A0A087Y1L4_POEFO Loading...

Syntaxin-1A

Essential for epithelial morphogenesis. May mediate Ca(2+)-regulation of exocytosis acrosomal reaction in sperm. Plays an essential role in hormone and neurotransmitter calcium-dependent exocytosis and endocytosis. Part of the SNARE (Soluble NSF Attachment Receptor) complex composed of SNAP25, STX1A and VAMP2 which mediates the fusion of synaptic vesicles with the presynaptic plasma membrane. STX1A and SNAP25 are localized on the plasma membrane while VAMP2 resides in synaptic vesicles. The pairing of the three SNAREs from the N-terminal SNARE motifs to the C-terminal anchors leads to the formation of the SNARE complex, which brings membranes into close proximity and results in final fusion. Participates in the calcium-dependent regulation of acrosomal exocytosis in sperm. Also plays an important role in the exocytosis of hormones such as insulin or glucagon-like peptide 1 (GLP-1).

AlphaFold DB , UniProt , Accession A0A087Y1L4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 287 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.3	Very low	59.2	Low	249 Å²	249	151.8 Å²	151.8	100%	1.227	71%	0.71	S	S	*	*				0	128.6	0	-92.2	167.8	171.5	0	0	107.9
2	K	53.9	Low	58.4	Low	199 Å²	199	150.3 Å²	150.3	87%	0.865	70%	0.699	S	S	*	*			trans	-75.3	130.2	174.9	-76.8	176.2	175.6	175.5	0	108.4	R4	K2-R4 PolarHBondContact O-N 3.32Å
3	D	62.8	Low	57.5	Low	129 Å²	129	149.9 Å²	149.9	69%	0.69	70%	0.698	S	S	*	*			trans	-63.7	115.6	178.5	-174.5	1.8	0	0	0	110	M5	D3-M5 WeakPolarHBondContact OD1-CB 3.47Å; D3-M5 PolarHBondContact OD1-N 3Å
4	R	73.8	Confident	56.8	Low	176 Å²	176	147.6 Å²	147.6	66%	0.664	70%	0.699	S	S	*	*			trans	-104.1	11.4	177.2	-75.9	-166.5	169.1	-173.2	-2.5	112.5	K2 Q6 E7	K2-R4 PolarHBondContact O-N 3.32Å; R4-Q6 PolarHBondContact O-N 3.3Å; R4-E7 WeakPolarHBondContact CD-OE2 3.31Å; R4-E7 IonicContact NE-OE2 2.58Å; R4-E7 PolarHBondContact O-N 3.45Å; R4-E7 VanDerWaalsContact O-N 3.11Å
5	M	63.3	Low	56.1	Low	117 Å²	117	145 Å²	145	58%	0.576	70%	0.697	S	S	*	*	H	α-helix	trans	-60.8	-27.3	-178.3	-170.6	179.3	-66.8	0	0	112.7	D3	D3-M5 WeakPolarHBondContact OD1-CB 3.47Å; D3-M5 PolarHBondContact OD1-N 3Å
6	Q	63.8	Low	55.5	Low	161 Å²	161	146.9 Å²	146.9	75%	0.752	71%	0.705	S	S	*	*	H	α-helix	trans	-71.3	-31.6	176.9	-73.4	-178	-13	0	0	113.5	R4 L8 R9	R4-Q6 PolarHBondContact O-N 3.3Å; Q6-L8 VanDerWaalsContact C-N 3.28Å; Q6-L8 PolarHBondContact O-N 3.34Å; Q6-R9 PolarHBondContact O-N 2.74Å
7	E	67.4	Low	54.9	Low	121 Å²	121	149.7 Å²	149.7	57%	0.565	72%	0.717	S	S	*	*	H	α-helix	trans	-67.8	-31.2	179.2	-67.2	176.8	179.3	0	0	111.5	R4	R4-E7 WeakPolarHBondContact CD-OE2 3.31Å; R4-E7 IonicContact NE-OE2 2.58Å; R4-E7 PolarHBondContact O-N 3.45Å; R4-E7 VanDerWaalsContact O-N 3.11Å
8	L	60	Low	54.1	Low	123 Å²	123	149.5 Å²	149.5	64%	0.644	72%	0.715	S	S	*	*	H	α-helix	trans	-75.3	-25.3	178.4	-73.7	162.8	0	0	0	113.6	Q6 S11	Q6-L8 VanDerWaalsContact C-N 3.28Å; Q6-L8 PolarHBondContact O-N 3.34Å; L8-S11 PolarHBondContact O-OG 2.86Å; L8-S11 VanDerWaalsContact O-OG 3.08Å
9	R	59.3	Low	53.4	Low	186 Å²	186	150 Å²	150	70%	0.702	72%	0.722	S	S	*	*	H	α-helix	trans	-72.3	-38.8	176.6	-72.6	-170.7	177.1	-152.1	-0.1	111.5	Q6 S11 K12	Q6-R9 PolarHBondContact O-N 2.74Å; R9-S11 PolarHBondContact O-N 3.29Å; R9-K12 PolarHBondContact O-N 3.48Å
10	H	53.5	Low	52.6	Low	143 Å²	143	152.1 Å²	152.1	66%	0.662	73%	0.731	S	S	*	*	H	α-helix	trans	-71.8	-26.6	178.2	-94.6	-39.9	0	0	0	114	K12 E13	H10-K12 VanDerWaalsContact C-N 3.28Å; H10-K12 PolarHBondContact O-N 3.3Å; H10-E13 IonicContact ND1-OE2 3.65Å; H10-E13 PolarHBondContact ND1-OE2 3.06Å
11	S	50.2	Low	52.2	Low	66 Å²	66	150.7 Å²	150.7	46%	0.462	73%	0.731	S	S	.	*	H	α-helix	trans	-73.5	-20.8	174.3	63.4	0	0	0	0	113.4	L8 R9 T14	L8-S11 PolarHBondContact O-OG 2.86Å; L8-S11 VanDerWaalsContact O-OG 3.08Å; R9-S11 PolarHBondContact O-N 3.29Å; S11-T14 PolarHBondContact O-OG1 3.14Å
12	K	49.3	Very low	51.9	Low	133 Å²	133	143.4 Å²	143.4	58%	0.578	71%	0.711	S	S	*	*	H	α-helix	trans	-77.9	-29.4	-176.2	-146	-179.4	-177.1	-168.6	0	112.7	R9 H10 T14 T15	R9-K12 PolarHBondContact O-N 3.48Å; H10-K12 VanDerWaalsContact C-N 3.28Å; H10-K12 PolarHBondContact O-N 3.3Å; K12-T14 PolarHBondContact O-N 3.07Å; K12-T15 PolarHBondContact O-N 3.38Å
13	E	46.8	Very low	51.4	Low	146 Å²	146	140.1 Å²	140.1	68%	0.682	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-14	179.3	-70.4	177.4	158.8	0	0	113.9	H10	H10-E13 IonicContact ND1-OE2 3.65Å; H10-E13 PolarHBondContact ND1-OE2 3.06Å
14	T	47.5	Very low	50.3	Low	117 Å²	117	136.9 Å²	136.9	72%	0.718	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	0.3	-178.7	36.7	0	0	0	0	115.5	S11 K12	S11-T14 PolarHBondContact O-OG1 3.14Å; K12-T14 PolarHBondContact O-N 3.07Å
15	T	47.1	Very low	48.9	Very low	109 Å²	109	137.9 Å²	137.9	67%	0.669	72%	0.719	S	S	*	*			trans	-141.9	65.8	-178.3	-36.2	0	0	0	0	111.6	K12	K12-T15 PolarHBondContact O-N 3.38Å
16	E	46.2	Very low	48.3	Very low	175 Å²	175	139.3 Å²	139.3	82%	0.818	73%	0.729	S	S	*	*			trans	-95.4	85.6	168.8	-73.1	-171.8	170.3	0	0	110.6
17	E	45.2	Very low	48	Very low	195 Å²	195	140.2 Å²	140.2	91%	0.911	73%	0.73	S	S	*	*			trans	-142	72	144.4	-76.9	-166.7	176.1	0	0	106.2
18	E	41.5	Very low	48.1	Very low	146 Å²	146	136.4 Å²	136.4	68%	0.682	72%	0.724	S	S	*	*			trans	-89	108.9	170.5	-75.6	-174.8	169.7	0	0	108.6	E20	E18-E20 PolarHBondContact O-N 3.25Å; E18-E20 VanDerWaalsContact O-N 3.1Å
19	D	40	Very low	49.1	Very low	159 Å²	159	137 Å²	137	85%	0.85	72%	0.721	S	S	*	*			trans	-54.7	108.3	157.1	-114.8	-24.7	0	0	0	107	V21	D19-V21 VanDerWaalsContact C-N 3.27Å; D19-V21 PolarHBondContact O-N 3.45Å
20	E	37.4	Very low	50.2	Low	191 Å²	191	129 Å²	129	89%	0.893	69%	0.692	S	S	*	*			trans	-64.4	88.6	172.9	-91.6	-170.7	153.1	0	0	109.3	E18 A22	E18-E20 PolarHBondContact O-N 3.25Å; E18-E20 VanDerWaalsContact O-N 3.1Å; E20-A22 VanDerWaalsContact C-N 3.29Å; E20-A22 PolarHBondContact O-N 3Å
21	V	44.2	Very low	51.9	Low	123 Å²	123	128 Å²	128	75%	0.745	69%	0.687	S	S	*	*			trans	-74.6	93.2	160.7	-163.6	0	0	0	0	105.8	D19 V23	D19-V21 VanDerWaalsContact C-N 3.27Å; D19-V21 PolarHBondContact O-N 3.45Å; V21-V23 VanDerWaalsContact C-N 3.32Å; V21-V23 PolarHBondContact O-N 3.45Å
22	A	36.7	Very low	53.8	Low	96 Å²	96	131.6 Å²	131.6	79%	0.793	70%	0.697	S	S	*	*			trans	-56.2	96.6	171.9	0	0	0	0	0	109.2	E20 G24	E20-A22 VanDerWaalsContact C-N 3.29Å; E20-A22 PolarHBondContact O-N 3Å; A22-G24 PolarHBondContact O-N 3.19Å; A22-G24 VanDerWaalsContact O-N 3.13Å
23	V	44.7	Very low	55.8	Low	130 Å²	130	125.5 Å²	125.5	79%	0.788	67%	0.671	S	S	*	*			trans	-70.5	105.7	166.7	179.8	0	0	0	0	105.1	V21 M25	V21-V23 VanDerWaalsContact C-N 3.32Å; V21-V23 PolarHBondContact O-N 3.45Å; V23-M25 PolarHBondContact O-N 3.38Å
24	G	38.1	Very low	58	Low	61 Å²	61	122.1 Å²	122.1	63%	0.629	65%	0.654	S	S	*	*			trans	-51	125.6	173.2	0	0	0	0	0	109.2	A22 D26	A22-G24 PolarHBondContact O-N 3.19Å; A22-G24 VanDerWaalsContact O-N 3.13Å; G24-D26 PolarHBondContact O-N 2.94Å
25	M	44.3	Very low	60.3	Low	197 Å²	197	123.1 Å²	123.1	97%	0.97	65%	0.651	S	S	*	*			trans	-63.9	76.2	163.4	-86.7	151.2	59.4	0	0	107.8	V23	V23-M25 PolarHBondContact O-N 3.38Å
26	D	50.9	Low	62.5	Low	147 Å²	147	120.9 Å²	120.9	79%	0.786	63%	0.632	S	S	*	*			trans	-70.7	149.8	159.4	-155.5	11.4	0	0	0	107.3	G24	G24-D26 PolarHBondContact O-N 2.94Å
27	K	57.8	Low	64.8	Low	180 Å²	180	112.8 Å²	112.8	78%	0.783	60%	0.595	S	S	*	*	S	Bend	trans	-36.2	146.1	-171.5	-67	172.2	175	179.7	0	114.1	F29	K27-F29 PolarHBondContact O-N 2.66Å
28	G	69.4	Low	67.2	Low	42 Å²	42	108.6 Å²	108.6	43%	0.433	58%	0.575	S	S	.	*			trans	-47.2	138.3	-174.8	0	0	0	0	0	112.2	M30 E31	G28-M30 PolarHBondContact O-N 3.01Å; G28-E31 PolarHBondContact N-OE2 3.13Å; G28-E31 VanDerWaalsContact O-CB 3.28Å; G28-E31 WeakPolarHBondContact O-CB 3.4Å; G28-E31 PolarHBondContact O-N 3.11Å
29	F	80.4	Confident	69.9	Low	136 Å²	136	105.1 Å²	105.1	60%	0.596	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.1	116.5	-179.7	172.3	-107.1	0	0	0	110.8	K27 E31 I115	K27-F29 PolarHBondContact O-N 2.66Å; F29-E31 PolarHBondContact O-N 3.09Å; F29-I115 HydrophobicContact CE1-CD1 4.04Å; F29-I115 HydrophobicContact CZ-CD1 4.15Å
30	M	83.2	Confident	72.6	Confident	18 Å²	18	97.6 Å²	97.6	9%	0.089	52%	0.519	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	26.8	-177.8	-63.9	-165.3	-54.8	0	0	115.7	G28 E32 F33 F34 D112 I115	G28-M30 PolarHBondContact O-N 3.01Å; M30-E32 PolarHBondContact O-N 2.79Å; M30-F33 HydrophobicContact CB-CB 4.23Å; M30-F33 HydrophobicContact CB-CD1 4.47Å; M30-F33 HydrophobicContact CE-CD1 4.47Å; M30-F33 WeakPolarHBondContact O-CB 3.37Å; M30-F33 PolarHBondContact O-N 3.17Å; M30-F33 HydrophobicContact SD-CD1 4.21Å; M30-F34 HydrophobicContact CB-CD2 3.83Å; M30-F34 HydrophobicContact CB-CE2 3.67Å; M30-F34 HydrophobicContact CB-CZ 4.47Å; M30-F34 HydrophobicContact CE-CE1 4.25Å; M30-F34 HydrophobicContact CE-CE2 3.55Å; M30-F34 HydrophobicContact CE-CZ 3.36Å; M30-F34 VanDerWaalsContact O-CD2 3.25Å; M30-F34 WeakPolarHBondContact O-CD2 3.22Å; M30-F34 PolarHBondContact O-N 2.85Å; M30-D112 WeakPolarHBondContact CG-OD1 3.38Å; M30-D112 HydrophobicContact SD-CB 4.08Å; M30-I115 HydrophobicContact CE-CB 3.71Å; M30-I115 HydrophobicContact CE-CD1 3.55Å; M30-I115 HydrophobicContact CE-CG1 4.2Å; M30-I115 HydrophobicContact CE-CG2 3.37Å; M30-I115 HydrophobicContact SD-CB 4.34Å; M30-I115 HydrophobicContact SD-CG2 4.33Å
