PolarHBondContact O-N 3.07Å; L463-G467 PolarHBondContact O-N 3.47Å; L463-K468 HydrophobicContact CB-CB 4.49Å; L463-K468 HydrophobicContact CD2-CB 3.96Å; L463-K468 HydrophobicContact CD2-CD 3.48Å; L463-K468 VanDerWaalsContact CD2-CD 3.48Å; L463-K468 HydrophobicContact CD2-CG 4.37Å; L463-K468 PolarHBondContact O-N 3.08Å; L463-L469 HydrophobicContact CB-CD1 4.31Å; L463-L469 HydrophobicContact CB-CD2 4.25Å; L463-L469 HydrophobicContact CB-CG 3.91Å; L463-L469 HydrophobicContact CD1-CD2 4.48Å; L463-L469 PolarHBondContact O-N 3.08Å
464	Q	95.6	Very high	94.8	Very high	115 Å²	115	63 Å²	63	54%	0.537	31%	0.31	S	S	.	.	H	α-helix	trans	-70.4	-45.9	174.7	-173.9	69.1	15.7	0	0	111.2	I460 L461 Q462 G467 L469	I460-Q464 WeakPolarHBondContact O-CB 3.42Å; I460-Q464 PolarHBondContact O-N 3.39Å; L461-Q464 WeakPolarHBondContact O-CB 3.36Å; L461-Q464 PolarHBondContact O-N 2.97Å; Q462-Q464 VanDerWaalsContact C-N 3.26Å; Q462-Q464 PolarHBondContact O-N 3.44Å; Q464-G467 PolarHBondContact O-N 3.3Å; Q464-G467 VanDerWaalsContact O-N 3.12Å; Q464-L469 HydrophobicContact CB-CD1 3.96Å
465	E	95.4	Very high	94.9	Very high	176 Å²	176	65.3 Å²	65.3	82%	0.822	32%	0.316	S	S	*	.	H	α-helix	trans	-65.1	-37.5	178.3	-74.1	-179.7	-179.3	0	0	112.4	L461 Q462 G467	L461-E465 WeakPolarHBondContact O-CG 3.35Å; L461-E465 PolarHBondContact O-N 3.29Å; Q462-E465 PolarHBondContact O-N 2.86Å; E465-G467 PolarHBondContact O-N 3.13Å
466	E	96.2	Very high	95	Very high	91 Å²	91	64 Å²	64	43%	0.425	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-7.8	174.2	-70	176.9	-166.1	0	0	113.2	Q462 K468	Q462-E466 WeakPolarHBondContact CG-OE1 3.46Å; Q462-E466 PolarHBondContact NE2-OE1 3.35Å; Q462-E466 WeakPolarHBondContact O-CB 3.16Å; Q462-E466 WeakPolarHBondContact O-CG 3.42Å; Q462-E466 PolarHBondContact O-N 3.35Å; E466-K468 HydrophobicContact CB-CD 4.48Å; E466-K468 HydrophobicContact CB-CG 4.23Å; E466-K468 PolarHBondContact O-N 3.45Å; E466-K468 WeakPolarHBondContact OE2-CD 3.24Å; E466-K468 WeakPolarHBondContact OE2-CE 3.46Å; E466-K468 IonicContact OE2-NZ 3.96Å; E466-K468 PolarHBondContact OE2-NZ 2.88Å
467	G	94.9	Very high	94.8	Very high	28 Å²	28	64 Å²	64	29%	0.289	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	7.2	-176.6	0	0	0	0	0	114.7	L463 Q464 E465 L469 H470 M471	L463-G467 PolarHBondContact O-N 3.47Å; Q464-G467 PolarHBondContact O-N 3.3Å; Q464-G467 VanDerWaalsContact O-N 3.12Å; E465-G467 PolarHBondContact O-N 3.13Å; G467-L469 VanDerWaalsContact C-N 3.33Å; G467-L469 PolarHBondContact O-N 3.13Å; G467-H470 PolarHBondContact O-N 3.41Å; G467-H470 VanDerWaalsContact O-N 3.16Å; G467-M471 PolarHBondContact O-N 3.17Å
468	K	95.9	Very high	94.2	Very high	58 Å²	58	69.7 Å²	69.7	25%	0.252	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-36.7	-179.7	-79	-179.6	173.5	177.8	0	113.1	E147 L463 E466 H470 M471 M472	E147-K468 IonicContact OE2-NZ 3.91Å; E147-K468 PolarHBondContact OE2-NZ 2.95Å; L463-K468 HydrophobicContact CB-CB 4.49Å; L463-K468 HydrophobicContact CD2-CB 3.96Å; L463-K468 HydrophobicContact CD2-CD 3.48Å; L463-K468 VanDerWaalsContact CD2-CD 3.48Å; L463-K468 HydrophobicContact CD2-CG 4.37Å; L463-K468 PolarHBondContact O-N 3.08Å; E466-K468 HydrophobicContact CB-CD 4.48Å; E466-K468 HydrophobicContact CB-CG 4.23Å; E466-K468 PolarHBondContact O-N 3.45Å; E466-K468 WeakPolarHBondContact OE2-CD 3.24Å; E466-K468 WeakPolarHBondContact OE2-CE 3.46Å; E466-K468 IonicContact OE2-NZ 3.96Å; E466-K468 PolarHBondContact OE2-NZ 2.88Å; K468-H470 VanDerWaalsContact C-N 3.27Å; K468-H470 PolarHBondContact O-N 3.07Å; K468-M471 HydrophobicContact CB-CE 4.16Å; K468-M471 HydrophobicContact CG-CE 3.57Å; K468-M471 PolarHBondContact O-N 2.95Å; K468-M472 WeakPolarHBondContact O-CG 3.42Å; K468-M472 PolarHBondContact O-N 3.17Å
469	L	95.5	Very high	92.8	Very high	5 Å²	5	65.1 Å²	65.1	3%	0.026	31%	0.309	C	S	.	.	H	α-helix	trans	-60.7	-38.6	175.9	-67.7	175.8	0	0	0	111.7	L144 F211 I460 L463 Q464 G467 M472 K473	L144-L469 HydrophobicContact CD1-CD2 3.67Å; F211-L469 HydrophobicContact CB-CD1 4.25Å; F211-L469 HydrophobicContact CB-CD2 4.32Å; I460-L469 HydrophobicContact CG2-CD1 4.25Å; L463-L469 HydrophobicContact CB-CD1 4.31Å; L463-L469 HydrophobicContact CB-CD2 4.25Å; L463-L469 HydrophobicContact CB-CG 3.91Å; L463-L469 HydrophobicContact CD1-CD2 4.48Å; L463-L469 PolarHBondContact O-N 3.08Å; Q464-L469 HydrophobicContact CB-CD1 3.96Å; G467-L469 VanDerWaalsContact C-N 3.33Å; G467-L469 PolarHBondContact O-N 3.13Å; L469-M472 HydrophobicContact CD2-CE 3.79Å; L469-K473 WeakPolarHBondContact O-CB 3.34Å; L469-K473 PolarHBondContact O-N 2.92Å
470	H	93.7	Very high	91.3	Very high	126 Å²	126	72.9 Å²	72.9	58%	0.583	35%	0.35	S	S	*	.	H	α-helix	trans	-70.3	-44.8	175.2	-172	-15.3	0	0	0	111.5	G467 K468 M472 K473 E474	G467-H470 PolarHBondContact O-N 3.41Å; G467-H470 VanDerWaalsContact O-N 3.16Å; K468-H470 VanDerWaalsContact C-N 3.27Å; K468-H470 PolarHBondContact O-N 3.07Å; H470-M472 VanDerWaalsContact C-N 3.31Å; H470-M472 PolarHBondContact O-N 3.37Å; H470-K473 WeakPolarHBondContact O-CB 3.48Å; H470-K473 PolarHBondContact O-N 3.13Å; H470-K473 VanDerWaalsContact O-N 3.08Å; H470-E474 PolarHBondContact O-N 3.21Å