31	E	89.7	Confident	75.4	Confident	120 Å²	120	94.2 Å²	94.2	56%	0.561	50%	0.498	S	S	*	.	H	α-helix	trans	-53.3	-49.3	-174.9	-175.8	170.6	-168.3	0	0	113	G28 F29 F33 F34 E35	G28-E31 PolarHBondContact N-OE2 3.13Å; G28-E31 VanDerWaalsContact O-CB 3.28Å; G28-E31 WeakPolarHBondContact O-CB 3.4Å; G28-E31 PolarHBondContact O-N 3.11Å; F29-E31 PolarHBondContact O-N 3.09Å; E31-F33 VanDerWaalsContact C-N 3.3Å; E31-F33 PolarHBondContact O-N 3.41Å; E31-F34 PolarHBondContact O-N 3.34Å; E31-E35 PolarHBondContact O-N 2.99Å
32	E	89.8	Confident	78	Confident	143 Å²	143	89.6 Å²	89.6	67%	0.668	48%	0.475	S	S	*	.	H	α-helix	trans	-61.4	-37	177.6	-176.6	-179.7	177.1	0	0	112.6	M30 Q36	M30-E32 PolarHBondContact O-N 2.79Å; E32-Q36 WeakPolarHBondContact O-CG 3.49Å; E32-Q36 PolarHBondContact O-N 3.39Å; E32-Q36 VanDerWaalsContact O-N 3.15Å
33	F	90.6	Very high	80.9	Confident	4 Å²	4	87.2 Å²	87.2	2%	0.018	45%	0.447	C	S	.	.	H	α-helix	trans	-70.1	-42.3	178.2	172.1	-107.5	0	0	0	111.4	M30 E31 E35 Q36 V37 I96 I115 R116 Q119	M30-F33 HydrophobicContact CB-CB 4.23Å; M30-F33 HydrophobicContact CB-CD1 4.47Å; M30-F33 HydrophobicContact CE-CD1 4.47Å; M30-F33 WeakPolarHBondContact O-CB 3.37Å; M30-F33 PolarHBondContact O-N 3.17Å; M30-F33 HydrophobicContact SD-CD1 4.21Å; E31-F33 VanDerWaalsContact C-N 3.3Å; E31-F33 PolarHBondContact O-N 3.41Å; F33-E35 VanDerWaalsContact C-N 3.32Å; F33-Q36 WeakPolarHBondContact O-CB 3.47Å; F33-Q36 PolarHBondContact O-N 3.17Å; F33-V37 HydrophobicContact CD1-CG2 4.32Å; F33-V37 HydrophobicContact CD2-CG2 4.41Å; F33-V37 HydrophobicContact CE1-CG2 3.75Å; F33-V37 HydrophobicContact CE2-CG2 3.86Å; F33-V37 HydrophobicContact CZ-CG2 3.48Å; F33-V37 VanDerWaalsContact CZ-CG2 3.48Å; F33-V37 WeakPolarHBondContact O-CG2 3.49Å; F33-V37 PolarHBondContact O-N 3.41Å; F33-I96 HydrophobicContact CE2-CD1 4.15Å; F33-I96 HydrophobicContact CE2-CG1 4.35Å; F33-I96 HydrophobicContact CE2-CG2 4.02Å; F33-I115 HydrophobicContact CE1-CG2 4.21Å; F33-R116 HydrophobicContact CD1-CG 4.27Å; F33-R116 HydrophobicContact CD2-CG 4.11Å; F33-R116 VanDerWaalsContact CD2-NH1 3.3Å; F33-R116 HydrophobicContact CE1-CG 4.05Å; F33-R116 HydrophobicContact CE2-CB 4.29Å; F33-R116 HydrophobicContact CE2-CG 3.88Å; F33-R116 HydrophobicContact CG-CG 4.3Å; F33-R116 HydrophobicContact CZ-CB 4.09Å; F33-R116 HydrophobicContact CZ-CG 3.86Å; F33-Q119 HydrophobicContact CE1-CB 4.11Å; F33-Q119 HydrophobicContact CE1-CG 3.99Å; F33-Q119 HydrophobicContact CZ-CB 3.76Å; F33-Q119 HydrophobicContact CZ-CG 4.18Å
34	F	93.8	Very high	83.4	Confident	75 Å²	75	81.3 Å²	81.3	33%	0.329	41%	0.411	S	S	.	.	H	α-helix	trans	-67.2	-34.5	176.9	-72.2	-57.6	0	0	0	112.3	M30 E31 Q36 V37 E38 I115	M30-F34 HydrophobicContact CB-CD2 3.83Å; M30-F34 HydrophobicContact CB-CE2 3.67Å; M30-F34 HydrophobicContact CB-CZ 4.47Å; M30-F34 HydrophobicContact CE-CE1 4.25Å; M30-F34 HydrophobicContact CE-CE2 3.55Å; M30-F34 HydrophobicContact CE-CZ 3.36Å; M30-F34 VanDerWaalsContact O-CD2 3.25Å; M30-F34 WeakPolarHBondContact O-CD2 3.22Å; M30-F34 PolarHBondContact O-N 2.85Å; E31-F34 PolarHBondContact O-N 3.34Å; F34-Q36 VanDerWaalsContact C-N 3.34Å; F34-Q36 PolarHBondContact O-N 3.35Å; F34-V37 PolarHBondContact O-N 3.32Å; F34-E38 PolarHBondContact O-N 2.93Å; F34-I115 HydrophobicContact CE1-CG2 4.2Å; F34-I115 HydrophobicContact CZ-CG2 4.17Å
35	E	94.7	Very high	86.2	Confident	139 Å²	139	82.9 Å²	82.9	65%	0.65	40%	0.402	S	S	*	.	H	α-helix	trans	-59.7	-44.7	171.3	-171.3	176.6	-171.9	0	0	111.2	E31 F33 V37 E38 E39	E31-E35 PolarHBondContact O-N 2.99Å; F33-E35 VanDerWaalsContact C-N 3.32Å; E35-V37 PolarHBondContact O-N 3.32Å; E35-E38 PolarHBondContact O-N 3.05Å; E35-E39 WeakPolarHBondContact O-CB 3.24Å; E35-E39 PolarHBondContact O-N 2.77Å
36	Q	94.6	Very high	88.8	Confident	61 Å²	61	76.3 Å²	76.3	29%	0.285	37%	0.373	S	S	.	.	H	α-helix	trans	-62.8	-40.4	174.4	-70.2	178.6	-3.1	0	0	112.8	E32 F33 F34 E39 I40	E32-Q36 WeakPolarHBondContact O-CG 3.49Å; E32-Q36 PolarHBondContact O-N 3.39Å; E32-Q36 VanDerWaalsContact O-N 3.15Å; F33-Q36 WeakPolarHBondContact O-CB 3.47Å; F33-Q36 PolarHBondContact O-N 3.17Å; F34-Q36 VanDerWaalsContact C-N 3.34Å; F34-Q36 PolarHBondContact O-N 3.35Å; Q36-E39 PolarHBondContact O-N 2.9Å; Q36-I40 WeakPolarHBondContact O-CD1 3.48Å; Q36-I40 VanDerWaalsContact O-CG1 3.22Å; Q36-I40 WeakPolarHBondContact O-CG1 3.39Å; Q36-I40 PolarHBondContact O-N 3.12Å
37	V	94.7	Very high	91	Very high	6 Å²	6	69.3 Å²	69.3	4%	0.036	34%	0.336	C	S	.	.	H	α-helix	trans	-63.3	-47.5	178	165.7	0	0	0	0	111	F33 F34 E35 E39 I40 R41 Q119 L123	F33-V37 HydrophobicContact CD1-CG2 4.32Å; F33-V37 HydrophobicContact CD2-CG2 4.41Å; F33-V37 HydrophobicContact CE1-CG2 3.75Å; F33-V37 HydrophobicContact CE2-CG2 3.86Å; F33-V37 HydrophobicContact CZ-CG2 3.48Å; F33-V37 VanDerWaalsContact CZ-CG2 3.48Å; F33-V37 WeakPolarHBondContact O-CG2 3.49Å; F33-V37 PolarHBondContact O-N 3.41Å; F34-V37 PolarHBondContact O-N 3.32Å; E35-V37 PolarHBondContact O-N 3.32Å; V37-E39 VanDerWaalsContact C-N 3.34Å; V37-I40 PolarHBondContact O-N 3.39Å; V37-R41 WeakPolarHBondContact O-CB 3.38Å; V37-R41 PolarHBondContact O-N 3.43Å; V37-Q119 HydrophobicContact CG2-CB 4.02Å; V37-Q119 HydrophobicContact CG2-CG 4.33Å; V37-L123 HydrophobicContact CB-CD1 4.34Å; V37-L123 HydrophobicContact CG1-CD1 4.06Å; V37-L123 HydrophobicContact CG2-CD1 4.2Å
38	E	95.4	Very high	92.9	Very high	106 Å²	106	62.4 Å²	62.4	50%	0.495	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-36.3	178.4	-72.3	-59.1	147	0	0	111.9	F34 E35 R41 G42	F34-E38 PolarHBondContact O-N 2.93Å; E35-E38 PolarHBondContact O-N 3.05Å; E38-R41 PolarHBondContact O-N 3.42Å; E38-R41 IonicContact OE1-NH1 2.84Å; E38-R41 IonicContact OE2-NH1 2.58Å; E38-G42 PolarHBondContact O-N 2.95Å
39	E	96.4	Very high	94.2	Very high	74 Å²	74	66.6 Å²	66.6	35%	0.346	32%	0.32	S	S	.	.	H	α-helix	trans	-63	-47.1	173.7	-170.1	-169.8	173.9	0	0	111.8	E35 Q36 V37 R41 G42 F43 K92	E35-E39 WeakPolarHBondContact O-CB 3.24Å; E35-E39 PolarHBondContact O-N 2.77Å; Q36-E39 PolarHBondContact O-N 2.9Å; V37-E39 VanDerWaalsContact C-N 3.34Å; E39-R41 VanDerWaalsContact C-N 3.3Å; E39-R41 PolarHBondContact O-N 3.45Å; E39-G42 PolarHBondContact O-N 3.21Å; E39-F43 HydrophobicContact CG-CD2 4.45Å; E39-F43 HydrophobicContact CG-CE1 4.18Å; E39-F43 HydrophobicContact CG-CE2 3.82Å; E39-F43 HydrophobicContact CG-CZ 3.64Å; E39-F43 VanDerWaalsContact O-CG 3.31Å; E39-F43 WeakPolarHBondContact O-CG 3.42Å; E39-F43 PolarHBondContact O-N 3.04Å; E39-F43 WeakPolarHBondContact OE1-CZ 3.45Å; E39-K92 WeakPolarHBondContact OE1-CE 3.28Å; E39-K92 IonicContact OE1-NZ 2.58Å; E39-K92 PolarHBondContact OE1-NZ 2.95Å; E39-K92 WeakPolarHBondContact OE2-CE 3.34Å; E39-K92 IonicContact OE2-NZ 3.54Å; E39-K92 PolarHBondContact OE2-NZ 3.34Å
40	I	97.1	Very high	95	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-43.4	176.5	-66.6	164.6	0	0	0	110.2	Q36 V37 F43 I44 I89 K92 L93 I96 L123	Q36-I40 WeakPolarHBondContact O-CD1 3.48Å; Q36-I40 VanDerWaalsContact O-CG1 3.22Å; Q36-I40 WeakPolarHBondContact O-CG1 3.39Å; Q36-I40 PolarHBondContact O-N 3.12Å; V37-I40 PolarHBondContact O-N 3.39Å; I40-F43 WeakPolarHBondContact O-CB 3.41Å; I40-F43 PolarHBondContact O-N 3.48Å; I40-I44 HydrophobicContact CG2-CD1 3.87Å; I40-I44 HydrophobicContact CG2-CG1 4.41Å; I40-I44 WeakPolarHBondContact O-CG1 3.42Å; I40-I44 PolarHBondContact O-N 3.34Å; I40-I89 HydrophobicContact CG2-CG2 4.16Å; I40-K92 HydrophobicContact CD1-CB 3.76Å; I40-K92 HydrophobicContact CG1-CB 3.72Å; I40-K92 HydrophobicContact CG1-CD 3.83Å; I40-K92 HydrophobicContact CG1-CG 4.43Å; I40-L93 HydrophobicContact CD1-CD2 4.37Å; I40-L93 HydrophobicContact CG2-CD2 4.35Å; I40-I96 HydrophobicContact CD1-CD1 3.43Å; I40-I96 VanDerWaalsContact CD1-CD1 3.43Å; I40-L123 HydrophobicContact CB-CD1 4.07Å; I40-L123 HydrophobicContact CD1-CD1 4.13Å; I40-L123 HydrophobicContact CG2-CB 4.28Å; I40-L123 HydrophobicContact CG2-CD1 3.94Å; I40-L123 HydrophobicContact CG2-CD2 4.15Å; I40-L123 HydrophobicContact CG2-CG 4.36Å
41	R	97.2	Very high	95.6	Very high	120 Å²	120	61.3 Å²	61.3	45%	0.453	30%	0.297	S	S	.	.	H	α-helix	trans	-59.7	-48.4	177.4	-178.4	-175.2	166.7	-173.4	-0.4	111.5	V37 E38 E39 F43 I44 E45 L123	V37-R41 WeakPolarHBondContact O-CB 3.38Å; V37-R41 PolarHBondContact O-N 3.43Å; E38-R41 PolarHBondContact O-N 3.42Å; E38-R41 IonicContact OE1-NH1 2.84Å; E38-R41 IonicContact OE2-NH1 2.58Å; E39-R41 VanDerWaalsContact C-N 3.3Å; E39-R41 PolarHBondContact O-N 3.45Å; R41-F43 VanDerWaalsContact C-N 3.26Å; R41-F43 PolarHBondContact O-N 3.1Å; R41-I44 PolarHBondContact O-N 3.41Å; R41-I44 VanDerWaalsContact O-N 3.08Å; R41-E45 IonicContact CZ-OE1 2.77Å; R41-E45 IonicContact NE-OE1 3.47Å; R41-E45 PolarHBondContact NE-OE1 3.1Å; R41-E45 IonicContact NH2-OE1 2.78Å; R41-E45 WeakPolarHBondContact O-CG 3.35Å; R41-E45 PolarHBondContact O-N 3.43Å; R41-L123 HydrophobicContact CB-CD2 4.13Å
42	G	97.9	Very high	96	Very high	26 Å²	26	59.5 Å²	59.5	27%	0.268	29%	0.288	S	S	.	.	H	α-helix	trans	-60.4	-36.2	176.7	0	0	0	0	0	112.4	E38 E39 E45 T46	E38-G42 PolarHBondContact O-N 2.95Å; E39-G42 PolarHBondContact O-N 3.21Å; G42-E45 PolarHBondContact O-N 3.25Å; G42-T46 WeakPolarHBondContact O-CB 3.35Å; G42-T46 PolarHBondContact O-N 3.36Å; G42-T46 PolarHBondContact O-OG1 2.93Å
43	F	97.9	Very high	96.3	Very high	47 Å²	47	56.8 Å²	56.8	21%	0.206	28%	0.276	C	S	.	.	H	α-helix	trans	-66.5	-39.8	172.8	-67.3	-14.9	0	0	0	112.9	E39 I40 R41 T46 L47 L85 I89 K92	E39-F43 HydrophobicContact CG-CD2 4.45Å; E39-F43 HydrophobicContact CG-CE1 4.18Å; E39-F43 HydrophobicContact CG-CE2 3.82Å; E39-F43 HydrophobicContact CG-CZ 3.64Å; E39-F43 VanDerWaalsContact O-CG 3.31Å; E39-F43 WeakPolarHBondContact O-CG 3.42Å; E39-F43 PolarHBondContact O-N 3.04Å; E39-F43 WeakPolarHBondContact OE1-CZ 3.45Å; I40-F43 WeakPolarHBondContact O-CB 3.41Å; I40-F43 PolarHBondContact O-N 3.48Å; R41-F43 VanDerWaalsContact C-N 3.26Å; R41-F43 PolarHBondContact O-N 3.1Å; F43-T46 PolarHBondContact O-N 2.9Å; F43-L47 VanDerWaalsContact O-CB 3.26Å; F43-L47 WeakPolarHBondContact O-CB 3.43Å; F43-L47 PolarHBondContact O-N 3.46Å; F43-L85 HydrophobicContact CB-CD1 3.66Å; F43-L85 HydrophobicContact CB-CG 4.39Å; F43-L85 HydrophobicContact CD1-CD1 3.91Å; F43-L85 HydrophobicContact CD2-CD1 4.37Å; F43-L85 HydrophobicContact CG-CD1 3.73Å; F43-L85 WeakPolarHBondContact O-CD2 3.26Å; F43-I89 HydrophobicContact CB-CD1 3.87Å; F43-I89 HydrophobicContact CB-CG1 3.6Å; F43-I89 HydrophobicContact CD2-CG1 4.35Å; F43-I89 HydrophobicContact CG-CG1 4.48Å; F43-K92 HydrophobicContact CD2-CD 4.43Å; F43-K92 HydrophobicContact CE2-CD 4.09Å
44	I	97.2	Very high	96.5	Very high	5 Å²	5	56.6 Å²	56.6	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-66.1	-40.3	176.2	-67.2	166.5	0	0	0	110.8	I40 R41 L47 A48 I89 L123 K126 F127 V130	I40-I44 HydrophobicContact CG2-CD1 3.87Å; I40-I44 HydrophobicContact CG2-CG1 4.41Å; I40-I44 WeakPolarHBondContact O-CG1 3.42Å; I40-I44 PolarHBondContact O-N 3.34Å; R41-I44 PolarHBondContact O-N 3.41Å; R41-I44 VanDerWaalsContact O-N 3.08Å; I44-L47 WeakPolarHBondContact O-CB 3.2Å; I44-L47 PolarHBondContact O-N 3.13Å; I44-A48 PolarHBondContact O-N 3.32Å; I44-I89 HydrophobicContact CD1-CG2 4.48Å; I44-I89 HydrophobicContact CG1-CD1 3.89Å; I44-I89 HydrophobicContact CG1-CG1 4.38Å; I44-I89 HydrophobicContact CG1-CG2 4.19Å; I44-L123 HydrophobicContact CD1-CB 4.43Å; I44-L123 HydrophobicContact CD1-CD2 4.15Å; I44-K126 HydrophobicContact CD1-CB 4.39Å; I44-K126 HydrophobicContact CG2-CB 4.42Å; I44-K126 HydrophobicContact CG2-CG 3.74Å; I44-F127 HydrophobicContact CD1-CB 4.03Å; I44-F127 HydrophobicContact CG1-CB 4.3Å; I44-V130 HydrophobicContact CG2-CG2 4Å
45	E	97.8	Very high	96.6	Very high	95 Å²	95	55.5 Å²	55.5	44%	0.444	27%	0.27	S	S	.	.	H	α-helix	trans	-62.7	-47.9	175.7	-70.8	173.1	-174.2	0	0	110.8	R41 G42 L47 A48 E49	R41-E45 IonicContact CZ-OE1 2.77Å; R41-E45 IonicContact NE-OE1 3.47Å; R41-E45 PolarHBondContact NE-OE1 3.1Å; R41-E45 IonicContact NH2-OE1 2.78Å; R41-E45 WeakPolarHBondContact O-CG 3.35Å; R41-E45 PolarHBondContact O-N 3.43Å; G42-E45 PolarHBondContact O-N 3.25Å; E45-L47 VanDerWaalsContact C-N 3.28Å; E45-L47 PolarHBondContact O-N 2.99Å; E45-A48 WeakPolarHBondContact O-CB 3.48Å; E45-A48 PolarHBondContact O-N 3.17Å; E45-E49 PolarHBondContact O-N 2.85Å
46	T	97.9	Very high	96.6	Very high	59 Å²	59	57.3 Å²	57.3	36%	0.362	27%	0.271	S	S	.	.	H	α-helix	trans	-60.8	-37.2	175	-55	0	0	0	0	112.1	G42 F43 E49 K50 L85	G42-T46 WeakPolarHBondContact O-CB 3.35Å; G42-T46 PolarHBondContact O-N 3.36Å; G42-T46 PolarHBondContact O-OG1 2.93Å; F43-T46 PolarHBondContact O-N 2.9Å; T46-E49 PolarHBondContact O-N 2.95Å; T46-K50 WeakPolarHBondContact O-CG 3.45Å; T46-K50 PolarHBondContact O-N 3.28Å; T46-K50 VanDerWaalsContact O-N 3.07Å; T46-L85 HydrophobicContact CG2-CD2 3.9Å
47	L	97.1	Very high	96.6	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.6	-46.1	176.7	179.5	68.4	0	0	0	110.7	F43 I44 E45 E49 K50 V51 I82 L85 I89 F127 V130 M131	F43-L47 VanDerWaalsContact O-CB 3.26Å; F43-L47 WeakPolarHBondContact O-CB 3.43Å; F43-L47 PolarHBondContact O-N 3.46Å; I44-L47 WeakPolarHBondContact O-CB 3.2Å; I44-L47 PolarHBondContact O-N 3.13Å; E45-L47 VanDerWaalsContact C-N 3.28Å; E45-L47 PolarHBondContact O-N 2.99Å; L47-E49 VanDerWaalsContact C-N 3.33Å; L47-E49 PolarHBondContact O-N 2.68Å; L47-K50 PolarHBondContact O-N 3Å; L47-V51 WeakPolarHBondContact O-CG2 3.11Å; L47-V51 PolarHBondContact O-N 3.26Å; L47-I82 HydrophobicContact CD1-CB 4.22Å; L47-I82 HydrophobicContact CD1-CG1 4.16Å; L47-I82 HydrophobicContact CD1-CG2 3.87Å; L47-L85 HydrophobicContact CB-CD2 3.73Å; L47-L85 HydrophobicContact CB-CG 4.31Å; L47-L85 HydrophobicContact CD1-CB 4.46Å; L47-L85 HydrophobicContact CD1-CD2 4.29Å; L47-I89 HydrophobicContact CB-CD1 4.4Å; L47-I89 HydrophobicContact CD2-CD1 3.9Å; L47-F127 HydrophobicContact CD2-CD2 3.85Å; L47-F127 HydrophobicContact CD2-CE2 3.68Å; L47-V130 HydrophobicContact CB-CG1 4.36Å; L47-V130 HydrophobicContact CD2-CB 4.46Å; L47-V130 HydrophobicContact CD2-CG1 3.83Å; L47-V130 HydrophobicContact CG-CG1 3.76Å; L47-M131 HydrophobicContact CD1-SD 4.48Å; L47-M131 HydrophobicContact CD2-SD 3.77Å
48	A	97.3	Very high	96.5	Very high	35 Å²	35	57.2 Å²	57.2	29%	0.289	27%	0.269	S	S	.	.	H	α-helix	trans	-60.8	-41.8	177.3	0	0	0	0	0	111.8	I44 E45 K50 V51 E52 V130	I44-A48 PolarHBondContact O-N 3.32Å; E45-A48 WeakPolarHBondContact O-CB 3.48Å; E45-A48 PolarHBondContact O-N 3.17Å; A48-K50 PolarHBondContact O-N 3.48Å; A48-V51 PolarHBondContact O-N 3.01Å; A48-E52 PolarHBondContact O-N 3.38Å; A48-E52 VanDerWaalsContact O-N 3.1Å; A48-V130 HydrophobicContact CB-CG1 4.04Å; A48-V130 HydrophobicContact CB-CG2 4.05Å
49	E	97.9	Very high	96.4	Very high	129 Å²	129	54.8 Å²	54.8	60%	0.603	26%	0.264	S	S	*	.	H	α-helix	trans	-59.3	-45.9	174.4	-70.6	178.3	176.1	0	0	112	E45 T46 L47 V51 E52 E53	E45-E49 PolarHBondContact O-N 2.85Å; T46-E49 PolarHBondContact O-N 2.95Å; L47-E49 VanDerWaalsContact C-N 3.33Å; L47-E49 PolarHBondContact O-N 2.68Å; E49-V51 VanDerWaalsContact C-N 3.32Å; E49-V51 PolarHBondContact O-N 3.33Å; E49-E52 WeakPolarHBondContact O-CB 3.45Å; E49-E52 PolarHBondContact O-N 3.49Å; E49-E52 VanDerWaalsContact O-N 3.16Å; E49-E53 PolarHBondContact O-N 2.97Å
50	K	96.9	Very high	96.2	Very high	41 Å²	41	53.7 Å²	53.7	18%	0.178	27%	0.268	C	S	.	.	H	α-helix	trans	-63.4	-36.6	177.4	-73.6	-179.1	176.7	-75	0	112.6	T46 L47 A48 E52 E53 V54 L78 D81 I82	T46-K50 WeakPolarHBondContact O-CG 3.45Å; T46-K50 PolarHBondContact O-N 3.28Å; T46-K50 VanDerWaalsContact O-N 3.07Å; L47-K50 PolarHBondContact O-N 3Å; A48-K50 PolarHBondContact O-N 3.48Å; K50-E52 VanDerWaalsContact C-N 3.32Å; K50-E52 PolarHBondContact O-N 2.98Å; K50-E53 PolarHBondContact O-N 3.28Å; K50-V54 WeakPolarHBondContact O-CG2 3.4Å; K50-V54 PolarHBondContact O-N 3.07Å; K50-L78 HydrophobicContact CG-CD2 4.27Å; K50-D81 HydrophobicContact CD-CB 3.92Å; K50-D81 IonicContact NZ-OD2 2.95Å; K50-D81 PolarHBondContact NZ-OD2 3.08Å; K50-I82 HydrophobicContact CB-CD1 4.09Å; K50-I82 HydrophobicContact CB-CG1 3.75Å; K50-I82 HydrophobicContact CD-CG1 4.42Å
51	V	96.2	Very high	95.9	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.012	27%	0.268	C	S	.	.	H	α-helix	trans	-61.6	-41.9	174.3	172.6	0	0	0	0	110.8	L47 A48 E49 V54 K55 I82 V130 E133 Y134	L47-V51 WeakPolarHBondContact O-CG2 3.11Å; L47-V51 PolarHBondContact O-N 3.26Å; A48-V51 PolarHBondContact O-N 3.01Å; E49-V51 VanDerWaalsContact C-N 3.32Å; E49-V51 PolarHBondContact O-N 3.33Å; V51-V54 WeakPolarHBondContact O-CB 3.25Å; V51-V54 PolarHBondContact O-N 3.03Å; V51-K55 PolarHBondContact O-N 3.31Å; V51-K55 VanDerWaalsContact O-N 3.12Å; V51-I82 HydrophobicContact CG2-CD1 4.21Å; V51-V130 HydrophobicContact CG2-CG1 4.26Å; V51-E133 HydrophobicContact CG1-CG 4.32Å; V51-Y134 HydrophobicContact CG1-CD2 4.31Å; V51-Y134 HydrophobicContact CG2-CD2 3.81Å; V51-Y134 HydrophobicContact CG2-CG 4.08Å
52	E	96.6	Very high	95.5	Very high	82 Å²	82	48.2 Å²	48.2	38%	0.383	25%	0.247	S	C	.	.	H	α-helix	trans	-65.9	-36.5	174.7	-70.6	-58.7	134.2	0	0	112.8	A48 E49 K50 K55 R56	A48-E52 PolarHBondContact O-N 3.38Å; A48-E52 VanDerWaalsContact O-N 3.1Å; E49-E52 WeakPolarHBondContact O-CB 3.45Å; E49-E52 PolarHBondContact O-N 3.49Å; E49-E52 VanDerWaalsContact O-N 3.16Å; K50-E52 VanDerWaalsContact C-N 3.32Å; K50-E52 PolarHBondContact O-N 2.98Å; E52-K55 WeakPolarHBondContact O-CB 3.47Å; E52-K55 PolarHBondContact O-N 3.19Å; E52-K55 IonicContact OE1-NZ 3.7Å; E52-K55 PolarHBondContact OE1-NZ 2.98Å; E52-K55 IonicContact OE2-NZ 2.68Å; E52-R56 WeakPolarHBondContact O-CG 3.42Å; E52-R56 PolarHBondContact O-N 3.29Å
53	E	96.7	Very high	95.1	Very high	87 Å²	87	50.9 Å²	50.9	41%	0.407	27%	0.266	S	S	.	.	H	α-helix	trans	-63.9	-41	172.9	-69.3	-171.9	159.8	0	0	112.1	E49 K50 K55 R56 K57 L78	E49-E53 PolarHBondContact O-N 2.97Å; K50-E53 PolarHBondContact O-N 3.28Å; E53-K55 VanDerWaalsContact C-N 3.35Å; E53-K55 PolarHBondContact O-N 2.94Å; E53-R56 WeakPolarHBondContact O-CB 3.29Å; E53-R56 PolarHBondContact O-N 3.08Å; E53-R56 VanDerWaalsContact O-N 3.14Å; E53-K57 WeakPolarHBondContact O-CG 3.46Å; E53-K57 PolarHBondContact O-N 3.38Å; E53-L78 HydrophobicContact CB-CD1 3.84Å; E53-L78 HydrophobicContact CB-CD2 4.28Å; E53-L78 VanDerWaalsContact OE2-CD2 3.26Å; E53-L78 WeakPolarHBondContact OE2-CD2 3.42Å
54	V	95.7	Very high	94.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.6	-46	174.2	165.6	0	0	0	0	111.1	K50 V51 R56 K57 H58 L75 L78 I82 Y134 T137	K50-V54 WeakPolarHBondContact O-CG2 3.4Å; K50-V54 PolarHBondContact O-N 3.07Å; V51-V54 WeakPolarHBondContact O-CB 3.25Å; V51-V54 PolarHBondContact O-N 3.03Å; V54-R56 VanDerWaalsContact C-N 3.28Å; V54-R56 PolarHBondContact O-N 3.15Å; V54-K57 PolarHBondContact O-N 3.15Å; V54-H58 WeakPolarHBondContact CG1-CD2 3.43Å; V54-H58 WeakPolarHBondContact CG1-NE2 3.31Å; V54-H58 WeakPolarHBondContact O-CB 3.26Å; V54-H58 PolarHBondContact O-CD2 2.89Å; V54-H58 PolarHBondContact O-N 3.45Å; V54-L75 HydrophobicContact CB-CD1 4.41Å; V54-L75 HydrophobicContact CG1-CD1 3.99Å; V54-L75 HydrophobicContact CG2-CD1 4.15Å; V54-L78 HydrophobicContact CG2-CB 3.82Å; V54-L78 HydrophobicContact CG2-CD1 4.24Å; V54-I82 HydrophobicContact CG2-CD1 3.67Å; V54-Y134 HydrophobicContact CG1-CE2 4.3Å; V54-Y134 HydrophobicContact CG2-CE2 4.45Å; V54-T137 HydrophobicContact CG1-CG2 4.2Å