471	M	94.8	Very high	89.8	Confident	116 Å²	116	75 Å²	75	57%	0.571	37%	0.372	S	S	*	.	H	α-helix	trans	-58.9	-42.8	177.5	-68.9	-171.2	-71.5	0	0	111.9	G467 K468 E474 K475	G467-M471 PolarHBondContact O-N 3.17Å; K468-M471 HydrophobicContact CB-CE 4.16Å; K468-M471 HydrophobicContact CG-CE 3.57Å; K468-M471 PolarHBondContact O-N 2.95Å; M471-E474 PolarHBondContact O-N 2.94Å; M471-K475 WeakPolarHBondContact O-CB 3.49Å; M471-K475 PolarHBondContact O-N 3.44Å
472	M	95.3	Very high	88.7	Confident	17 Å²	17	72.4 Å²	72.4	8%	0.084	36%	0.361	C	S	.	.	H	α-helix	trans	-65.4	-39.9	174.2	-70.4	-173.5	-68.7	0	0	111.7	Y140 D143 L144 E147 K468 L469 H470 K475 W476	Y140-M472 HydrophobicContact CD2-CB 3.95Å; Y140-M472 HydrophobicContact CE2-CB 3.64Å; D143-M472 HydrophobicContact CB-SD 3.82Å; L144-M472 HydrophobicContact CD1-CE 4.26Å; E147-M472 HydrophobicContact CG-SD 4.32Å; K468-M472 WeakPolarHBondContact O-CG 3.42Å; K468-M472 PolarHBondContact O-N 3.17Å; L469-M472 HydrophobicContact CD2-CE 3.79Å; H470-M472 VanDerWaalsContact C-N 3.31Å; H470-M472 PolarHBondContact O-N 3.37Å; M472-K475 PolarHBondContact O-N 2.82Å; M472-W476 PolarHBondContact O-N 3.4Å; M472-W476 VanDerWaalsContact O-N 3.14Å
473	K	93.9	Very high	87.4	Confident	59 Å²	59	74 Å²	74	26%	0.257	38%	0.378	S	S	.	.	H	α-helix	trans	-60.2	-49.7	176.7	-174.9	-172.3	176.2	-168.2	0	109.9	Y140 M212 E421 L469 H470 K475 W476 W477	Y140-K473 HydrophobicContact CE2-CB 4.23Å; M212-K473 HydrophobicContact CE-CD 4.47Å; M212-K473 HydrophobicContact CE-CG 4.23Å; E421-K473 IonicContact OE1-NZ 3.73Å; E421-K473 PolarHBondContact OE1-NZ 3.5Å; E421-K473 WeakPolarHBondContact OE2-CE 3.3Å; E421-K473 IonicContact OE2-NZ 2.87Å; E421-K473 PolarHBondContact OE2-NZ 2.95Å; L469-K473 WeakPolarHBondContact O-CB 3.34Å; L469-K473 PolarHBondContact O-N 2.92Å; H470-K473 WeakPolarHBondContact O-CB 3.48Å; H470-K473 PolarHBondContact O-N 3.13Å; H470-K473 VanDerWaalsContact O-N 3.08Å; K473-K475 VanDerWaalsContact C-N 3.34Å; K473-K475 PolarHBondContact O-N 2.57Å; K473-W476 PolarHBondContact O-N 2.91Å; K473-W477 HydrophobicContact CG-CD2 4.19Å; K473-W477 HydrophobicContact CG-CE3 3.97Å; K473-W477 HydrophobicContact CG-CG 4.46Å; K473-W477 WeakPolarHBondContact O-CB 3.41Å; K473-W477 PolarHBondContact O-N 2.93Å
474	E	91.6	Very high	85.6	Confident	86 Å²	86	81 Å²	81	40%	0.402	41%	0.411	S	S	.	.	H	α-helix	trans	-61	-44.3	179.9	-166.5	178	163.5	0	0	111.2	H470 M471 W476 R478	H470-E474 PolarHBondContact O-N 3.21Å; M471-E474 PolarHBondContact O-N 2.94Å; E474-W476 VanDerWaalsContact C-N 3.31Å; E474-W476 PolarHBondContact O-N 3.42Å; E474-R478 HydrophobicContact CG-CB 4.32Å; E474-R478 WeakPolarHBondContact O-CB 3.46Å; E474-R478 PolarHBondContact O-N 3.44Å; E474-R478 IonicContact OE1-CZ 3.73Å; E474-R478 IonicContact OE1-NH1 3.07Å; E474-R478 PolarHBondContact OE1-NH1 3.43Å
475	K	92.8	Very high	83.6	Confident	132 Å²	132	83.3 Å²	83.3	57%	0.574	42%	0.421	S	S	*	.	H	α-helix	trans	-53.7	-43.8	176.1	178.5	-172.1	172.5	-168.3	0	113.4	D143 M471 M472 K473	D143-K475 IonicContact OD2-NZ 3.22Å; D143-K475 PolarHBondContact OD2-NZ 3.26Å; M471-K475 WeakPolarHBondContact O-CB 3.49Å; M471-K475 PolarHBondContact O-N 3.44Å; M472-K475 PolarHBondContact O-N 2.82Å; K473-K475 VanDerWaalsContact C-N 3.34Å; K473-K475 PolarHBondContact O-N 2.57Å
476	W	92.7	Very high	81.1	Confident	36 Å²	36	83.2 Å²	83.2	14%	0.136	42%	0.421	C	S	.	.	H	α-helix	trans	-91.7	-30.9	-172.7	-73.5	106.1	0	0	0	113.9	P120 M123 E138 G139 Y140 D143 M472 K473 E474	P120-W476 HydrophobicContact CB-CB 4.4Å; P120-W476 HydrophobicContact CB-CE3 4.42Å; M123-W476 HydrophobicContact CE-CE3 3.98Å; M123-W476 HydrophobicContact CE-CH2 4.44Å; M123-W476 HydrophobicContact CE-CZ3 3.49Å; M123-W476 VanDerWaalsContact CE-CZ3 3.49Å; E138-W476 HydrophobicContact CB-CH2 4.06Å; E138-W476 HydrophobicContact CG-CH2 4.21Å; G139-W476 VanDerWaalsContact C-CZ2 3.45Å; G139-W476 VanDerWaalsContact CA-CH2 3.42Å; G139-W476 VanDerWaalsContact CA-CZ2 3.4Å; G139-W476 VanDerWaalsContact N-CZ2 3.34Å; Y140-W476 AromaticContact CD2-CD1 3.99Å; D143-W476 WeakPolarHBondContact OD2-CZ2 3.45Å; D143-W476 PolarHBondContact OD2-NE1 3.49Å; M472-W476 PolarHBondContact O-N 3.4Å; M472-W476 VanDerWaalsContact O-N 3.14Å; K473-W476 PolarHBondContact O-N 2.91Å; E474-W476 VanDerWaalsContact C-N 3.31Å; E474-W476 PolarHBondContact O-N 3.42Å
477	W	91.1	Very high	78.6	Confident	2 Å²	2	83 Å²	83	1%	0.008	43%	0.429	C	S	.	.	H	α-helix	trans	-81.3	-46.9	178.1	-89.7	-106.9	0	0	0	111.6	P120 Y121 Y140 M212 T418 Q425 R426 K473 G479	P120-W477 HydrophobicContact CG-CD2 4.27Å; P120-W477 HydrophobicContact CG-CE3 4.09Å; P120-W477 HydrophobicContact CG-CH2 3.6Å; P120-W477 HydrophobicContact CG-CZ2 3.8Å; P120-W477 HydrophobicContact CG-CZ3 3.77Å; Y121-W477 HydrophobicContact CD1-CH2 4.11Å; Y121-W477 AromaticContact CE1-CH2 3.5Å; Y121-W477 HydrophobicContact CE1-CH2 3.5Å; Y121-W477 HydrophobicContact CE1-CZ2 4.06Å; Y121-W477 HydrophobicContact CE2-CH2 4.33Å; Y121-W477 HydrophobicContact CE2-CZ2 4.31Å; Y121-W477 AromaticContact CZ-CH2 3.61Å; Y121-W477 AromaticContact CZ-CZ2 3.68Å; Y121-W477 WeakPolarHBondContact OH-CZ2 3.46Å; Y140-W477 AromaticContact CD2-CZ3 3.82Å; Y140-W477 HydrophobicContact CD2-CZ3 3.82Å; Y140-W477 HydrophobicContact CG-CH2 4.47Å; Y140-W477 AromaticContact CG-CZ3 3.89Å; Y140-W477 HydrophobicContact CG-CZ3 3.89Å; M212-W477 HydrophobicContact CE-CH2 4.14Å; M212-W477 HydrophobicContact CE-CZ3 4.21Å; M212-W477 HydrophobicContact SD-CH2 4.48Å; T418-W477 PolarHBondContact O-NE1 3.29Å; Q425-W477 PolarHBondContact OE1-O 2.78Å; R426-W477 PolarHBondContact NH1-O 3.21Å; K473-W477 HydrophobicContact CG-CD2 4.19Å; K473-W477 HydrophobicContact CG-CE3 3.97Å; K473-W477 HydrophobicContact CG-CG 4.46Å; K473-W477 WeakPolarHBondContact O-CB 3.41Å; K473-W477 PolarHBondContact O-N 2.93Å; W477-G479 PolarHBondContact O-N 3.03Å