55	K	94.9	Very high	93.6	Very high	52 Å²	52	53.3 Å²	53.3	23%	0.226	29%	0.289	C	S	.	.	H	α-helix	trans	-55.7	-42.3	175.1	-70.4	176.5	-178.4	172.8	0	112.6	V51 E52 E53 S59 E133 T137	V51-K55 PolarHBondContact O-N 3.31Å; V51-K55 VanDerWaalsContact O-N 3.12Å; E52-K55 WeakPolarHBondContact O-CB 3.47Å; E52-K55 PolarHBondContact O-N 3.19Å; E52-K55 IonicContact OE1-NZ 3.7Å; E52-K55 PolarHBondContact OE1-NZ 2.98Å; E52-K55 IonicContact OE2-NZ 2.68Å; E53-K55 VanDerWaalsContact C-N 3.35Å; E53-K55 PolarHBondContact O-N 2.94Å; K55-S59 WeakPolarHBondContact O-CB 3.36Å; K55-S59 PolarHBondContact O-N 3.43Å; K55-S59 PolarHBondContact O-OG 3.16Å; K55-E133 WeakPolarHBondContact CE-OE1 3.33Å; K55-E133 IonicContact NZ-OE1 2.73Å; K55-E133 PolarHBondContact NZ-OE1 3.45Å; K55-T137 HydrophobicContact CB-CG2 4.45Å; K55-T137 WeakPolarHBondContact CE-OG1 3.44Å; K55-T137 HydrophobicContact CG-CG2 3.43Å; K55-T137 VanDerWaalsContact CG-CG2 3.43Å
56	R	94.9	Very high	92.7	Very high	177 Å²	177	53.5 Å²	53.5	67%	0.668	29%	0.292	S	S	*	.	H	α-helix	trans	-66.3	-44.7	178.2	-68.6	176.3	-177.4	161.8	2.9	111.4	E52 E53 V54 S59 A60	E52-R56 WeakPolarHBondContact O-CG 3.42Å; E52-R56 PolarHBondContact O-N 3.29Å; E53-R56 WeakPolarHBondContact O-CB 3.29Å; E53-R56 PolarHBondContact O-N 3.08Å; E53-R56 VanDerWaalsContact O-N 3.14Å; V54-R56 VanDerWaalsContact C-N 3.28Å; V54-R56 PolarHBondContact O-N 3.15Å; R56-S59 PolarHBondContact O-N 3.31Å; R56-A60 PolarHBondContact O-N 3.05Å
57	K	93.8	Very high	92	Very high	57 Å²	57	51.2 Å²	51.2	25%	0.248	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-47.2	178.1	-65.6	-68	173.5	-175.7	0	111.5	E53 V54 S59 A60 I61 T71 E74 L75 L78	E53-K57 WeakPolarHBondContact O-CG 3.46Å; E53-K57 PolarHBondContact O-N 3.38Å; V54-K57 PolarHBondContact O-N 3.15Å; K57-S59 VanDerWaalsContact C-N 3.29Å; K57-S59 PolarHBondContact O-N 3.45Å; K57-A60 WeakPolarHBondContact O-CB 3.41Å; K57-A60 PolarHBondContact O-N 3.3Å; K57-A60 VanDerWaalsContact O-N 3.08Å; K57-I61 VanDerWaalsContact O-CG1 3.25Å; K57-I61 WeakPolarHBondContact O-CG1 3.43Å; K57-I61 PolarHBondContact O-N 3.02Å; K57-T71 HydrophobicContact CD-CG2 3.86Å; K57-E74 WeakPolarHBondContact CE-OE2 3.49Å; K57-E74 IonicContact NZ-OE2 2.72Å; K57-E74 PolarHBondContact NZ-OE2 3.46Å; K57-L75 HydrophobicContact CB-CB 4.36Å; K57-L75 HydrophobicContact CB-CD1 4.25Å; K57-L78 HydrophobicContact CG-CD1 3.96Å
58	H	93.5	Very high	91.5	Very high	7 Å²	7	55.3 Å²	55.3	3%	0.032	30%	0.301	C	S	.	.	H	α-helix	trans	-51.9	-47.3	172	-79.3	-31.1	0	0	0	112.7	V54 A60 I61 L62 Q138 Y141	V54-H58 WeakPolarHBondContact CG1-CD2 3.43Å; V54-H58 WeakPolarHBondContact CG1-NE2 3.31Å; V54-H58 WeakPolarHBondContact O-CB 3.26Å; V54-H58 PolarHBondContact O-CD2 2.89Å; V54-H58 PolarHBondContact O-N 3.45Å; H58-A60 VanDerWaalsContact C-N 3.35Å; H58-A60 PolarHBondContact O-N 2.94Å; H58-I61 PolarHBondContact O-N 2.79Å; H58-L62 PolarHBondContact O-N 2.9Å; H58-Q138 PolarHBondContact NE2-OE1 3.39Å; H58-Q138 VanDerWaalsContact NE2-OE1 3.1Å; H58-Y141 HydrophobicContact CB-CD2 3.32Å; H58-Y141 HydrophobicContact CB-CE2 3.45Å; H58-Y141 VanDerWaalsContact CB-CE2 3.45Å; H58-Y141 HydrophobicContact CB-CG 4.07Å; H58-Y141 AromaticContact CD2-CG 3.89Å; H58-Y141 AromaticContact CE1-CD1 3.43Å; H58-Y141 VanDerWaalsContact CE1-CD1 3.43Å; H58-Y141 WeakPolarHBondContact CE1-CD1 3.36Å; H58-Y141 AromaticContact CE1-CE1 3.74Å; H58-Y141 AromaticContact CE1-CG 3.67Å; H58-Y141 AromaticContact CG-CD2 3.32Å; H58-Y141 AromaticContact CG-CE2 3.58Å; H58-Y141 AromaticContact CG-CG 3.55Å; H58-Y141 AromaticContact ND1-CD1 3.4Å; H58-Y141 WeakPolarHBondContact ND1-CD1 3.34Å; H58-Y141 AromaticContact ND1-CD2 3.4Å; H58-Y141 WeakPolarHBondContact ND1-CD2 3.34Å; H58-Y141 AromaticContact ND1-CE1 3.42Å; H58-Y141 WeakPolarHBondContact ND1-CE1 3.48Å; H58-Y141 AromaticContact ND1-CE2 3.34Å; H58-Y141 VanDerWaalsContact ND1-CE2 3.34Å; H58-Y141 WeakPolarHBondContact ND1-CE2 3.22Å; H58-Y141 AromaticContact ND1-CG 3.4Å; H58-Y141 AromaticContact ND1-CZ 3.4Å; H58-Y141 AromaticContact NE2-CG 3.98Å; H58-Y141 WeakPolarHBondContact O-CE2 3.32Å
59	S	92.7	Very high	91.1	Very high	55 Å²	55	59.7 Å²	59.7	39%	0.385	32%	0.315	S	S	.	.	H	α-helix	trans	-63.2	-40.1	177.9	-62.6	0	0	0	0	112.6	K55 R56 K57 A63	K55-S59 WeakPolarHBondContact O-CB 3.36Å; K55-S59 PolarHBondContact O-N 3.43Å; K55-S59 PolarHBondContact O-OG 3.16Å; R56-S59 PolarHBondContact O-N 3.31Å; K57-S59 VanDerWaalsContact C-N 3.29Å; K57-S59 PolarHBondContact O-N 3.45Å; S59-A63 WeakPolarHBondContact O-CB 3.36Å; S59-A63 PolarHBondContact O-N 2.73Å; S59-A63 VanDerWaalsContact O-N 3.15Å
60	A	92.2	Very high	90.8	Very high	52 Å²	52	60.4 Å²	60.4	43%	0.43	32%	0.316	S	S	.	.	H	α-helix	trans	-65.9	-43.9	176.7	0	0	0	0	0	112.2	R56 K57 H58 L62 A63 T71	R56-A60 PolarHBondContact O-N 3.05Å; K57-A60 WeakPolarHBondContact O-CB 3.41Å; K57-A60 PolarHBondContact O-N 3.3Å; K57-A60 VanDerWaalsContact O-N 3.08Å; H58-A60 VanDerWaalsContact C-N 3.35Å; H58-A60 PolarHBondContact O-N 2.94Å; A60-L62 VanDerWaalsContact C-N 3.33Å; A60-L62 PolarHBondContact O-N 3.48Å; A60-A63 WeakPolarHBondContact O-CB 3.48Å; A60-A63 PolarHBondContact O-N 3.48Å; A60-A63 VanDerWaalsContact O-N 3.15Å; A60-T71 HydrophobicContact CB-CG2 4.44Å
61	I	91.3	Very high	90.5	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-64.4	-40.3	179.4	-61	167.8	0	0	0	110.2	K57 H58 A63 S64 P67 T71 L75 Y141 R197 E200	K57-I61 VanDerWaalsContact O-CG1 3.25Å; K57-I61 WeakPolarHBondContact O-CG1 3.43Å; K57-I61 PolarHBondContact O-N 3.02Å; H58-I61 PolarHBondContact O-N 2.79Å; I61-A63 VanDerWaalsContact C-N 3.27Å; I61-A63 PolarHBondContact O-N 3.41Å; I61-S64 VanDerWaalsContact O-O 3.06Å; I61-P67 HydrophobicContact CB-CB 4.16Å; I61-P67 HydrophobicContact CG1-CB 4.39Å; I61-P67 HydrophobicContact CG2-CB 3.52Å; I61-P67 HydrophobicContact CG2-CG 3.64Å; I61-T71 HydrophobicContact CD1-CG2 4.18Å; I61-T71 HydrophobicContact CG1-CG2 3.59Å; I61-L75 HydrophobicContact CD1-CB 4.27Å; I61-L75 HydrophobicContact CD1-CD2 3.54Å; I61-Y141 WeakPolarHBondContact CG2-OH 3.43Å; I61-R197 PolarHBondContact O-NH1 3.39Å; I61-R197 PolarHBondContact O-NH2 3.49Å; I61-E200 WeakPolarHBondContact CG2-OE1 3.5Å
62	L	89.4	Confident	90.2	Very high	3 Å²	3	60.8 Å²	60.8	2%	0.016	32%	0.319	C	S	.	.	H	α-helix	trans	-72.4	-16.3	176.5	-76.7	168.2	0	0	0	114.3	H58 A60 Y141 R144 R148	H58-L62 PolarHBondContact O-N 2.9Å; A60-L62 VanDerWaalsContact C-N 3.33Å; A60-L62 PolarHBondContact O-N 3.48Å; L62-Y141 HydrophobicContact CD1-CD2 3.58Å; L62-Y141 HydrophobicContact CD1-CE2 3.4Å; L62-Y141 HydrophobicContact CD2-CE2 4.31Å; L62-Y141 HydrophobicContact CG-CD2 4.23Å; L62-Y141 HydrophobicContact CG-CE2 3.53Å; L62-R144 HydrophobicContact CD1-CB 3.64Å; L62-R144 HydrophobicContact CD1-CG 4.41Å; L62-R144 HydrophobicContact CD2-CB 4.45Å; L62-R148 HydrophobicContact CD2-CG 3.94Å; L62-R148 PolarHBondContact O-NH2 3.01Å
63	A	90.2	Very high	90	Very high	81 Å²	81	59 Å²	59	67%	0.669	32%	0.318	S	S	*	.	H	α-helix	trans	-79	-20.9	179.1	0	0	0	0	0	112.7	S59 A60 I61	S59-A63 WeakPolarHBondContact O-CB 3.36Å; S59-A63 PolarHBondContact O-N 2.73Å; S59-A63 VanDerWaalsContact O-N 3.15Å; A60-A63 WeakPolarHBondContact O-CB 3.48Å; A60-A63 PolarHBondContact O-N 3.48Å; A60-A63 VanDerWaalsContact O-N 3.15Å; I61-A63 VanDerWaalsContact C-N 3.27Å; I61-A63 PolarHBondContact O-N 3.41Å
64	S	85.1	Confident	89.9	Confident	46 Å²	46	57.7 Å²	57.7	32%	0.322	31%	0.312	S	S	.	.			trans	-112	135.8	178.1	-174.2	0	0	0	0	111.3	I61 N66 R197	I61-S64 VanDerWaalsContact O-O 3.06Å; S64-N66 VanDerWaalsContact C-N 3.25Å; S64-N66 PolarHBondContact O-N 2.94Å; S64-N66 VanDerWaalsContact OG-C 3.22Å; S64-N66 PolarHBondContact OG-N 3.01Å; S64-N66 PolarHBondContact OG-O 3.42Å; S64-R197 PolarHBondContact O-NH2 3.4Å
65	P	76.6	Confident	89.8	Confident	58 Å²	58	58.4 Å²	58.4	38%	0.377	32%	0.316	S	S	.	.	S	Bend	trans	-58.7	-39.8	168.2	-23.7	34.3	0	0	0	112	P67	P65-P67 VanDerWaalsContact O-CD 3.26Å; P65-P67 WeakPolarHBondContact O-CD 3.17Å
66	N	79.8	Confident	89.6	Confident	98 Å²	98	60 Å²	60	52%	0.524	32%	0.324	S	S	.	.	S	Bend	trans	-116.7	83.6	176.9	-68.1	-31.8	0	0	0	108.7	S64	S64-N66 VanDerWaalsContact C-N 3.25Å; S64-N66 PolarHBondContact O-N 2.94Å; S64-N66 VanDerWaalsContact OG-C 3.22Å; S64-N66 PolarHBondContact OG-N 3.01Å; S64-N66 PolarHBondContact OG-O 3.42Å
67	P	82.8	Confident	89.6	Confident	12 Å²	12	56.6 Å²	56.6	8%	0.078	32%	0.319	C	S	.	.			trans	-60.2	141.8	174.2	23.8	-33.7	0	0	0	110.9	I61 P65 K72 T196	I61-P67 HydrophobicContact CB-CB 4.16Å; I61-P67 HydrophobicContact CG1-CB 4.39Å; I61-P67 HydrophobicContact CG2-CB 3.52Å; I61-P67 HydrophobicContact CG2-CG 3.64Å; P65-P67 VanDerWaalsContact O-CD 3.26Å; P65-P67 WeakPolarHBondContact O-CD 3.17Å; P67-K72 VanDerWaalsContact CG-CE 3.47Å; P67-T196 HydrophobicContact CG-CG2 4.15Å
68	D	87.4	Confident	89.7	Confident	85 Å²	85	54.6 Å²	54.6	46%	0.455	31%	0.311	S	S	.	.			trans	-68.9	142.1	178.6	65.2	-72.1	0	0	0	111.2	K70 T71 K72	D68-K70 PolarHBondContact O-N 3.48Å; D68-K70 WeakPolarHBondContact OD2-CB 3.32Å; D68-T71 PolarHBondContact O-N 3.2Å; D68-T71 VanDerWaalsContact OD1-CB 3.29Å; D68-T71 WeakPolarHBondContact OD1-CB 3.26Å; D68-T71 PolarHBondContact OD1-OG1 3.21Å; D68-T71 WeakPolarHBondContact OD2-CB 3.29Å; D68-T71 PolarHBondContact OD2-N 3.19Å; D68-T71 PolarHBondContact OD2-OG1 2.93Å; D68-K72 PolarHBondContact O-N 3.42Å
69	E	88.9	Confident	89.6	Confident	127 Å²	127	55.6 Å²	55.6	59%	0.593	32%	0.316	S	S	*	.	H	α-helix	trans	-63.2	-26.2	-176.6	-159.7	59.5	-155.3	0	0	112.2	K72 A73	E69-K72 PolarHBondContact O-N 2.88Å; E69-K72 IonicContact OE2-NZ 4Å; E69-A73 WeakPolarHBondContact O-CB 3.48Å; E69-A73 PolarHBondContact O-N 3.39Å
70	K	91.5	Very high	89.6	Confident	144 Å²	144	54.8 Å²	54.8	63%	0.626	31%	0.313	S	S	*	.	H	α-helix	trans	-66	-48.2	176.1	-178.6	-175.1	176.4	-170.7	0	111.3	D68 K72 A73 E74	D68-K70 PolarHBondContact O-N 3.48Å; D68-K70 WeakPolarHBondContact OD2-CB 3.32Å; K70-K72 VanDerWaalsContact C-N 3.26Å; K70-K72 PolarHBondContact O-N 3.44Å; K70-A73 PolarHBondContact O-N 2.87Å; K70-E74 WeakPolarHBondContact CE-OE1 3.48Å; K70-E74 IonicContact NZ-OE1 3.66Å; K70-E74 WeakPolarHBondContact O-CG 3.45Å; K70-E74 PolarHBondContact O-N 3.11Å
71	T	91.1	Very high	89.8	Confident	17 Å²	17	55.1 Å²	55.1	10%	0.104	31%	0.308	C	S	.	.	H	α-helix	trans	-61.6	-35.7	176.5	-61.9	0	0	0	0	111.7	K57 A60 I61 D68 L75	K57-T71 HydrophobicContact CD-CG2 3.86Å; A60-T71 HydrophobicContact CB-CG2 4.44Å; I61-T71 HydrophobicContact CD1-CG2 4.18Å; I61-T71 HydrophobicContact CG1-CG2 3.59Å; D68-T71 PolarHBondContact O-N 3.2Å; D68-T71 VanDerWaalsContact OD1-CB 3.29Å; D68-T71 WeakPolarHBondContact OD1-CB 3.26Å; D68-T71 PolarHBondContact OD1-OG1 3.21Å; D68-T71 WeakPolarHBondContact OD2-CB 3.29Å; D68-T71 PolarHBondContact OD2-N 3.19Å; D68-T71 PolarHBondContact OD2-OG1 2.93Å; T71-L75 PolarHBondContact O-N 3.43Å
72	K	89.4	Confident	89.9	Confident	35 Å²	35	55.1 Å²	55.1	15%	0.152	31%	0.307	C	S	.	.	H	α-helix	trans	-65	-47.8	173.8	-70.1	179.5	-176.6	166.8	0	112.2	P67 D68 E69 K70 E74 L75 E76	P67-K72 VanDerWaalsContact CG-CE 3.47Å; D68-K72 PolarHBondContact O-N 3.42Å; E69-K72 PolarHBondContact O-N 2.88Å; E69-K72 IonicContact OE2-NZ 4Å; K70-K72 VanDerWaalsContact C-N 3.26Å; K70-K72 PolarHBondContact O-N 3.44Å; K72-E74 VanDerWaalsContact C-N 3.32Å; K72-E74 PolarHBondContact O-N 2.97Å; K72-L75 WeakPolarHBondContact O-CB 3.39Å; K72-L75 PolarHBondContact O-N 3.29Å; K72-E76 PolarHBondContact O-N 2.83Å
73	A	92.3	Very high	90.1	Very high	44 Å²	44	59 Å²	59	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-60.3	-43	177.2	0	0	0	0	0	111.6	E69 K70 L75 E76 D77	E69-A73 WeakPolarHBondContact O-CB 3.48Å; E69-A73 PolarHBondContact O-N 3.39Å; K70-A73 PolarHBondContact O-N 2.87Å; A73-L75 VanDerWaalsContact C-N 3.31Å; A73-L75 PolarHBondContact O-N 2.92Å; A73-E76 PolarHBondContact O-N 3.25Å; A73-D77 PolarHBondContact O-N 2.83Å
74	E	93.9	Very high	90.2	Very high	60 Å²	60	61.1 Å²	61.1	28%	0.28	32%	0.318	S	S	.	.	H	α-helix	trans	-62.4	-36.4	175.8	-72.2	173.4	173.4	0	0	112.5	K57 K70 K72 L78	K57-E74 WeakPolarHBondContact CE-OE2 3.49Å; K57-E74 IonicContact NZ-OE2 2.72Å; K57-E74 PolarHBondContact NZ-OE2 3.46Å; K70-E74 WeakPolarHBondContact CE-OE1 3.48Å; K70-E74 IonicContact NZ-OE1 3.66Å; K70-E74 WeakPolarHBondContact O-CG 3.45Å; K70-E74 PolarHBondContact O-N 3.11Å; K72-E74 VanDerWaalsContact C-N 3.32Å; K72-E74 PolarHBondContact O-N 2.97Å; E74-L78 VanDerWaalsContact O-CG 3.28Å; E74-L78 WeakPolarHBondContact O-CG 3.46Å; E74-L78 PolarHBondContact O-N 2.76Å
75	L	93.3	Very high	90.7	Very high	14 Å²	14	59.8 Å²	59.8	7%	0.073	31%	0.307	C	S	.	.	H	α-helix	trans	-65.3	-44.2	173.7	174	64.1	0	0	0	111.5	V54 K57 I61 T71 K72 A73 D77 L78 M79	V54-L75 HydrophobicContact CB-CD1 4.41Å; V54-L75 HydrophobicContact CG1-CD1 3.99Å; V54-L75 HydrophobicContact CG2-CD1 4.15Å; K57-L75 HydrophobicContact CB-CB 4.36Å; K57-L75 HydrophobicContact CB-CD1 4.25Å; I61-L75 HydrophobicContact CD1-CB 4.27Å; I61-L75 HydrophobicContact CD1-CD2 3.54Å; T71-L75 PolarHBondContact O-N 3.43Å; K72-L75 WeakPolarHBondContact O-CB 3.39Å; K72-L75 PolarHBondContact O-N 3.29Å; A73-L75 VanDerWaalsContact C-N 3.31Å; A73-L75 PolarHBondContact O-N 2.92Å; L75-D77 VanDerWaalsContact C-N 3.33Å; L75-D77 PolarHBondContact O-N 2.92Å; L75-L78 PolarHBondContact O-N 2.68Å; L75-M79 HydrophobicContact CD1-CG 4.29Å; L75-M79 HydrophobicContact CD1-SD 4.28Å; L75-M79 HydrophobicContact CG-SD 4.03Å; L75-M79 VanDerWaalsContact O-CG 3.28Å; L75-M79 WeakPolarHBondContact O-CG 3.47Å; L75-M79 PolarHBondContact O-N 2.75Å
76	E	91.8	Very high	91.5	Very high	85 Å²	85	57 Å²	57	40%	0.397	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-41.4	177.6	-71.6	179.2	-167.4	0	0	112	K72 A73 L78 M79 A80 K203	K72-E76 PolarHBondContact O-N 2.83Å; A73-E76 PolarHBondContact O-N 3.25Å; E76-L78 VanDerWaalsContact C-N 3.35Å; E76-L78 PolarHBondContact O-N 2.91Å; E76-M79 PolarHBondContact O-N 3.26Å; E76-A80 WeakPolarHBondContact O-CB 3.25Å; E76-A80 PolarHBondContact O-N 3.05Å; E76-K203 WeakPolarHBondContact OE1-CE 3.12Å; E76-K203 IonicContact OE1-NZ 2.64Å; E76-K203 PolarHBondContact OE1-NZ 3.21Å
77	D	94.8	Very high	92.1	Very high	107 Å²	107	54.8 Å²	54.8	57%	0.572	28%	0.277	S	S	*	.	H	α-helix	trans	-61.3	-43.5	174.5	-75.8	-22.7	0	0	0	111.4	A73 L75 A80 D81	A73-D77 PolarHBondContact O-N 2.83Å; L75-D77 VanDerWaalsContact C-N 3.33Å; L75-D77 PolarHBondContact O-N 2.92Å; D77-A80 PolarHBondContact O-N 3.22Å; D77-D81 WeakPolarHBondContact O-CB 3.39Å; D77-D81 PolarHBondContact O-N 3.22Å
78	L	95.3	Very high	92.7	Very high	14 Å²	14	59.8 Å²	59.8	7%	0.073	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-43.9	175.6	-74.3	171.4	0	0	0	112.2	K50 E53 V54 K57 E74 L75 E76 A80 D81 I82	K50-L78 HydrophobicContact CG-CD2 4.27Å; E53-L78 HydrophobicContact CB-CD1 3.84Å; E53-L78 HydrophobicContact CB-CD2 4.28Å; E53-L78 VanDerWaalsContact OE2-CD2 3.26Å; E53-L78 WeakPolarHBondContact OE2-CD2 3.42Å; V54-L78 HydrophobicContact CG2-CB 3.82Å; V54-L78 HydrophobicContact CG2-CD1 4.24Å; K57-L78 HydrophobicContact CG-CD1 3.96Å; E74-L78 VanDerWaalsContact O-CG 3.28Å; E74-L78 WeakPolarHBondContact O-CG 3.46Å; E74-L78 PolarHBondContact O-N 2.76Å; L75-L78 PolarHBondContact O-N 2.68Å; E76-L78 VanDerWaalsContact C-N 3.35Å; E76-L78 PolarHBondContact O-N 2.91Å; L78-A80 VanDerWaalsContact C-N 3.35Å; L78-A80 PolarHBondContact O-N 3.05Å; L78-D81 PolarHBondContact O-N 3.22Å; L78-I82 WeakPolarHBondContact O-CB 3.35Å; L78-I82 VanDerWaalsContact O-CG1 3.28Å; L78-I82 WeakPolarHBondContact O-CG1 3.22Å; L78-I82 PolarHBondContact O-N 2.98Å
79	M	92.4	Very high	93.1	Very high	29 Å²	29	55.8 Å²	55.8	14%	0.143	28%	0.276	C	S	.	.	H	α-helix	trans	-62.5	-42.6	176.9	-68.1	170.8	70.1	0	0	111.4	L75 E76 I82 K83	L75-M79 HydrophobicContact CD1-CG 4.29Å; L75-M79 HydrophobicContact CD1-SD 4.28Å; L75-M79 HydrophobicContact CG-SD 4.03Å; L75-M79 VanDerWaalsContact O-CG 3.28Å; L75-M79 WeakPolarHBondContact O-CG 3.47Å; L75-M79 PolarHBondContact O-N 2.75Å; E76-M79 PolarHBondContact O-N 3.26Å; M79-I82 PolarHBondContact O-N 3.31Å; M79-K83 WeakPolarHBondContact O-CB 3.38Å; M79-K83 PolarHBondContact O-N 2.96Å
80	A	92.9	Very high	93.2	Very high	38 Å²	38	52.9 Å²	52.9	31%	0.314	26%	0.26	S	S	.	.	H	α-helix	trans	-64.5	-39.3	176.4	0	0	0	0	0	112.1	E76 D77 L78 K83 K84	E76-A80 WeakPolarHBondContact O-CB 3.25Å; E76-A80 PolarHBondContact O-N 3.05Å; D77-A80 PolarHBondContact O-N 3.22Å; L78-A80 VanDerWaalsContact C-N 3.35Å; L78-A80 PolarHBondContact O-N 3.05Å; A80-K83 PolarHBondContact O-N 2.73Å; A80-K84 VanDerWaalsContact O-CG 3.31Å; A80-K84 WeakPolarHBondContact O-CG 2.93Å; A80-K84 PolarHBondContact O-N 3.14Å
81	D	94.9	Very high	93.3	Very high	59 Å²	59	49.8 Å²	49.8	32%	0.316	26%	0.257	S	S	.	.	H	α-helix	trans	-67.4	-44.4	176.3	-83.7	-5.5	0	0	0	112.6	K50 D77 L78 K83 K84 L85	K50-D81 HydrophobicContact CD-CB 3.92Å; K50-D81 IonicContact NZ-OD2 2.95Å; K50-D81 PolarHBondContact NZ-OD2 3.08Å; D77-D81 WeakPolarHBondContact O-CB 3.39Å; D77-D81 PolarHBondContact O-N 3.22Å; L78-D81 PolarHBondContact O-N 3.22Å; D81-K83 VanDerWaalsContact C-N 3.3Å; D81-K83 PolarHBondContact O-N 2.64Å; D81-K84 PolarHBondContact O-N 3.44Å; D81-L85 VanDerWaalsContact O-CB 3.29Å; D81-L85 WeakPolarHBondContact O-CB 3.43Å; D81-L85 PolarHBondContact O-N 2.86Å
82	I	94.6	Very high	93.4	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-55.1	-48.9	173.6	-76	171.8	0	0	0	109.5	L47 K50 V51 V54 L78 M79 K84 L85 A86 Y134	L47-I82 HydrophobicContact CD1-CB 4.22Å; L47-I82 HydrophobicContact CD1-CG1 4.16Å; L47-I82 HydrophobicContact CD1-CG2 3.87Å; K50-I82 HydrophobicContact CB-CD1 4.09Å; K50-I82 HydrophobicContact CB-CG1 3.75Å; K50-I82 HydrophobicContact CD-CG1 4.42Å; V51-I82 HydrophobicContact CG2-CD1 4.21Å; V54-I82 HydrophobicContact CG2-CD1 3.67Å; L78-I82 WeakPolarHBondContact O-CB 3.35Å; L78-I82 VanDerWaalsContact O-CG1 3.28Å; L78-I82 WeakPolarHBondContact O-CG1 3.22Å; L78-I82 PolarHBondContact O-N 2.98Å; M79-I82 PolarHBondContact O-N 3.31Å; I82-K84 PolarHBondContact O-N 2.7Å; I82-L85 PolarHBondContact O-N 3.18Å; I82-A86 WeakPolarHBondContact O-CB 3.49Å; I82-A86 PolarHBondContact O-N 2.92Å; I82-Y134 HydrophobicContact CD1-CD2 3.9Å; I82-Y134 HydrophobicContact CD1-CE2 3.45Å; I82-Y134 VanDerWaalsContact CD1-CE2 3.45Å; I82-Y134 HydrophobicContact CG2-CD1 4.12Å; I82-Y134 HydrophobicContact CG2-CD2 4.44Å; I82-Y134 HydrophobicContact CG2-CE1 3.84Å; I82-Y134 HydrophobicContact CG2-CE2 4.14Å; I82-Y134 HydrophobicContact CG2-CG 4.43Å