478	R	82.8	Confident	76.4	Confident	140 Å²	140	90.2 Å²	90.2	53%	0.528	45%	0.453	S	S	.	.			trans	-52.1	104	-171.3	-165.9	169.9	-172.2	177.9	-1.8	111.2	E474 E484	E474-R478 HydrophobicContact CG-CB 4.32Å; E474-R478 WeakPolarHBondContact O-CB 3.46Å; E474-R478 PolarHBondContact O-N 3.44Å; E474-R478 IonicContact OE1-CZ 3.73Å; E474-R478 IonicContact OE1-NH1 3.07Å; E474-R478 PolarHBondContact OE1-NH1 3.43Å; R478-E484 IonicContact NH2-OE1 3.66Å
479	G	66.1	Low	74.2	Confident	17 Å²	17	94.9 Å²	94.9	18%	0.175	48%	0.476	C	S	.	.			trans	-98.5	128.6	178.1	0	0	0	0	0	111.5	W477 G481	W477-G479 PolarHBondContact O-N 3.03Å; G479-G481 PolarHBondContact O-N 3.4Å; G479-G481 VanDerWaalsContact O-N 3.16Å
480	N	63.8	Low	72.1	Confident	165 Å²	165	99.4 Å²	99.4	88%	0.882	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	13.6	167.4	-61.3	-13.6	0	0	0	112.3
481	G	63.7	Low	70.4	Confident	46 Å²	46	98.2 Å²	98.2	47%	0.474	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-28.7	-168.9	0	0	0	0	0	113.5	G479	G479-G481 PolarHBondContact O-N 3.4Å; G479-G481 VanDerWaalsContact O-N 3.16Å
482	C	73.4	Confident	68.8	Low	29 Å²	29	97.3 Å²	97.3	20%	0.196	53%	0.53	C	S	.	.	S	Bend	trans	-115.5	137	176.4	-65.5	0	0	0	0	110.2	T424 Q425 C428 E484	T424-C482 PolarHBondContact O-SG 2.98Å; Q425-C482 PolarHBondContact O-N 3.46Å; C428-C482 WeakPolarHBondContact CA-SG 3.36Å; C428-C482 HydrophobicContact CB-CB 4.07Å; C428-C482 WeakPolarHBondContact CB-SG 3.15Å; C428-C482 PolarHBondContact N-SG 3.48Å; C428-C482 WeakPolarHBondContact SG-CA 3.37Å; C428-C482 WeakPolarHBondContact SG-CB 3.34Å; C428-C482 CovalentContact SG-SG 2.04Å; C428-C482 PolarHBondContact SG-SG 3Å; C482-E484 PolarHBondContact O-N 3.3Å
483	P	68.6	Low	67.4	Low	110 Å²	110	101.5 Å²	101.5	71%	0.714	55%	0.552	S	S	*	*			trans	-54.3	128.1	166.6	23.2	-29.3	0	0	0	107.1	E485	P483-E485 PolarHBondContact O-N 3.2Å
484	E	59.1	Low	66	Low	147 Å²	147	100.1 Å²	100.1	69%	0.687	56%	0.555	S	S	*	*			trans	-48.9	140	164.4	-76.2	-177.6	168.7	0	0	106.3	R478 C482 E486	R478-E484 IonicContact NH2-OE1 3.66Å; C482-E484 PolarHBondContact O-N 3.3Å; E484-E486 PolarHBondContact O-N 3.31Å
485	E	55.2	Low	65.1	Low	163 Å²	163	101.7 Å²	101.7	76%	0.762	57%	0.57	S	S	*	*			trans	-58.5	90.4	175.5	-70.1	-165.2	157.6	0	0	107.1	P483 S487	P483-E485 PolarHBondContact O-N 3.2Å; E485-S487 PolarHBondContact O-N 3.13Å
486	E	42.2	Very low	63.9	Low	174 Å²	174	101.4 Å²	101.4	81%	0.813	57%	0.571	S	S	*	*			trans	-51.1	121.5	171.5	-82.4	-176.1	164	0	0	103.8	E484 K488	E484-E486 PolarHBondContact O-N 3.31Å; E486-K488 PolarHBondContact O-N 2.97Å; E486-K488 VanDerWaalsContact O-N 3.07Å
487	S	43.4	Very low	62.9	Low	86 Å²	86	101.3 Å²	101.3	60%	0.601	57%	0.573	S	S	*	*			trans	-31.1	121.5	172.7	46	0	0	0	0	108	E485 E489	E485-S487 PolarHBondContact O-N 3.13Å; S487-E489 PolarHBondContact O-N 3.21Å
488	K	49.1	Very low	62.3	Low	180 Å²	180	104 Å²	104	78%	0.783	59%	0.587	S	S	*	*			trans	-52.8	79.6	-178	-65.1	-178.3	179.2	-174.1	0	110.1	E486	E486-K488 PolarHBondContact O-N 2.97Å; E486-K488 VanDerWaalsContact O-N 3.07Å
489	E	49.1	Very low	62.2	Low	157 Å²	157	98.1 Å²	98.1	73%	0.734	57%	0.57	S	S	*	*			trans	-68.8	135.7	172.9	-75	-167.3	168.1	0	0	105.3	S487 S491	S487-E489 PolarHBondContact O-N 3.21Å; E489-S491 PolarHBondContact O-N 3.4Å
490	A	52.7	Low	63.1	Low	99 Å²	99	97.3 Å²	97.3	82%	0.818	56%	0.562	S	S	*	*			trans	-56.7	103	-178.1	0	0	0	0	0	108.7
491	S	57.6	Low	64.3	Low	102 Å²	102	93.7 Å²	93.7	71%	0.713	54%	0.542	S	S	*	.			trans	-65.3	139	-179.9	-69.2	0	0	0	0	108.9	E489 L493	E489-S491 PolarHBondContact O-N 3.4Å; S491-L493 PolarHBondContact O-N 2.9Å
492	A	60.4	Low	65.5	Low	96 Å²	96	97.8 Å²	97.8	79%	0.793	55%	0.547	S	S	*	.			trans	-55.4	140.2	176.6	0	0	0	0	0	110.2	G494	A492-G494 PolarHBondContact O-N 2.88Å
493	L	65.1	Low	66.3	Low	105 Å²	105	100.9 Å²	100.9	55%	0.55	56%	0.56	S	S	.	*			trans	-60	109	-179.7	-78.7	92.8	0	0	0	110.3	L337 S491 I498	L337-L493 HydrophobicContact CD1-CD2 3.78Å; L337-L493 HydrophobicContact CD2-CD2 4.21Å; S491-L493 PolarHBondContact O-N 2.9Å; L493-I498 HydrophobicContact CB-CD1 4.08Å; L493-I498 HydrophobicContact CD2-CD1 3.82Å; L493-I498 HydrophobicContact CD2-CG1 4.36Å
494	G	66.3	Low	67.3	Low	31 Å²	31	99.6 Å²	99.6	32%	0.32	55%	0.55	S	S	.	*			trans	-71.6	156.8	177.2	0	0	0	0	0	112.8	A492 Q496 N497	A492-G494 PolarHBondContact O-N 2.88Å; G494-Q496 PolarHBondContact O-N 2.96Å; G494-N497 PolarHBondContact O-N 3.43Å; G494-N497 VanDerWaalsContact O-N 3.08Å
495	V	71.1	Confident	68.9	Low	118 Å²	118	97.6 Å²	97.6	72%	0.715	54%	0.544	S	S	*	.	H	α-helix	trans	-56.1	-23.8	173	178.2	0	0	0	0	111.8	N497 I498 G499	V495-N497 VanDerWaalsContact C-N 3.31Å; V495-N497 PolarHBondContact O-N 3.34Å; V495-I498 PolarHBondContact O-N 3.32Å; V495-G499 WeakPolarHBondContact O-CA 3.35Å; V495-G499 PolarHBondContact O-N 3.21Å
496	Q	68.5	Low	70.7	Confident	126 Å²	126	92.3 Å²	92.3	59%	0.589	53%	0.528	S	S	*	.	H	α-helix	trans	-63.6	-33.1	177.9	-64.3	164.9	-2.3	0	0	113	P228 G494	P228-Q496 HydrophobicContact CG-CB 4.38Å; G494-Q496 PolarHBondContact O-N 2.96Å
497	N	70.6	Confident	73.2	Confident	34 Å²	34	86.8 Å²	86.8	18%	0.182	51%	0.512	C	S	.	.	H	α-helix	trans	-85.3	-27.8	179.7	-72.4	-24.4	0	0	0	113.4	P228 S232 L337 G494 V495	P228-N497 VanDerWaalsContact CB-OD1 3.27Å; P228-N497 WeakPolarHBondContact CB-OD1 3.45Å; P228-N497 WeakPolarHBondContact CG-OD1 3.44Å; S232-N497 PolarHBondContact OG-O 3.29Å; L337-N497 HydrophobicContact CD2-CB 4.36Å; G494-N497 PolarHBondContact O-N 3.43Å; G494-N497 VanDerWaalsContact O-N 3.08Å; V495-N497 VanDerWaalsContact C-N 3.31Å; V495-N497 PolarHBondContact O-N 3.34Å
498	I	78.8	Confident	75.6	Confident	59 Å²	59	84.6 Å²	84.6	30%	0.303	50%	0.503	S	S	.	.	H	α-helix	trans	-106.3	-13.7	-174.7	-63.3	177	0	0	0	112	L493 V495 G500 I501 F502	L493-I498 HydrophobicContact CB-CD1 4.08Å; L493-I498 HydrophobicContact CD2-CD1 3.82Å; L493-I498 HydrophobicContact CD2-CG1 4.36Å; V495-I498 PolarHBondContact O-N 3.32Å; I498-G500 VanDerWaalsContact C-N 3.28Å; I498-G500 PolarHBondContact O-N 3.37Å; I498-G500 VanDerWaalsContact O-N 3.15Å; I498-I501 HydrophobicContact CG2-CD1 4.22Å; I498-I501 WeakPolarHBondContact O-CB 3.4Å; I498-I501 PolarHBondContact O-N 3.48Å; I498-F502 HydrophobicContact CG2-CD2 4.33Å; I498-F502 HydrophobicContact CG2-CE2 3.81Å
499	G	81.1	Confident	77.7	Confident	17 Å²	17	81 Å²	81	18%	0.175	49%	0.492	C	S	.	.	H	α-helix	trans	-56.2	-36.8	-172.6	0	0	0	0	0	114.2	V495 I501 F502 I503	V495-G499 WeakPolarHBondContact O-CA 3.35Å; V495-G499 PolarHBondContact O-N 3.21Å; G499-I501 VanDerWaalsContact C-N 3.25Å; G499-I501 PolarHBondContact O-N 3.47Å; G499-F502 PolarHBondContact O-N 3.42Å; G499-I503 PolarHBondContact O-N 3.19Å
500	G	85.6	Confident	79.9	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	48%	0.481	C	S	.	.	H	α-helix	trans	-59.8	-33.1	176	0	0	0	0	0	114	V230 I498 F502 I503 V504	V230-G500 WeakPolarHBondContact O-CA 3.27Å; V230-G500 PolarHBondContact O-N 2.94Å; I498-G500 VanDerWaalsContact C-N 3.28Å; I498-G500 PolarHBondContact O-N 3.37Å; I498-G500 VanDerWaalsContact O-N 3.15Å; G500-F502 VanDerWaalsContact C-N 3.33Å; G500-F502 PolarHBondContact O-N 2.93Å; G500-I503 PolarHBondContact O-N 3.22Å; G500-V504 WeakPolarHBondContact O-CG2 3.48Å; G500-V504 PolarHBondContact O-N 3.46Å
501	I	88.9	Confident	81.9	Confident	88 Å²	88	78.1 Å²	78.1	45%	0.451	47%	0.47	S	S	.	.	H	α-helix	trans	-65.5	-39.9	180	-60.4	170.8	0	0	0	110.2	F233 I498 G499 I503 V504 L505	F233-I501 HydrophobicContact CD1-CG1 4.15Å; F233-I501 HydrophobicContact CE1-CG1 4.48Å; F233-I501 HydrophobicContact CG-CG1 4.24Å; I498-I501 HydrophobicContact CG2-CD1 4.22Å; I498-I501 WeakPolarHBondContact O-CB 3.4Å; I498-I501 PolarHBondContact O-N 3.48Å; G499-I501 VanDerWaalsContact C-N 3.25Å; G499-I501 PolarHBondContact O-N 3.47Å; I501-I503 VanDerWaalsContact C-N 3.34Å; I501-I503 PolarHBondContact O-N 3.13Å; I501-V504 PolarHBondContact O-N 3.44Å; I501-L505 PolarHBondContact O-N 2.89Å
502	F	88.9	Confident	83.7	Confident	132 Å²	132	76.3 Å²	76.3	58%	0.579	46%	0.457	S	S	*	.	H	α-helix	trans	-66.7	-34.8	175.8	-68.4	-69.9	0	0	0	112.7	I498 G499 G500 L505 A506	I498-F502 HydrophobicContact CG2-CD2 4.33Å; I498-F502 HydrophobicContact CG2-CE2 3.81Å; G499-F502 PolarHBondContact O-N 3.42Å; G500-F502 VanDerWaalsContact C-N 3.33Å; G500-F502 PolarHBondContact O-N 2.93Å; F502-L505 PolarHBondContact O-N 2.96Å; F502-A506 PolarHBondContact O-N 2.94Å
503	I	89.8	Confident	85.3	Confident	94 Å²	94	76 Å²	76	48%	0.482	45%	0.446	S	S	.	.	H	α-helix	trans	-66.5	-44.8	176.3	-64.8	167.5	0	0	0	110.5	V230 G499 G500 I501 L505 A506 A507	V230-I503 HydrophobicContact CG1-CD1 3.57Å; G499-I503 PolarHBondContact O-N 3.19Å; G500-I503 PolarHBondContact O-N 3.22Å; I501-I503 VanDerWaalsContact C-N 3.34Å; I501-I503 PolarHBondContact O-N 3.13Å; I503-L505 VanDerWaalsContact C-N 3.31Å; I503-L505 PolarHBondContact O-N 3.47Å; I503-A506 PolarHBondContact O-N 3.34Å; I503-A507 WeakPolarHBondContact O-CB 3.45Å; I503-A507 PolarHBondContact O-N 3.04Å
504	V	91	Very high	86.7	Confident	83 Å²	83	77.8 Å²	77.8	50%	0.503	45%	0.449	S	S	.	.	H	α-helix	trans	-61	-42.1	176.4	174.1	0	0	0	0	110.9	F233 G500 I501 A507 G508	F233-V504 HydrophobicContact CZ-CG2 4.39Å; G500-V504 WeakPolarHBondContact O-CG2 3.48Å; G500-V504 PolarHBondContact O-N 3.46Å; I501-V504 PolarHBondContact O-N 3.44Å; V504-A507 PolarHBondContact O-N 3.23Å; V504-G508 PolarHBondContact O-N 2.82Å
505	L	91.8	Very high	88	Confident	105 Å²	105	79.8 Å²	79.8	55%	0.55	46%	0.455	S	S	.	.	H	α-helix	trans	-59.9	-48.9	175.7	178.4	63.3	0	0	0	112	I501 F502 I503 A507 G508 L509	I501-L505 PolarHBondContact O-N 2.89Å; F502-L505 PolarHBondContact O-N 2.96Å; I503-L505 VanDerWaalsContact C-N 3.31Å; I503-L505 PolarHBondContact O-N 3.47Å; L505-A507 PolarHBondContact O-N 3.31Å; L505-G508 PolarHBondContact O-N 3.3Å; L505-L509 HydrophobicContact CG-CD1 4.5Å; L505-L509 WeakPolarHBondContact O-CG 3.41Å; L505-L509 PolarHBondContact O-N 2.89Å