83	K	92.3	Very high	93.6	Very high	86 Å²	86	50.1 Å²	50.1	37%	0.374	26%	0.257	S	S	.	.	H	α-helix	trans	-58	-47.1	176.9	-178.9	-178.6	-173.9	171.5	0	112.3	M79 A80 D81 N87 E210	M79-K83 WeakPolarHBondContact O-CB 3.38Å; M79-K83 PolarHBondContact O-N 2.96Å; A80-K83 PolarHBondContact O-N 2.73Å; D81-K83 VanDerWaalsContact C-N 3.3Å; D81-K83 PolarHBondContact O-N 2.64Å; K83-N87 WeakPolarHBondContact O-CB 3.39Å; K83-N87 PolarHBondContact O-N 3.07Å; K83-N87 VanDerWaalsContact O-N 3.08Å; K83-N87 PolarHBondContact O-ND2 3.21Å; K83-E210 VanDerWaalsContact CD-OE2 3.3Å; K83-E210 WeakPolarHBondContact CD-OE2 3.34Å; K83-E210 WeakPolarHBondContact CE-OE2 3.42Å; K83-E210 IonicContact NZ-OE1 3.72Å; K83-E210 PolarHBondContact NZ-OE1 3.37Å; K83-E210 IonicContact NZ-OE2 2.63Å; K83-E210 PolarHBondContact NZ-OE2 3.3Å
84	K	93.9	Very high	93.5	Very high	125 Å²	125	53.2 Å²	53.2	54%	0.543	26%	0.262	S	S	.	.	H	α-helix	trans	-62.8	-45.5	179.1	-73.3	168.4	-170.8	164.1	0	111.2	A80 D81 I82 N87 K88	A80-K84 VanDerWaalsContact O-CG 3.31Å; A80-K84 WeakPolarHBondContact O-CG 2.93Å; A80-K84 PolarHBondContact O-N 3.14Å; D81-K84 PolarHBondContact O-N 3.44Å; I82-K84 PolarHBondContact O-N 2.7Å; K84-N87 PolarHBondContact O-N 3.12Å; K84-K88 WeakPolarHBondContact O-CG 3.39Å; K84-K88 PolarHBondContact O-N 3.39Å
85	L	95.3	Very high	93.5	Very high	17 Å²	17	53 Å²	53	9%	0.089	27%	0.267	C	S	.	.	H	α-helix	trans	-67.6	-44.8	-177	-170.7	57.7	0	0	0	111.6	F43 T46 L47 D81 I82 N87 K88 I89	F43-L85 HydrophobicContact CB-CD1 3.66Å; F43-L85 HydrophobicContact CB-CG 4.39Å; F43-L85 HydrophobicContact CD1-CD1 3.91Å; F43-L85 HydrophobicContact CD2-CD1 4.37Å; F43-L85 HydrophobicContact CG-CD1 3.73Å; F43-L85 WeakPolarHBondContact O-CD2 3.26Å; T46-L85 HydrophobicContact CG2-CD2 3.9Å; L47-L85 HydrophobicContact CB-CD2 3.73Å; L47-L85 HydrophobicContact CB-CG 4.31Å; L47-L85 HydrophobicContact CD1-CB 4.46Å; L47-L85 HydrophobicContact CD1-CD2 4.29Å; D81-L85 VanDerWaalsContact O-CB 3.29Å; D81-L85 WeakPolarHBondContact O-CB 3.43Å; D81-L85 PolarHBondContact O-N 2.86Å; I82-L85 PolarHBondContact O-N 3.18Å; L85-N87 VanDerWaalsContact C-N 3.33Å; L85-N87 PolarHBondContact O-N 2.88Å; L85-K88 WeakPolarHBondContact O-CB 3.4Å; L85-K88 PolarHBondContact O-N 2.94Å; L85-K88 VanDerWaalsContact O-N 3.12Å; L85-I89 HydrophobicContact CG-CD1 4.21Å; L85-I89 WeakPolarHBondContact O-CG1 3.33Å; L85-I89 PolarHBondContact O-N 2.82Å
86	A	93.5	Very high	93.4	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62	-39.5	176.4	0	0	0	0	0	112	I82 I89 R90 F127 M131 M214	I82-A86 WeakPolarHBondContact O-CB 3.49Å; I82-A86 PolarHBondContact O-N 2.92Å; A86-I89 PolarHBondContact O-N 3.47Å; A86-R90 WeakPolarHBondContact O-CB 3.5Å; A86-R90 PolarHBondContact O-N 2.61Å; A86-F127 HydrophobicContact CB-CE2 3.97Å; A86-F127 HydrophobicContact CB-CZ 3.97Å; A86-M131 HydrophobicContact CB-CE 4.33Å; A86-M131 HydrophobicContact CB-SD 3.92Å; A86-M214 HydrophobicContact CB-CE 3.56Å; A86-M214 HydrophobicContact CB-SD 3.61Å
87	N	92.6	Very high	93.3	Very high	51 Å²	51	49.6 Å²	49.6	27%	0.273	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-38.2	172.7	-81	-54.1	0	0	0	113.4	K83 K84 L85 R90 S91	K83-N87 WeakPolarHBondContact O-CB 3.39Å; K83-N87 PolarHBondContact O-N 3.07Å; K83-N87 VanDerWaalsContact O-N 3.08Å; K83-N87 PolarHBondContact O-ND2 3.21Å; K84-N87 PolarHBondContact O-N 3.12Å; L85-N87 VanDerWaalsContact C-N 3.33Å; L85-N87 PolarHBondContact O-N 2.88Å; N87-R90 PolarHBondContact OD1-NH2 3.1Å; N87-S91 WeakPolarHBondContact O-CB 3.44Å; N87-S91 PolarHBondContact O-N 3.13Å
88	K	94.6	Very high	93	Very high	118 Å²	118	49.8 Å²	49.8	51%	0.513	25%	0.248	S	C	.	.	H	α-helix	trans	-63.6	-47.3	174.5	-73.3	175.7	-179.7	-176.7	0	111.5	K84 L85 S91 K92	K84-K88 WeakPolarHBondContact O-CG 3.39Å; K84-K88 PolarHBondContact O-N 3.39Å; L85-K88 WeakPolarHBondContact O-CB 3.4Å; L85-K88 PolarHBondContact O-N 2.94Å; L85-K88 VanDerWaalsContact O-N 3.12Å; K88-S91 PolarHBondContact O-N 3.03Å; K88-K92 PolarHBondContact O-N 3.2Å
89	I	94.8	Very high	92.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.6	-50.2	176.8	-66.5	160.5	0	0	0	109.9	I40 F43 I44 L47 L85 A86 S91 K92 L93 F127	I40-I89 HydrophobicContact CG2-CG2 4.16Å; F43-I89 HydrophobicContact CB-CD1 3.87Å; F43-I89 HydrophobicContact CB-CG1 3.6Å; F43-I89 HydrophobicContact CD2-CG1 4.35Å; F43-I89 HydrophobicContact CG-CG1 4.48Å; I44-I89 HydrophobicContact CD1-CG2 4.48Å; I44-I89 HydrophobicContact CG1-CD1 3.89Å; I44-I89 HydrophobicContact CG1-CG1 4.38Å; I44-I89 HydrophobicContact CG1-CG2 4.19Å; L47-I89 HydrophobicContact CB-CD1 4.4Å; L47-I89 HydrophobicContact CD2-CD1 3.9Å; L85-I89 HydrophobicContact CG-CD1 4.21Å; L85-I89 WeakPolarHBondContact O-CG1 3.33Å; L85-I89 PolarHBondContact O-N 2.82Å; A86-I89 PolarHBondContact O-N 3.47Å; I89-S91 VanDerWaalsContact C-N 3.33Å; I89-S91 PolarHBondContact O-N 3.2Å; I89-K92 PolarHBondContact O-N 2.9Å; I89-K92 VanDerWaalsContact O-N 3.17Å; I89-L93 HydrophobicContact CG2-CD1 3.81Å; I89-L93 HydrophobicContact CG2-CG 4.26Å; I89-L93 WeakPolarHBondContact O-CG 3.2Å; I89-L93 PolarHBondContact O-N 3.49Å; I89-F127 HydrophobicContact CB-CD2 4.23Å; I89-F127 HydrophobicContact CB-CE2 4.05Å; I89-F127 HydrophobicContact CB-CZ 4.31Å; I89-F127 HydrophobicContact CD1-CD2 4Å; I89-F127 HydrophobicContact CD1-CE2 3.96Å; I89-F127 HydrophobicContact CG2-CB 4.18Å; I89-F127 HydrophobicContact CG2-CD1 3.96Å; I89-F127 HydrophobicContact CG2-CD2 3.62Å; I89-F127 HydrophobicContact CG2-CE1 4.22Å; I89-F127 HydrophobicContact CG2-CE2 3.91Å; I89-F127 HydrophobicContact CG2-CG 3.64Å; I89-F127 HydrophobicContact CG2-CZ 4.18Å
90	R	92.1	Very high	92.4	Very high	67 Å²	67	50 Å²	50	25%	0.253	25%	0.252	S	S	.	.	H	α-helix	trans	-54.2	-47.6	176.7	-179.8	175.3	64	154.5	-6.8	112	A86 N87 K92 L93 K94 D217	A86-R90 WeakPolarHBondContact O-CB 3.5Å; A86-R90 PolarHBondContact O-N 2.61Å; N87-R90 PolarHBondContact OD1-NH2 3.1Å; R90-K92 PolarHBondContact O-N 3.43Å; R90-L93 PolarHBondContact O-N 3.23Å; R90-K94 WeakPolarHBondContact O-CB 3.45Å; R90-K94 PolarHBondContact O-N 3.17Å; R90-D217 IonicContact CZ-OD2 3.94Å; R90-D217 IonicContact NH1-OD2 3.51Å; R90-D217 PolarHBondContact NH1-OD2 3.46Å
91	S	93.1	Very high	92.2	Very high	79 Å²	79	53 Å²	53	55%	0.552	26%	0.259	S	S	*	.	H	α-helix	trans	-62.3	-41.6	179.7	-173.5	0	0	0	0	112.4	N87 K88 I89 S95	N87-S91 WeakPolarHBondContact O-CB 3.44Å; N87-S91 PolarHBondContact O-N 3.13Å; K88-S91 PolarHBondContact O-N 3.03Å; I89-S91 VanDerWaalsContact C-N 3.33Å; I89-S91 PolarHBondContact O-N 3.2Å; S91-S95 PolarHBondContact O-N 3.47Å
92	K	94.3	Very high	91.8	Very high	59 Å²	59	56.3 Å²	56.3	26%	0.257	27%	0.273	S	S	.	.	H	α-helix	trans	-70.4	-43	179.2	-73.8	-176	176.6	-83.1	0	112.2	E39 I40 F43 K88 I89 R90 K94 S95 I96	E39-K92 WeakPolarHBondContact OE1-CE 3.28Å; E39-K92 IonicContact OE1-NZ 2.58Å; E39-K92 PolarHBondContact OE1-NZ 2.95Å; E39-K92 WeakPolarHBondContact OE2-CE 3.34Å; E39-K92 IonicContact OE2-NZ 3.54Å; E39-K92 PolarHBondContact OE2-NZ 3.34Å; I40-K92 HydrophobicContact CD1-CB 3.76Å; I40-K92 HydrophobicContact CG1-CB 3.72Å; I40-K92 HydrophobicContact CG1-CD 3.83Å; I40-K92 HydrophobicContact CG1-CG 4.43Å; F43-K92 HydrophobicContact CD2-CD 4.43Å; F43-K92 HydrophobicContact CE2-CD 4.09Å; K88-K92 PolarHBondContact O-N 3.2Å; I89-K92 PolarHBondContact O-N 2.9Å; I89-K92 VanDerWaalsContact O-N 3.17Å; R90-K92 PolarHBondContact O-N 3.43Å; K92-K94 VanDerWaalsContact C-N 3.33Å; K92-K94 PolarHBondContact O-N 3.25Å; K92-S95 WeakPolarHBondContact O-CB 3.31Å; K92-S95 PolarHBondContact O-N 3.25Å; K92-I96 PolarHBondContact O-N 3.35Å
93	L	92.8	Very high	91.2	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.5	-46	173.4	-73.4	175.3	0	0	0	111.2	I40 I89 R90 S95 I96 Q97 H120 L123 F127	I40-L93 HydrophobicContact CD1-CD2 4.37Å; I40-L93 HydrophobicContact CG2-CD2 4.35Å; I89-L93 HydrophobicContact CG2-CD1 3.81Å; I89-L93 HydrophobicContact CG2-CG 4.26Å; I89-L93 WeakPolarHBondContact O-CG 3.2Å; I89-L93 PolarHBondContact O-N 3.49Å; R90-L93 PolarHBondContact O-N 3.23Å; L93-S95 VanDerWaalsContact C-N 3.3Å; L93-S95 PolarHBondContact O-N 2.86Å; L93-I96 PolarHBondContact O-N 2.96Å; L93-I96 VanDerWaalsContact O-N 3.14Å; L93-Q97 PolarHBondContact O-N 3.08Å; L93-H120 PolarHBondContact O-CD2 3.47Å; L93-H120 PolarHBondContact O-NE2 2.93Å; L93-L123 HydrophobicContact CD2-CB 3.8Å; L93-F127 HydrophobicContact CD1-CB 4.32Å; L93-F127 HydrophobicContact CD1-CD1 3.98Å; L93-F127 HydrophobicContact CD1-CG 4.41Å
94	K	91.1	Very high	90.6	Very high	108 Å²	108	57.8 Å²	57.8	47%	0.47	28%	0.281	S	S	.	.	H	α-helix	trans	-61.3	-37	176.3	-168.6	169.7	-173.2	168.3	0	112.8	R90 K92 Q97 Q98	R90-K94 WeakPolarHBondContact O-CB 3.45Å; R90-K94 PolarHBondContact O-N 3.17Å; K92-K94 VanDerWaalsContact C-N 3.33Å; K92-K94 PolarHBondContact O-N 3.25Å; K94-Q97 PolarHBondContact O-N 2.99Å; K94-Q98 WeakPolarHBondContact O-CG 3.46Å; K94-Q98 PolarHBondContact O-N 2.99Å
95	S	92.8	Very high	89.7	Confident	56 Å²	56	55.3 Å²	55.3	39%	0.392	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-45.4	174	-170.6	0	0	0	0	111.6	S91 K92 L93 Q97 Q98 T99	S91-S95 PolarHBondContact O-N 3.47Å; K92-S95 WeakPolarHBondContact O-CB 3.31Å; K92-S95 PolarHBondContact O-N 3.25Å; L93-S95 VanDerWaalsContact C-N 3.3Å; L93-S95 PolarHBondContact O-N 2.86Å; S95-Q97 VanDerWaalsContact C-N 3.33Å; S95-Q97 PolarHBondContact O-N 3.38Å; S95-Q98 PolarHBondContact O-N 3.31Å; S95-T99 PolarHBondContact O-N 2.98Å; S95-T99 VanDerWaalsContact O-N 3.12Å; S95-T99 PolarHBondContact O-OG1 3.39Å; S95-T99 VanDerWaalsContact O-OG1 3.12Å