506	A	92.9	Very high	89.1	Confident	52 Å²	52	76.8 Å²	76.8	43%	0.43	44%	0.442	S	S	.	.	H	α-helix	trans	-62.2	-43.7	179.1	0	0	0	0	0	112	F502 I503 G508 L509 V510	F502-A506 PolarHBondContact O-N 2.94Å; I503-A506 PolarHBondContact O-N 3.34Å; A506-G508 VanDerWaalsContact C-N 3.32Å; A506-G508 PolarHBondContact O-N 2.89Å; A506-L509 PolarHBondContact O-N 3.02Å; A506-V510 WeakPolarHBondContact O-CG2 3.47Å; A506-V510 PolarHBondContact O-N 3.35Å
507	A	93.9	Very high	90.3	Very high	58 Å²	58	74.4 Å²	74.4	48%	0.479	44%	0.436	S	S	.	.	H	α-helix	trans	-61	-41.3	176.1	0	0	0	0	0	111.9	I503 V504 L505 V510 L511	I503-A507 WeakPolarHBondContact O-CB 3.45Å; I503-A507 PolarHBondContact O-N 3.04Å; V504-A507 PolarHBondContact O-N 3.23Å; L505-A507 PolarHBondContact O-N 3.31Å; A507-V510 PolarHBondContact O-N 3.05Å; A507-L511 WeakPolarHBondContact O-CB 3.45Å; A507-L511 PolarHBondContact O-N 2.83Å
508	G	93.7	Very high	91.3	Very high	40 Å²	40	74.6 Å²	74.6	41%	0.412	45%	0.446	S	S	.	.	H	α-helix	trans	-62.5	-41.5	176.2	0	0	0	0	0	113.3	V504 L505 A506 L511 S512	V504-G508 PolarHBondContact O-N 2.82Å; L505-G508 PolarHBondContact O-N 3.3Å; A506-G508 VanDerWaalsContact C-N 3.32Å; A506-G508 PolarHBondContact O-N 2.89Å; G508-L511 PolarHBondContact O-N 3.37Å; G508-S512 WeakPolarHBondContact O-CB 3.45Å; G508-S512 PolarHBondContact O-N 3.09Å
509	L	95	Very high	92	Very high	104 Å²	104	78 Å²	78	55%	0.545	46%	0.461	S	S	.	.	H	α-helix	trans	-66.1	-41.3	176.3	-70.1	173	0	0	0	112.5	L505 A506 S512 V513	L505-L509 HydrophobicContact CG-CD1 4.5Å; L505-L509 WeakPolarHBondContact O-CG 3.41Å; L505-L509 PolarHBondContact O-N 2.89Å; A506-L509 PolarHBondContact O-N 3.02Å; L509-S512 PolarHBondContact O-N 2.92Å; L509-S512 PolarHBondContact O-OG 3.41Å; L509-V513 WeakPolarHBondContact O-CG2 3.41Å; L509-V513 PolarHBondContact O-N 3.09Å
510	V	94.9	Very high	92.6	Very high	83 Å²	83	84.1 Å²	84.1	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-65.4	-45.2	177	170.6	0	0	0	0	110.4	A506 A507 S512 V513 F514	A506-V510 WeakPolarHBondContact O-CG2 3.47Å; A506-V510 PolarHBondContact O-N 3.35Å; A507-V510 PolarHBondContact O-N 3.05Å; V510-S512 VanDerWaalsContact C-N 3.34Å; V510-S512 PolarHBondContact O-N 2.89Å; V510-V513 PolarHBondContact O-N 2.85Å; V510-F514 HydrophobicContact CG1-CD2 3.72Å; V510-F514 HydrophobicContact CG1-CE2 3.4Å; V510-F514 VanDerWaalsContact CG1-CE2 3.4Å; V510-F514 WeakPolarHBondContact O-CD2 3.27Å; V510-F514 PolarHBondContact O-N 3.47Å; V510-F514 VanDerWaalsContact O-N 3.13Å
511	L	94.8	Very high	92.9	Very high	113 Å²	113	89.3 Å²	89.3	59%	0.592	51%	0.51	S	S	*	.	H	α-helix	trans	-61.6	-41.1	178.1	-176.8	63.6	0	0	0	111.9	A507 G508 V513 F514 V515	A507-L511 WeakPolarHBondContact O-CB 3.45Å; A507-L511 PolarHBondContact O-N 2.83Å; G508-L511 PolarHBondContact O-N 3.37Å; L511-V513 VanDerWaalsContact C-N 3.35Å; L511-V513 PolarHBondContact O-N 2.93Å; L511-F514 PolarHBondContact O-N 3.34Å; L511-V515 HydrophobicContact CD1-CG2 4.45Å; L511-V515 HydrophobicContact CG-CG2 4.47Å; L511-V515 WeakPolarHBondContact O-CG2 3.35Å; L511-V515 PolarHBondContact O-N 2.97Å
512	S	94.6	Very high	93	Very high	64 Å²	64	93 Å²	93	45%	0.448	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-39.1	179.5	71.6	0	0	0	0	112.4	G508 L509 V510 V515 A516	G508-S512 WeakPolarHBondContact O-CB 3.45Å; G508-S512 PolarHBondContact O-N 3.09Å; L509-S512 PolarHBondContact O-N 2.92Å; L509-S512 PolarHBondContact O-OG 3.41Å; V510-S512 VanDerWaalsContact C-N 3.34Å; V510-S512 PolarHBondContact O-N 2.89Å; S512-V515 PolarHBondContact O-N 2.94Å; S512-A516 WeakPolarHBondContact O-CB 3.47Å; S512-A516 PolarHBondContact O-N 3.36Å
513	V	94.8	Very high	93.1	Very high	91 Å²	91	93.1 Å²	93.1	55%	0.552	52%	0.52	S	S	*	.	H	α-helix	trans	-62.3	-44.2	173.7	173.2	0	0	0	0	110.9	L509 V510 L511 A516 V517	L509-V513 WeakPolarHBondContact O-CG2 3.41Å; L509-V513 PolarHBondContact O-N 3.09Å; V510-V513 PolarHBondContact O-N 2.85Å; L511-V513 VanDerWaalsContact C-N 3.35Å; L511-V513 PolarHBondContact O-N 2.93Å; V513-A516 PolarHBondContact O-N 3.45Å; V513-V517 VanDerWaalsContact O-CG2 3.32Å; V513-V517 WeakPolarHBondContact O-CG2 3.35Å; V513-V517 PolarHBondContact O-N 3.03Å
514	F	93.9	Very high	93	Very high	141 Å²	141	91.6 Å²	91.6	62%	0.618	52%	0.518	S	S	*	.	H	α-helix	trans	-63	-42.5	177.1	-79.1	-62.8	0	0	0	112.7	V510 L511 V517 G518	V510-F514 HydrophobicContact CG1-CD2 3.72Å; V510-F514 HydrophobicContact CG1-CE2 3.4Å; V510-F514 VanDerWaalsContact CG1-CE2 3.4Å; V510-F514 WeakPolarHBondContact O-CD2 3.27Å; V510-F514 PolarHBondContact O-N 3.47Å; V510-F514 VanDerWaalsContact O-N 3.13Å; L511-F514 PolarHBondContact O-N 3.34Å; F514-V517 PolarHBondContact O-N 3.4Å; F514-G518 PolarHBondContact O-N 3.28Å
515	V	93.8	Very high	92.9	Very high	74 Å²	74	94.4 Å²	94.4	45%	0.448	52%	0.523	S	S	.	.	H	α-helix	trans	-63.1	-45.6	176.2	173.4	0	0	0	0	110.6	L511 S512 V517 G518 E519	L511-V515 HydrophobicContact CD1-CG2 4.45Å; L511-V515 HydrophobicContact CG-CG2 4.47Å; L511-V515 WeakPolarHBondContact O-CG2 3.35Å; L511-V515 PolarHBondContact O-N 2.97Å; S512-V515 PolarHBondContact O-N 2.94Å; V515-V517 PolarHBondContact O-N 3.43Å; V515-G518 CarbonylContact O-C 3.59Å; V515-G518 WeakPolarHBondContact O-CA 3.38Å; V515-G518 PolarHBondContact O-N 3.42Å; V515-G518 VanDerWaalsContact O-N 3.09Å; V515-E519 HydrophobicContact CG1-CG 4.4Å; V515-E519 WeakPolarHBondContact O-CG 3.45Å; V515-E519 PolarHBondContact O-N 2.96Å