96	I	91	Very high	88.9	Confident	4 Å²	4	59.5 Å²	59.5	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-62.7	-43	176.9	-66.4	171.5	0	0	0	110.4	F33 I40 K92 L93 Q98 T99 I100 H120	F33-I96 HydrophobicContact CE2-CD1 4.15Å; F33-I96 HydrophobicContact CE2-CG1 4.35Å; F33-I96 HydrophobicContact CE2-CG2 4.02Å; I40-I96 HydrophobicContact CD1-CD1 3.43Å; I40-I96 VanDerWaalsContact CD1-CD1 3.43Å; K92-I96 PolarHBondContact O-N 3.35Å; L93-I96 PolarHBondContact O-N 2.96Å; L93-I96 VanDerWaalsContact O-N 3.14Å; I96-Q98 PolarHBondContact O-N 3.25Å; I96-T99 WeakPolarHBondContact O-CB 3.5Å; I96-T99 PolarHBondContact O-N 3.11Å; I96-I100 HydrophobicContact CG2-CD1 3.87Å; I96-I100 HydrophobicContact CG2-CG1 4.45Å; I96-I100 WeakPolarHBondContact O-CG1 3.46Å; I96-I100 PolarHBondContact O-N 2.98Å; I96-H120 HydrophobicContact CG2-CB 3.85Å
97	Q	89.2	Confident	87.4	Confident	24 Å²	24	67 Å²	67	11%	0.112	35%	0.35	C	S	.	.	H	α-helix	trans	-57.6	-46.5	176.5	-179.7	60.9	24.3	0	0	112	L93 K94 S95 T99 I100 E101 H120 L221	L93-Q97 PolarHBondContact O-N 3.08Å; K94-Q97 PolarHBondContact O-N 2.99Å; S95-Q97 VanDerWaalsContact C-N 3.33Å; S95-Q97 PolarHBondContact O-N 3.38Å; Q97-T99 VanDerWaalsContact C-N 3.31Å; Q97-T99 PolarHBondContact O-N 2.97Å; Q97-I100 WeakPolarHBondContact O-CB 3.31Å; Q97-I100 PolarHBondContact O-N 3.35Å; Q97-E101 WeakPolarHBondContact CG-OE1 3.48Å; Q97-E101 PolarHBondContact NE2-OE1 2.89Å; Q97-E101 WeakPolarHBondContact O-CG 3.47Å; Q97-E101 PolarHBondContact O-N 3.49Å; Q97-H120 PolarHBondContact OE1-CE1 2.94Å; Q97-H120 PolarHBondContact OE1-ND1 3.35Å; Q97-L221 HydrophobicContact CG-CD2 4.09Å
98	Q	90.1	Very high	85.9	Confident	110 Å²	110	71.8 Å²	71.8	51%	0.514	36%	0.364	S	S	.	.	H	α-helix	trans	-61.8	-38.5	177.2	-73.7	176.3	-17.5	0	0	112.4	K94 S95 I96 E101 Q102	K94-Q98 WeakPolarHBondContact O-CG 3.46Å; K94-Q98 PolarHBondContact O-N 2.99Å; S95-Q98 PolarHBondContact O-N 3.31Å; I96-Q98 PolarHBondContact O-N 3.25Å; Q98-E101 PolarHBondContact O-N 2.58Å; Q98-Q102 WeakPolarHBondContact O-CB 3.45Å; Q98-Q102 PolarHBondContact O-N 2.82Å
99	T	88.6	Confident	84.4	Confident	44 Å²	44	69.3 Å²	69.3	27%	0.27	36%	0.362	S	S	.	.	H	α-helix	trans	-63.7	-42.8	174.3	-54.6	0	0	0	0	111.5	S95 I96 Q97 Q102 E103	S95-T99 PolarHBondContact O-N 2.98Å; S95-T99 VanDerWaalsContact O-N 3.12Å; S95-T99 PolarHBondContact O-OG1 3.39Å; S95-T99 VanDerWaalsContact O-OG1 3.12Å; I96-T99 WeakPolarHBondContact O-CB 3.5Å; I96-T99 PolarHBondContact O-N 3.11Å; Q97-T99 VanDerWaalsContact C-N 3.31Å; Q97-T99 PolarHBondContact O-N 2.97Å; T99-Q102 PolarHBondContact O-N 2.78Å; T99-E103 WeakPolarHBondContact O-CG 3.35Å; T99-E103 PolarHBondContact O-N 2.89Å
100	I	86.8	Confident	83.5	Confident	3 Å²	3	70.8 Å²	70.8	2%	0.015	37%	0.372	C	S	.	.	H	α-helix	trans	-59.5	-50.7	176.3	-69.7	164.2	0	0	0	110.6	I96 Q97 Q102 E103 E104 L113 R116 K117 H120	I96-I100 HydrophobicContact CG2-CD1 3.87Å; I96-I100 HydrophobicContact CG2-CG1 4.45Å; I96-I100 WeakPolarHBondContact O-CG1 3.46Å; I96-I100 PolarHBondContact O-N 2.98Å; Q97-I100 WeakPolarHBondContact O-CB 3.31Å; Q97-I100 PolarHBondContact O-N 3.35Å; I100-Q102 VanDerWaalsContact C-N 3.29Å; I100-Q102 PolarHBondContact O-N 3.19Å; I100-E103 PolarHBondContact O-N 2.92Å; I100-E104 WeakPolarHBondContact O-CG 3.33Å; I100-E104 PolarHBondContact O-N 3.36Å; I100-L113 HydrophobicContact CB-CD1 4.4Å; I100-L113 HydrophobicContact CG1-CD1 4.49Å; I100-L113 HydrophobicContact CG2-CD1 3.98Å; I100-R116 HydrophobicContact CD1-CB 4.21Å; I100-R116 HydrophobicContact CG1-CB 3.9Å; I100-K117 HydrophobicContact CD1-CG 4.18Å; I100-K117 HydrophobicContact CG1-CG 4.38Å; I100-K117 HydrophobicContact CG2-CD 4.36Å; I100-K117 HydrophobicContact CG2-CG 3.67Å; I100-H120 HydrophobicContact CD1-CB 3.81Å
101	E	87	Confident	82.7	Confident	102 Å²	102	70 Å²	70	48%	0.477	38%	0.38	S	S	.	.	H	α-helix	trans	-60.4	-38.7	-179.9	-71.7	169.8	-173.5	0	0	112.1	Q97 Q98 E104 G105	Q97-E101 WeakPolarHBondContact CG-OE1 3.48Å; Q97-E101 PolarHBondContact NE2-OE1 2.89Å; Q97-E101 WeakPolarHBondContact O-CG 3.47Å; Q97-E101 PolarHBondContact O-N 3.49Å; Q98-E101 PolarHBondContact O-N 2.58Å; E101-E104 PolarHBondContact O-N 3.18Å; E101-G105 PolarHBondContact O-N 3.16Å; E101-G105 VanDerWaalsContact O-N 3.09Å
102	Q	86.5	Confident	82.1	Confident	129 Å²	129	68 Å²	68	60%	0.603	36%	0.363	S	S	*	.	H	α-helix	trans	-65.3	-41.4	176.9	-173.7	179.9	11.5	0	0	112.2	Q98 T99 I100	Q98-Q102 WeakPolarHBondContact O-CB 3.45Å; Q98-Q102 PolarHBondContact O-N 2.82Å; T99-Q102 PolarHBondContact O-N 2.78Å; I100-Q102 VanDerWaalsContact C-N 3.29Å; I100-Q102 PolarHBondContact O-N 3.19Å
103	E	82.1	Confident	81.6	Confident	33 Å²	33	65.5 Å²	65.5	15%	0.154	35%	0.352	C	S	.	.	H	α-helix	trans	-71.3	-35.1	178.5	-73.8	-173.2	-168.1	0	0	112.6	T99 I100 Q106 R108 L113 R116	T99-E103 WeakPolarHBondContact O-CG 3.35Å; T99-E103 PolarHBondContact O-N 2.89Å; I100-E103 PolarHBondContact O-N 2.92Å; E103-Q106 PolarHBondContact O-N 3.25Å; E103-R108 PolarHBondContact O-N 3.1Å; E103-L113 HydrophobicContact CB-CD1 3.97Å; E103-R116 IonicContact OE1-NE 3.73Å
104	E	80.5	Confident	81	Confident	85 Å²	85	67.3 Å²	67.3	40%	0.397	36%	0.359	S	S	.	.	H	α-helix	trans	-62.5	-43.9	172.7	-75.4	-173.8	130.8	0	0	112.3	I100 E101 Q106 N107 L113 K117	I100-E104 WeakPolarHBondContact O-CG 3.33Å; I100-E104 PolarHBondContact O-N 3.36Å; E101-E104 PolarHBondContact O-N 3.18Å; E104-Q106 PolarHBondContact O-N 2.98Å; E104-Q106 VanDerWaalsContact O-N 3.11Å; E104-N107 PolarHBondContact O-N 3.24Å; E104-L113 HydrophobicContact CG-CD1 4.38Å; E104-L113 HydrophobicContact CG-CD2 3.94Å; E104-K117 WeakPolarHBondContact OE1-CE 3.45Å; E104-K117 IonicContact OE1-NZ 2.94Å; E104-K117 PolarHBondContact OE1-NZ 3.17Å
105	G	75.6	Confident	80.7	Confident	72 Å²	72	64.7 Å²	64.7	74%	0.742	35%	0.35	S	S	*	.	H	α-helix	trans	-61.1	-20	177	0	0	0	0	0	113.8	E101	E101-G105 PolarHBondContact O-N 3.16Å; E101-G105 VanDerWaalsContact O-N 3.09Å
106	Q	77.1	Confident	80.5	Confident	105 Å²	105	63.8 Å²	63.8	49%	0.491	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	5.5	175.2	-64.5	-176.8	-2.6	0	0	113.5	E103 E104 R108	E103-Q106 PolarHBondContact O-N 3.25Å; E104-Q106 PolarHBondContact O-N 2.98Å; E104-Q106 VanDerWaalsContact O-N 3.11Å; Q106-R108 HydrophobicContact CB-CG 4.15Å; Q106-R108 PolarHBondContact O-N 3.49Å
107	N	62.3	Low	80.2	Confident	159 Å²	159	66.9 Å²	66.9	85%	0.85	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	27.4	-178.1	-114.9	-5.1	0	0	0	113.7	E104 S109	E104-N107 PolarHBondContact O-N 3.24Å; N107-S109 PolarHBondContact O-N 3.29Å
108	R	61.8	Low	80	Confident	151 Å²	151	67.8 Å²	67.8	57%	0.57	36%	0.358	S	S	*	.			trans	-86.5	79.7	177.8	-69.9	-176.6	175.9	-173.9	1.3	110.2	E103 Q106 S110 L113	E103-R108 PolarHBondContact O-N 3.1Å; Q106-R108 HydrophobicContact CB-CG 4.15Å; Q106-R108 PolarHBondContact O-N 3.49Å; R108-S110 PolarHBondContact O-N 3.41Å; R108-L113 WeakPolarHBondContact O-CD2 3.45Å
109	S	63.5	Low	80	Confident	66 Å²	66	65.4 Å²	65.4	46%	0.462	35%	0.347	S	S	.	.			trans	-75.4	69.8	171.6	-170.9	0	0	0	0	111.3	N107 Y242	N107-S109 PolarHBondContact O-N 3.29Å; S109-Y242 WeakPolarHBondContact O-CE2 3.47Å; S109-Y242 VanDerWaalsContact O-CZ 3.27Å; S109-Y242 PolarHBondContact O-OH 2.97Å
110	S	74.4	Confident	80	Confident	31 Å²	31	63.3 Å²	63.3	22%	0.217	33%	0.334	C	S	.	.			trans	-96.1	163.1	-175.4	70.1	0	0	0	0	112.8	R108 D112 L113 R114	R108-S110 PolarHBondContact O-N 3.41Å; S110-D112 PolarHBondContact O-N 3.26Å; S110-D112 WeakPolarHBondContact OG-CB 3.39Å; S110-D112 PolarHBondContact OG-N 2.99Å; S110-L113 PolarHBondContact O-N 3.39Å; S110-L113 PolarHBondContact OG-N 3.17Å; S110-L113 VanDerWaalsContact OG-N 3.08Å; S110-R114 PolarHBondContact O-N 3.05Å
111	A	75.7	Confident	80.1	Confident	50 Å²	50	63.2 Å²	63.2	41%	0.413	33%	0.334	S	S	.	.	H	α-helix	trans	-59.6	-34.1	169.7	0	0	0	0	0	112	R114 I115	A111-R114 PolarHBondContact O-N 2.94Å; A111-I115 VanDerWaalsContact O-CG1 3.3Å; A111-I115 WeakPolarHBondContact O-CG1 3.4Å; A111-I115 PolarHBondContact O-N 3.03Å; A111-I115 VanDerWaalsContact O-N 3.07Å
112	D	81.7	Confident	80.1	Confident	36 Å²	36	61.7 Å²	61.7	19%	0.193	33%	0.331	C	S	.	.	H	α-helix	trans	-59.4	-51.2	174.7	-174.2	106.4	0	0	0	111.2	M30 S110 R114 I115 R116	M30-D112 WeakPolarHBondContact CG-OD1 3.38Å; M30-D112 HydrophobicContact SD-CB 4.08Å; S110-D112 PolarHBondContact O-N 3.26Å; S110-D112 WeakPolarHBondContact OG-CB 3.39Å; S110-D112 PolarHBondContact OG-N 2.99Å; D112-R114 VanDerWaalsContact C-N 3.33Å; D112-R114 PolarHBondContact O-N 3.45Å; D112-I115 PolarHBondContact O-N 3.41Å; D112-I115 VanDerWaalsContact O-N 3.08Å; D112-R116 WeakPolarHBondContact O-CG 3.49Å; D112-R116 PolarHBondContact O-N 2.84Å; D112-R116 IonicContact OD1-NH2 3.71Å; D112-R116 IonicContact OD2-CZ 3.44Å; D112-R116 IonicContact OD2-NE 3.82Å; D112-R116 PolarHBondContact OD2-NE 3.47Å; D112-R116 IonicContact OD2-NH2 2.73Å; D112-R116 PolarHBondContact OD2-NH2 2.94Å
113	L	83.1	Confident	80.4	Confident	7 Å²	7	56 Å²	56	4%	0.037	31%	0.305	C	S	.	.	H	α-helix	trans	-59.6	-41	177.7	-179.1	61.5	0	0	0	112.4	I100 E103 E104 R108 S110 I115 R116 K117	I100-L113 HydrophobicContact CB-CD1 4.4Å; I100-L113 HydrophobicContact CG1-CD1 4.49Å; I100-L113 HydrophobicContact CG2-CD1 3.98Å; E103-L113 HydrophobicContact CB-CD1 3.97Å; E104-L113 HydrophobicContact CG-CD1 4.38Å; E104-L113 HydrophobicContact CG-CD2 3.94Å; R108-L113 WeakPolarHBondContact O-CD2 3.45Å; S110-L113 PolarHBondContact O-N 3.39Å; S110-L113 PolarHBondContact OG-N 3.17Å; S110-L113 VanDerWaalsContact OG-N 3.08Å; L113-I115 VanDerWaalsContact C-N 3.34Å; L113-I115 PolarHBondContact O-N 3.29Å; L113-R116 PolarHBondContact O-N 3.33Å; L113-K117 HydrophobicContact CD1-CG 4.5Å; L113-K117 HydrophobicContact CG-CD 4.42Å; L113-K117 WeakPolarHBondContact O-CG 3.47Å; L113-K117 PolarHBondContact O-N 2.98Å