516	A	93.8	Very high	92.7	Very high	54 Å²	54	93.6 Å²	93.6	45%	0.446	52%	0.516	S	S	.	.	H	α-helix	trans	-61.2	-41.4	178.3	0	0	0	0	0	112.6	S512 V513 E519 F520	S512-A516 WeakPolarHBondContact O-CB 3.47Å; S512-A516 PolarHBondContact O-N 3.36Å; V513-A516 PolarHBondContact O-N 3.45Å; A516-E519 PolarHBondContact O-N 3.31Å; A516-F520 WeakPolarHBondContact O-CB 3.32Å; A516-F520 PolarHBondContact O-N 2.91Å
517	V	93.3	Very high	92.2	Very high	76 Å²	76	94.8 Å²	94.8	46%	0.461	52%	0.515	S	S	.	.	H	α-helix	trans	-63.6	-42.8	173.3	172.2	0	0	0	0	110.6	V513 F514 V515 F520 L521	V513-V517 VanDerWaalsContact O-CG2 3.32Å; V513-V517 WeakPolarHBondContact O-CG2 3.35Å; V513-V517 PolarHBondContact O-N 3.03Å; F514-V517 PolarHBondContact O-N 3.4Å; V515-V517 PolarHBondContact O-N 3.43Å; V517-F520 PolarHBondContact O-N 3.04Å; V517-L521 HydrophobicContact CG1-CD1 4Å; V517-L521 HydrophobicContact CG1-CG 4.37Å; V517-L521 WeakPolarHBondContact O-CB 3.34Å; V517-L521 VanDerWaalsContact O-CG 3.27Å; V517-L521 WeakPolarHBondContact O-CG 3.38Å; V517-L521 PolarHBondContact O-N 2.88Å
518	G	92.6	Very high	91.5	Very high	38 Å²	38	94 Å²	94	39%	0.392	51%	0.509	S	S	.	.	H	α-helix	trans	-59.3	-47.4	175.8	0	0	0	0	0	112.9	F514 V515 L521 Y522	F514-G518 PolarHBondContact O-N 3.28Å; V515-G518 CarbonylContact O-C 3.59Å; V515-G518 WeakPolarHBondContact O-CA 3.38Å; V515-G518 PolarHBondContact O-N 3.42Å; V515-G518 VanDerWaalsContact O-N 3.09Å; G518-L521 PolarHBondContact O-N 2.92Å; G518-Y522 WeakPolarHBondContact O-CB 3.27Å; G518-Y522 PolarHBondContact O-N 2.99Å
519	E	93.3	Very high	90.8	Very high	130 Å²	130	97.8 Å²	97.8	61%	0.607	52%	0.516	S	S	*	.	H	α-helix	trans	-61.6	-43.4	175.8	-73.2	-177.5	175.2	0	0	111.9	V515 A516 Y522 K523	V515-E519 HydrophobicContact CG1-CG 4.4Å; V515-E519 WeakPolarHBondContact O-CG 3.45Å; V515-E519 PolarHBondContact O-N 2.96Å; A516-E519 PolarHBondContact O-N 3.31Å; E519-Y522 PolarHBondContact O-N 3.44Å; E519-K523 VanDerWaalsContact O-CB 3.27Å; E519-K523 WeakPolarHBondContact O-CB 3.24Å; E519-K523 PolarHBondContact O-N 3.22Å
520	F	92.9	Very high	90	Very high	147 Å²	147	97.2 Å²	97.2	65%	0.645	51%	0.513	S	S	*	.	H	α-helix	trans	-61	-46.3	177	-179.3	-98.4	0	0	0	111.5	A516 V517 S524	A516-F520 WeakPolarHBondContact O-CB 3.32Å; A516-F520 PolarHBondContact O-N 2.91Å; V517-F520 PolarHBondContact O-N 3.04Å; F520-S524 WeakPolarHBondContact O-CB 3.39Å; F520-S524 PolarHBondContact O-N 2.97Å
521	L	91.9	Very high	89.2	Confident	108 Å²	108	98.8 Å²	98.8	57%	0.565	52%	0.515	S	S	*	.	H	α-helix	trans	-64.8	-41.9	177.3	-69.5	174.6	0	0	0	111.8	V517 G518 K525	V517-L521 HydrophobicContact CG1-CD1 4Å; V517-L521 HydrophobicContact CG1-CG 4.37Å; V517-L521 WeakPolarHBondContact O-CB 3.34Å; V517-L521 VanDerWaalsContact O-CG 3.27Å; V517-L521 WeakPolarHBondContact O-CG 3.38Å; V517-L521 PolarHBondContact O-N 2.88Å; G518-L521 PolarHBondContact O-N 2.92Å; L521-K525 WeakPolarHBondContact O-CB 3.49Å; L521-K525 PolarHBondContact O-N 3.28Å
522	Y	92.5	Very high	88.2	Confident	165 Å²	165	100.3 Å²	100.3	65%	0.647	52%	0.517	S	S	*	.	H	α-helix	trans	-62.8	-50.3	177.7	-178.6	-97.2	0	0	0	111.4	G518 E519 K525 Q526	G518-Y522 WeakPolarHBondContact O-CB 3.27Å; G518-Y522 PolarHBondContact O-N 2.99Å; E519-Y522 PolarHBondContact O-N 3.44Å; Y522-K525 PolarHBondContact O-N 3.4Å; Y522-Q526 WeakPolarHBondContact O-CB 3.08Å; Y522-Q526 PolarHBondContact O-N 3.35Å
523	K	90.8	Very high	87.1	Confident	136 Å²	136	99.2 Å²	99.2	59%	0.591	51%	0.512	S	S	*	.	H	α-helix	trans	-66.5	-38.6	179.7	-168.2	171.9	-176.3	174.9	0	112	E519 Q526 N527	E519-K523 VanDerWaalsContact O-CB 3.27Å; E519-K523 WeakPolarHBondContact O-CB 3.24Å; E519-K523 PolarHBondContact O-N 3.22Å; K523-Q526 PolarHBondContact O-N 2.93Å; K523-N527 WeakPolarHBondContact O-CB 3.48Å; K523-N527 VanDerWaalsContact O-CG 3.26Å; K523-N527 PolarHBondContact O-N 3.04Å
524	S	87.3	Confident	86	Confident	62 Å²	62	99.8 Å²	99.8	43%	0.434	51%	0.508	S	S	.	.	H	α-helix	trans	-60.8	-45.2	173.5	178.7	0	0	0	0	111.6	F520 N527 A528	F520-S524 WeakPolarHBondContact O-CB 3.39Å; F520-S524 PolarHBondContact O-N 2.97Å; S524-N527 PolarHBondContact O-N 2.99Å; S524-A528 WeakPolarHBondContact O-CB 3.31Å; S524-A528 PolarHBondContact O-N 3.36Å
525	K	88.1	Confident	84.8	Confident	141 Å²	141	100.2 Å²	100.2	61%	0.613	51%	0.506	S	S	*	.	H	α-helix	trans	-64.3	-41.9	175.9	-172	178.4	179.5	-179	0	112.1	L521 Y522 A528 Q529	L521-K525 WeakPolarHBondContact O-CB 3.49Å; L521-K525 PolarHBondContact O-N 3.28Å; Y522-K525 PolarHBondContact O-N 3.4Å; K525-A528 PolarHBondContact O-N 2.85Å; K525-Q529 WeakPolarHBondContact O-CG 3.41Å; K525-Q529 PolarHBondContact O-N 2.89Å
526	Q	87.3	Confident	83.5	Confident	88 Å²	88	105.1 Å²	105.1	41%	0.411	52%	0.516	S	S	.	.	H	α-helix	trans	-63.7	-45	177	-170.9	178.1	11.5	0	0	111.4	Y522 K523 Q529 L530	Y522-Q526 WeakPolarHBondContact O-CB 3.08Å; Y522-Q526 PolarHBondContact O-N 3.35Å; K523-Q526 PolarHBondContact O-N 2.93Å; Q526-Q529 PolarHBondContact O-N 3.04Å; Q526-L530 HydrophobicContact CG-CD1 4.19Å; Q526-L530 WeakPolarHBondContact O-CG 3.47Å; Q526-L530 PolarHBondContact O-N 2.85Å
527	N	82.9	Confident	82.1	Confident	77 Å²	77	109.2 Å²	109.2	41%	0.412	53%	0.526	S	S	.	.	H	α-helix	trans	-64.1	-42	176.3	-73.9	-5.2	0	0	0	111.7	K523 S524 Q529 L530 E531	K523-N527 WeakPolarHBondContact O-CB 3.48Å; K523-N527 VanDerWaalsContact O-CG 3.26Å; K523-N527 PolarHBondContact O-N 3.04Å; S524-N527 PolarHBondContact O-N 2.99Å; N527-Q529 VanDerWaalsContact C-N 3.28Å; N527-Q529 PolarHBondContact O-N 3.42Å; N527-L530 PolarHBondContact O-N 2.96Å; N527-E531 WeakPolarHBondContact O-CB 3.48Å; N527-E531 WeakPolarHBondContact O-CG 3.34Å; N527-E531 PolarHBondContact O-N 3.19Å
528	A	79.6	Confident	80.7	Confident	43 Å²	43	112.3 Å²	112.3	36%	0.355	53%	0.53	S	S	.	.	H	α-helix	trans	-62.5	-34.2	174.7	0	0	0	0	0	112.6	S524 K525 K532	S524-A528 WeakPolarHBondContact O-CB 3.31Å; S524-A528 PolarHBondContact O-N 3.36Å; K525-A528 PolarHBondContact O-N 2.85Å; A528-K532 WeakPolarHBondContact O-CB 3.25Å; A528-K532 VanDerWaalsContact O-CG 3.25Å; A528-K532 WeakPolarHBondContact O-CG 3.37Å; A528-K532 PolarHBondContact O-N 3.21Å
529	Q	79.8	Confident	79.3	Confident	119 Å²	119	114.7 Å²	114.7	56%	0.556	53%	0.533	S	S	*	.	H	α-helix	trans	-71.5	-40.9	173.8	-74.6	-179.8	-8.6	0	0	112.4	K525 Q526 N527 K532 A533	K525-Q529 WeakPolarHBondContact O-CG 3.41Å; K525-Q529 PolarHBondContact O-N 2.89Å; Q526-Q529 PolarHBondContact O-N 3.04Å; N527-Q529 VanDerWaalsContact C-N 3.28Å; N527-Q529 PolarHBondContact O-N 3.42Å; Q529-K532 PolarHBondContact O-N 3.42Å; Q529-A533 WeakPolarHBondContact O-CB 3.35Å; Q529-A533 PolarHBondContact O-N 3.35Å
530	L	77.7	Confident	77.8	Confident	92 Å²	92	115.5 Å²	115.5	48%	0.482	54%	0.535	S	S	.	.	H	α-helix	trans	-64.3	-45	175.3	-75.7	165	0	0	0	111.4	Q526 N527 A533 Q534	Q526-L530 HydrophobicContact CG-CD1 4.19Å; Q526-L530 WeakPolarHBondContact O-CG 3.47Å; Q526-L530 PolarHBondContact O-N 2.85Å; N527-L530 PolarHBondContact O-N 2.96Å; L530-A533 WeakPolarHBondContact O-CB 3.41Å; L530-A533 PolarHBondContact O-N 3.21Å; L530-A533 VanDerWaalsContact O-N 3.16Å; L530-Q534 WeakPolarHBondContact O-CG 3.45Å; L530-Q534 PolarHBondContact O-N 2.88Å
531	E	77.6	Confident	76.2	Confident	116 Å²	116	115.9 Å²	115.9	54%	0.542	54%	0.536	S	S	.	.	H	α-helix	trans	-60	-49.4	173.6	-76.7	-174.2	167.7	0	0	110.4	N527 A533 Q534 W535	N527-E531 WeakPolarHBondContact O-CB 3.48Å; N527-E531 WeakPolarHBondContact O-CG 3.34Å; N527-E531 PolarHBondContact O-N 3.19Å; E531-A533 PolarHBondContact O-N 2.9Å; E531-Q534 CarbonylContact O-C 3.59Å; E531-Q534 PolarHBondContact O-N 3.16Å; E531-W535 PolarHBondContact O-N 3.16Å
532	K	74.4	Confident	74.4	Confident	145 Å²	145	119.5 Å²	119.5	63%	0.63	54%	0.542	S	S	*	.	H	α-helix	trans	-58.2	-31.3	175.3	-77.5	177.2	-178.3	-177.4	0	113.5	A528 Q529 R536	A528-K532 WeakPolarHBondContact O-CB 3.25Å; A528-K532 VanDerWaalsContact O-CG 3.25Å; A528-K532 WeakPolarHBondContact O-CG 3.37Å; A528-K532 PolarHBondContact O-N 3.21Å; Q529-K532 PolarHBondContact O-N 3.42Å; K532-R536 WeakPolarHBondContact O-CG 3.47Å; K532-R536 PolarHBondContact O-N 3.04Å; K532-R536 PolarHBondContact O-NE 3.34Å
533	A	70.7	Confident	72.7	Confident	41 Å²	41	118.1 Å²	118.1	34%	0.339	54%	0.542	S	S	.	.	H	α-helix	trans	-73.2	-41.5	174.2	0	0	0	0	0	111.9	Q529 L530 E531 R536 Q537	Q529-A533 WeakPolarHBondContact O-CB 3.35Å; Q529-A533 PolarHBondContact O-N 3.35Å; L530-A533 WeakPolarHBondContact O-CB 3.41Å; L530-A533 PolarHBondContact O-N 3.21Å; L530-A533 VanDerWaalsContact O-N 3.16Å; E531-A533 PolarHBondContact O-N 2.9Å; A533-R536 PolarHBondContact O-N 2.8Å; A533-Q537 PolarHBondContact O-N 3.21Å
534	Q	72.4	Confident	71.1	Confident	103 Å²	103	118 Å²	118	48%	0.481	54%	0.543	S	S	.	.	H	α-helix	trans	-67.5	-37	175.4	-71.7	-179.3	-4	0	0	112.9	L530 E531 Q537 R538	L530-Q534 WeakPolarHBondContact O-CG 3.45Å; L530-Q534 PolarHBondContact O-N 2.88Å; E531-Q534 CarbonylContact O-C 3.59Å; E531-Q534 PolarHBondContact O-N 3.16Å; Q534-Q537 PolarHBondContact O-N 3.17Å; Q534-R538 PolarHBondContact O-N 2.97Å
535	W	68.9	Low	69.5	Low	149 Å²	149	123.2 Å²	123.2	56%	0.564	56%	0.559	S	S	*	*	H	α-helix	trans	-63	-46.5	172.7	-81.7	99.8	0	0	0	110.9	E531 Q537 R538 D539	E531-W535 PolarHBondContact O-N 3.16Å; W535-Q537 VanDerWaalsContact C-N 3.31Å; W535-Q537 PolarHBondContact O-N 3.1Å; W535-R538 PolarHBondContact O-N 3.34Å; W535-R538 VanDerWaalsContact O-N 3.1Å; W535-D539 PolarHBondContact O-N 3.43Å
536	R	65.9	Low	67.9	Low	178 Å²	178	121.1 Å²	121.1	67%	0.672	56%	0.56	S	S	*	*	H	α-helix	trans	-61.3	-34.6	174.4	-78.5	-173.4	-74.6	-177.5	-0.8	113.8	K532 A533 K540	K532-R536 WeakPolarHBondContact O-CG 3.47Å; K532-R536 PolarHBondContact O-N 3.04Å; K532-R536 PolarHBondContact O-NE 3.34Å; A533-R536 PolarHBondContact O-N 2.8Å; R536-K540 PolarHBondContact O-N 3.39Å
537	Q	65.4	Low	66.3	Low	140 Å²	140	122 Å²	122	65%	0.654	58%	0.575	S	S	*	*	H	α-helix	trans	-71.4	-35.2	173.4	-78.7	-171.8	-12	0	0	112.9	A533 Q534 W535 K541	A533-Q537 PolarHBondContact O-N 3.21Å; Q534-Q537 PolarHBondContact O-N 3.17Å; W535-Q537 VanDerWaalsContact C-N 3.31Å; W535-Q537 PolarHBondContact O-N 3.1Å; Q537-K541 PolarHBondContact O-N 3.06Å; Q537-K541 VanDerWaalsContact O-N 3.16Å
538	R	63.3	Low	64.9	Low	141 Å²	141	126.3 Å²	126.3	53%	0.532	59%	0.592	S	S	.	*	H	α-helix	trans	-69	-40.2	174.5	-86.4	-174.1	-101.7	-178.5	-6.8	112.3	Q534 W535 K541 R542	Q534-R538 PolarHBondContact O-N 2.97Å; W535-R538 PolarHBondContact O-N 3.34Å; W535-R538 VanDerWaalsContact O-N 3.1Å; R538-K541 PolarHBondContact O-N 3.23Å; R538-R542 WeakPolarHBondContact O-CB 3.48Å; R538-R542 PolarHBondContact O-N 3.44Å
539	D	63	Low	63.4	Low	87 Å²	87	133.1 Å²	133.1	47%	0.465	62%	0.617	S	S	.	*	H	α-helix	trans	-65.3	-41.8	175.6	-75.1	-26.5	0	0	0	111.9	W535 K541 R542 E543	W535-D539 PolarHBondContact O-N 3.43Å; D539-K541 PolarHBondContact O-N 3.38Å; D539-R542 WeakPolarHBondContact O-CB 3.47Å; D539-R542 PolarHBondContact O-N 3.05Å; D539-E543 PolarHBondContact O-N 3.23Å
540	K	61.2	Low	61.9	Low	148 Å²	148	130.6 Å²	130.6	64%	0.643	62%	0.623	S	S	*	*	H	α-helix	trans	-57.4	-45.4	171.9	-97.8	-173.5	171.4	-172.5	0	113.1	R536 R542 E543 E544	R536-K540 PolarHBondContact O-N 3.39Å; K540-R542 PolarHBondContact O-N 2.9Å; K540-E543 PolarHBondContact O-N 2.79Å; K540-E544 PolarHBondContact O-N 3.36Å; K540-E544 VanDerWaalsContact O-N 3.09Å
541	K	59.3	Low	60.2	Low	155 Å²	155	130.7 Å²	130.7	67%	0.674	64%	0.636	S	S	*	*	H	α-helix	trans	-64.6	-28.5	175.7	-83.3	-174.8	174.1	-177.8	0	112.8	Q537 R538 D539 F545	Q537-K541 PolarHBondContact O-N 3.06Å; Q537-K541 VanDerWaalsContact O-N 3.16Å; R538-K541 PolarHBondContact O-N 3.23Å; D539-K541 PolarHBondContact O-N 3.38Å; K541-F545 PolarHBondContact O-N 2.92Å
542	R	55	Low	58.6	Low	183 Å²	183	134.6 Å²	134.6	69%	0.691	65%	0.652	S	S	*	*	H	α-helix	trans	-79	-37	179.1	-154.5	177.9	-177.6	-158.2	-0.7	112.1	R538 D539 K540 F545 C546	R538-R542 WeakPolarHBondContact O-CB 3.48Å; R538-R542 PolarHBondContact O-N 3.44Å; D539-R542 WeakPolarHBondContact O-CB 3.47Å; D539-R542 PolarHBondContact O-N 3.05Å; K540-R542 PolarHBondContact O-N 2.9Å; R542-F545 PolarHBondContact O-N 3.06Å; R542-C546 PolarHBondContact O-N 3.03Å
543	E	56.8	Low	56.8	Low	137 Å²	137	136.2 Å²	136.2	64%	0.64	67%	0.666	S	S	*	*	H	α-helix	trans	-64.5	-40.8	170.6	-77	179.9	155	0	0	112.2	D539 K540 F545 C546 C547	D539-E543 PolarHBondContact O-N 3.23Å; K540-E543 PolarHBondContact O-N 2.79Å; E543-F545 VanDerWaalsContact C-N 3.32Å; E543-F545 PolarHBondContact O-N 3.34Å; E543-C546 PolarHBondContact O-N 3.09Å; E543-C547 PolarHBondContact O-N 3.43Å; E543-C547 PolarHBondContact O-SG 3.04Å
544	E	56.3	Low	55.2	Low	132 Å²	132	141.9 Å²	141.9	62%	0.617	69%	0.691	S	S	*	*	H	α-helix	trans	-62.2	-36.8	173.2	-79	176.3	168.2	0	0	112.4	K540	K540-E544 PolarHBondContact O-N 3.36Å; K540-E544 VanDerWaalsContact O-N 3.09Å
545	F	53.9	Low	53.7	Low	173 Å²	173	145.8 Å²	145.8	76%	0.759	71%	0.707	S	S	*	*	H	α-helix	trans	-73	-36.3	178	-140.2	-93.8	0	0	0	112.8	K541 R542 E543	K541-F545 PolarHBondContact O-N 2.92Å; R542-F545 PolarHBondContact O-N 3.06Å; E543-F545 VanDerWaalsContact C-N 3.32Å; E543-F545 PolarHBondContact O-N 3.34Å
546	C	54.7	Low	52.1	Low	96 Å²	96	146.5 Å²	146.5	65%	0.649	72%	0.722	S	S	*	*	H	α-helix	trans	-73.2	-30.9	176.2	-82.8	0	0	0	0	113.2	R542 E543 H548	R542-C546 PolarHBondContact O-N 3.03Å; E543-C546 PolarHBondContact O-N 3.09Å; C546-H548 VanDerWaalsContact C-N 3.3Å; C546-H548 PolarHBondContact O-N 3.45Å
547	C	54.4	Low	51	Low	107 Å²	107	144.8 Å²	144.8	72%	0.723	72%	0.721	S	S	*	*	H	α-helix	trans	-72.3	-20.9	176.7	-67.9	0	0	0	0	113.5	E543	E543-C547 PolarHBondContact O-N 3.43Å; E543-C547 PolarHBondContact O-SG 3.04Å
548	H	52.4	Low	49.6	Very low	167 Å²	167	147 Å²	147	77%	0.773	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-3.3	-179	-98.7	-62.6	0	0	0	115.6	C546	C546-H548 VanDerWaalsContact C-N 3.3Å; C546-H548 PolarHBondContact O-N 3.45Å
549	H	49.2	Very low	48.6	Very low	187 Å²	187	147.3 Å²	147.3	87%	0.866	74%	0.742	S	S	*	*	S	Bend	trans	-125.7	11	-179.8	-106.1	53.4	0	0	0	115.2
550	G	46.8	Very low	47.2	Very low	66 Å²	66	156.5 Å²	156.5	68%	0.68	78%	0.778	S	S	*	*			trans	-110.5	51.1	-178.3	0	0	0	0	0	114.6
551	A	43.4	Very low	46.5	Very low	93 Å²	93	156.9 Å²	156.9	77%	0.769	79%	0.785	S	S	*	*	S	Bend	trans	-159.9	122.1	164.3	0	0	0	0	0	113.2
552	K	43.1	Very low	45.9	Very low	198 Å²	198	157 Å²	157	86%	0.861	79%	0.79	S	S	*	*			trans	81.7	100.7	167.6	-65.7	-178.3	176.1	177.4	0	118.1
553	L	37.1	Very low	45.4	Very low	179 Å²	179	155.6 Å²	155.6	94%	0.937	80%	0.796	S	S	*	*				-151.6	103.4	122.6	-103.2	140.5	0	0	0	109.1
554	D	36.6	Very low	44.7	Very low	160 Å²	160	156.6 Å²	156.6	86%	0.856	81%	0.805	S	S	*	*			trans	-66	140.1	171.5	-101.6	-39.2	0	0	0	110.7
555	F	41.1	Very low	44	Very low	186 Å²	186	158.2 Å²	158.2	82%	0.816	82%	0.817	S	S	*	*			trans	-55.9	129.7	162.2	-107.5	-103.9	0	0	0	110.6
556	N	36.1	Very low	43.3	Very low	164 Å²	164	157.2 Å²	157.2	88%	0.877	82%	0.821	S	S	*	*			trans	-156.4	135.2	135	-114.5	-25.9	0	0	0	114.3
557	H	41	Very low	42.5	Very low	141 Å²	141	161.6 Å²	161.6	65%	0.653	83%	0.833	S	S	*	*			trans	-60.1	145.9	178.5	-114	-90.3	0	0	0	113.2
558	H	37.7	Very low	41.6	Very low	187 Å²	187	165.8 Å²	165.8	87%	0.866	84%	0.842	S	S	*	*				-158.1	133	130	-110.4	-71.3	0	0	0	112.2
559	L	41.8	Very low	40.7	Very low	147 Å²	147	165.7 Å²	165.7	77%	0.77	85%	0.847	S	S	*	*			trans	-63.8	137.4	178.4	-73.5	107.9	0	0	0	113.3
560	K	34.2	Very low	39.9	Very low	280 Å²	280	163.7 Å²	163.7	100%	1.217	85%	0.846	S	S	*	*				-168	0	110	-125.5	177.1	-176.8	178.6	0	111.7

Retrieved 560 of 560 residues in 859.4 ms (Link to these results)

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