114	R	80.7	Confident	80.8	Confident	39 Å²	39	54.5 Å²	54.5	15%	0.147	30%	0.298	C	S	.	.	H	α-helix	trans	-62.9	-40.7	175.9	-72	-167.3	-65.2	-107.6	6.2	112.1	S110 A111 D112 T118 N235 H238 S239	S110-R114 PolarHBondContact O-N 3.05Å; A111-R114 PolarHBondContact O-N 2.94Å; D112-R114 VanDerWaalsContact C-N 3.33Å; D112-R114 PolarHBondContact O-N 3.45Å; R114-T118 WeakPolarHBondContact O-CB 3.49Å; R114-T118 PolarHBondContact O-N 3.04Å; R114-T118 PolarHBondContact O-OG1 3.46Å; R114-N235 WeakPolarHBondContact CD-OD1 3.36Å; R114-H238 PolarHBondContact NH1-O 3.03Å; R114-H238 VanDerWaalsContact NH1-O 3.1Å; R114-S239 PolarHBondContact NH2-OG 3.48Å
115	I	84.5	Confident	81.2	Confident	52 Å²	52	55.5 Å²	55.5	27%	0.267	30%	0.298	S	S	.	.	H	α-helix	trans	-66.5	-45.1	178.1	-67	164.2	0	0	0	109.9	F29 M30 F33 F34 A111 D112 L113 K117 T118 Q119	F29-I115 HydrophobicContact CE1-CD1 4.04Å; F29-I115 HydrophobicContact CZ-CD1 4.15Å; M30-I115 HydrophobicContact CE-CB 3.71Å; M30-I115 HydrophobicContact CE-CD1 3.55Å; M30-I115 HydrophobicContact CE-CG1 4.2Å; M30-I115 HydrophobicContact CE-CG2 3.37Å; M30-I115 HydrophobicContact SD-CB 4.34Å; M30-I115 HydrophobicContact SD-CG2 4.33Å; F33-I115 HydrophobicContact CE1-CG2 4.21Å; F34-I115 HydrophobicContact CE1-CG2 4.2Å; F34-I115 HydrophobicContact CZ-CG2 4.17Å; A111-I115 VanDerWaalsContact O-CG1 3.3Å; A111-I115 WeakPolarHBondContact O-CG1 3.4Å; A111-I115 PolarHBondContact O-N 3.03Å; A111-I115 VanDerWaalsContact O-N 3.07Å; D112-I115 PolarHBondContact O-N 3.41Å; D112-I115 VanDerWaalsContact O-N 3.08Å; L113-I115 VanDerWaalsContact C-N 3.34Å; L113-I115 PolarHBondContact O-N 3.29Å; I115-K117 PolarHBondContact O-N 3.32Å; I115-T118 PolarHBondContact O-N 2.63Å; I115-Q119 HydrophobicContact CG2-CG 4.18Å; I115-Q119 WeakPolarHBondContact O-CB 3.42Å; I115-Q119 WeakPolarHBondContact O-CG 3.28Å; I115-Q119 PolarHBondContact O-N 3.29Å
116	R	88.3	Confident	81.9	Confident	38 Å²	38	56.8 Å²	56.8	14%	0.143	28%	0.284	C	S	.	.	H	α-helix	trans	-56.2	-50	176.1	-68.5	179.2	-172.6	-84.7	-7.3	112.7	F33 I100 E103 D112 L113 T118 Q119 H120	F33-R116 HydrophobicContact CD1-CG 4.27Å; F33-R116 HydrophobicContact CD2-CG 4.11Å; F33-R116 VanDerWaalsContact CD2-NH1 3.3Å; F33-R116 HydrophobicContact CE1-CG 4.05Å; F33-R116 HydrophobicContact CE2-CB 4.29Å; F33-R116 HydrophobicContact CE2-CG 3.88Å; F33-R116 HydrophobicContact CG-CG 4.3Å; F33-R116 HydrophobicContact CZ-CB 4.09Å; F33-R116 HydrophobicContact CZ-CG 3.86Å; I100-R116 HydrophobicContact CD1-CB 4.21Å; I100-R116 HydrophobicContact CG1-CB 3.9Å; E103-R116 IonicContact OE1-NE 3.73Å; D112-R116 WeakPolarHBondContact O-CG 3.49Å; D112-R116 PolarHBondContact O-N 2.84Å; D112-R116 IonicContact OD1-NH2 3.71Å; D112-R116 IonicContact OD2-CZ 3.44Å; D112-R116 IonicContact OD2-NE 3.82Å; D112-R116 PolarHBondContact OD2-NE 3.47Å; D112-R116 IonicContact OD2-NH2 2.73Å; D112-R116 PolarHBondContact OD2-NH2 2.94Å; L113-R116 PolarHBondContact O-N 3.33Å; R116-T118 PolarHBondContact O-N 2.91Å; R116-Q119 PolarHBondContact O-N 3.42Å; R116-H120 VanDerWaalsContact O-CB 3.26Å; R116-H120 WeakPolarHBondContact O-CB 3.39Å; R116-H120 PolarHBondContact O-N 3.32Å
117	K	85.6	Confident	82.7	Confident	69 Å²	69	51.8 Å²	51.8	30%	0.3	26%	0.26	S	S	.	.	H	α-helix	trans	-58.2	-46.9	176.7	-74.7	178	173.1	-171.3	0	112.7	I100 E104 L113 I115 S121	I100-K117 HydrophobicContact CD1-CG 4.18Å; I100-K117 HydrophobicContact CG1-CG 4.38Å; I100-K117 HydrophobicContact CG2-CD 4.36Å; I100-K117 HydrophobicContact CG2-CG 3.67Å; E104-K117 WeakPolarHBondContact OE1-CE 3.45Å; E104-K117 IonicContact OE1-NZ 2.94Å; E104-K117 PolarHBondContact OE1-NZ 3.17Å; L113-K117 HydrophobicContact CD1-CG 4.5Å; L113-K117 HydrophobicContact CG-CD 4.42Å; L113-K117 WeakPolarHBondContact O-CG 3.47Å; L113-K117 PolarHBondContact O-N 2.98Å; I115-K117 PolarHBondContact O-N 3.32Å; K117-S121 WeakPolarHBondContact O-CB 3.45Å; K117-S121 PolarHBondContact O-N 3.5Å
118	T	84.3	Confident	84	Confident	43 Å²	43	46.3 Å²	46.3	26%	0.264	23%	0.232	S	C	.	.	H	α-helix	trans	-63.6	-45.2	-178.1	-55.2	0	0	0	0	111.3	R114 I115 R116 T122 I229 N235	R114-T118 WeakPolarHBondContact O-CB 3.49Å; R114-T118 PolarHBondContact O-N 3.04Å; R114-T118 PolarHBondContact O-OG1 3.46Å; I115-T118 PolarHBondContact O-N 2.63Å; R116-T118 PolarHBondContact O-N 2.91Å; T118-T122 WeakPolarHBondContact O-CB 3.32Å; T118-T122 PolarHBondContact O-N 3.29Å; T118-T122 PolarHBondContact O-OG1 3.49Å; T118-I229 HydrophobicContact CG2-CG2 4.48Å; T118-N235 PolarHBondContact OG1-ND2 2.91Å
119	Q	89.6	Confident	85.4	Confident	59 Å²	59	44.5 Å²	44.5	28%	0.276	23%	0.23	S	C	.	.	H	α-helix	trans	-66.8	-47.7	178.3	-70.4	-63.9	-9.5	0	0	111.8	F33 V37 I115 R116 S121 T122 L123	F33-Q119 HydrophobicContact CE1-CB 4.11Å; F33-Q119 HydrophobicContact CE1-CG 3.99Å; F33-Q119 HydrophobicContact CZ-CB 3.76Å; F33-Q119 HydrophobicContact CZ-CG 4.18Å; V37-Q119 HydrophobicContact CG2-CB 4.02Å; V37-Q119 HydrophobicContact CG2-CG 4.33Å; I115-Q119 HydrophobicContact CG2-CG 4.18Å; I115-Q119 WeakPolarHBondContact O-CB 3.42Å; I115-Q119 WeakPolarHBondContact O-CG 3.28Å; I115-Q119 PolarHBondContact O-N 3.29Å; R116-Q119 PolarHBondContact O-N 3.42Å; Q119-S121 VanDerWaalsContact C-N 3.25Å; Q119-S121 PolarHBondContact O-N 3.3Å; Q119-T122 PolarHBondContact O-N 3.05Å; Q119-L123 WeakPolarHBondContact O-CB 3.43Å; Q119-L123 WeakPolarHBondContact O-CG 3.37Å; Q119-L123 PolarHBondContact O-N 3.45Å
120	H	90	Very high	86.9	Confident	1 Å²	1	42 Å²	42	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-53.5	-44.6	176.2	175.9	-99.1	0	0	0	112	L93 I96 Q97 I100 R116 S124 Q225	L93-H120 PolarHBondContact O-CD2 3.47Å; L93-H120 PolarHBondContact O-NE2 2.93Å; I96-H120 HydrophobicContact CG2-CB 3.85Å; Q97-H120 PolarHBondContact OE1-CE1 2.94Å; Q97-H120 PolarHBondContact OE1-ND1 3.35Å; I100-H120 HydrophobicContact CD1-CB 3.81Å; R116-H120 VanDerWaalsContact O-CB 3.26Å; R116-H120 WeakPolarHBondContact O-CB 3.39Å; R116-H120 PolarHBondContact O-N 3.32Å; H120-S124 WeakPolarHBondContact O-CB 3.4Å; H120-S124 PolarHBondContact O-N 3.43Å; H120-S124 PolarHBondContact O-OG 2.83Å; H120-Q225 PolarHBondContact CE1-NE2 3.37Å; H120-Q225 PolarHBondContact ND1-NE2 3.07Å; H120-Q225 PolarHBondContact ND1-OE1 2.97Å
121	S	86.9	Confident	87.7	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.007	20%	0.203	C	C	.	.	H	α-helix	trans	-69	-41.6	-179.5	-161.7	0	0	0	0	113.5	K117 Q119 S124 R125 Q225 I229	K117-S121 WeakPolarHBondContact O-CB 3.45Å; K117-S121 PolarHBondContact O-N 3.5Å; Q119-S121 VanDerWaalsContact C-N 3.25Å; Q119-S121 PolarHBondContact O-N 3.3Å; S121-S124 PolarHBondContact O-N 3.17Å; S121-R125 PolarHBondContact O-N 3.4Å; S121-R125 PolarHBondContact OG-NH1 2.97Å; S121-R125 PolarHBondContact OG-NH2 3.41Å; S121-Q225 PolarHBondContact OG-OE1 3.38Å; S121-Q225 VanDerWaalsContact OG-OE1 3.07Å; S121-I229 VanDerWaalsContact OG-CD1 3.22Å; S121-I229 WeakPolarHBondContact OG-CD1 3.44Å
122	T	87.9	Confident	88.4	Confident	69 Å²	69	41.1 Å²	41.1	42%	0.423	20%	0.203	S	C	.	.	H	α-helix	trans	-63.1	-47.4	177.1	-57.6	0	0	0	0	110.9	T118 Q119 R125 K126	T118-T122 WeakPolarHBondContact O-CB 3.32Å; T118-T122 PolarHBondContact O-N 3.29Å; T118-T122 PolarHBondContact O-OG1 3.49Å; Q119-T122 PolarHBondContact O-N 3.05Å; T122-R125 PolarHBondContact O-N 2.87Å; T122-K126 WeakPolarHBondContact O-CB 3.33Å; T122-K126 PolarHBondContact O-N 3.14Å
123	L	92.7	Very high	89	Confident	11 Å²	11	43.4 Å²	43.4	6%	0.058	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-40.6	177.6	-68.4	172.2	0	0	0	112	V37 I40 R41 I44 L93 Q119 K126 F127	V37-L123 HydrophobicContact CB-CD1 4.34Å; V37-L123 HydrophobicContact CG1-CD1 4.06Å; V37-L123 HydrophobicContact CG2-CD1 4.2Å; I40-L123 HydrophobicContact CB-CD1 4.07Å; I40-L123 HydrophobicContact CD1-CD1 4.13Å; I40-L123 HydrophobicContact CG2-CB 4.28Å; I40-L123 HydrophobicContact CG2-CD1 3.94Å; I40-L123 HydrophobicContact CG2-CD2 4.15Å; I40-L123 HydrophobicContact CG2-CG 4.36Å; R41-L123 HydrophobicContact CB-CD2 4.13Å; I44-L123 HydrophobicContact CD1-CB 4.43Å; I44-L123 HydrophobicContact CD1-CD2 4.15Å; L93-L123 HydrophobicContact CD2-CB 3.8Å; Q119-L123 WeakPolarHBondContact O-CB 3.43Å; Q119-L123 WeakPolarHBondContact O-CG 3.37Å; Q119-L123 PolarHBondContact O-N 3.45Å; L123-K126 PolarHBondContact O-N 2.87Å; L123-F127 WeakPolarHBondContact O-CB 3.35Å; L123-F127 PolarHBondContact O-N 3.4Å
124	S	91.3	Very high	89.5	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.007	21%	0.211	C	C	.	.	H	α-helix	trans	-61.9	-45.6	176.9	-67.2	0	0	0	0	111.8	H120 S121 F127 V128	H120-S124 WeakPolarHBondContact O-CB 3.4Å; H120-S124 PolarHBondContact O-N 3.43Å; H120-S124 PolarHBondContact O-OG 2.83Å; S121-S124 PolarHBondContact O-N 3.17Å; S124-F127 PolarHBondContact O-N 3.06Å; S124-V128 WeakPolarHBondContact O-CG2 3.41Å; S124-V128 PolarHBondContact O-N 3.4Å
125	R	87.8	Confident	90	Very high	105 Å²	105	43.4 Å²	43.4	40%	0.396	22%	0.215	S	C	.	.	H	α-helix	trans	-60.8	-46.5	174.3	-81.9	-171.8	-76.8	-83.4	-5.1	111.9	S121 T122 F127 V128 E129 I229	S121-R125 PolarHBondContact O-N 3.4Å; S121-R125 PolarHBondContact OG-NH1 2.97Å; S121-R125 PolarHBondContact OG-NH2 3.41Å; T122-R125 PolarHBondContact O-N 2.87Å; R125-F127 VanDerWaalsContact C-N 3.31Å; R125-F127 PolarHBondContact O-N 3.11Å; R125-V128 PolarHBondContact O-N 3.41Å; R125-E129 WeakPolarHBondContact O-CB 3.32Å; R125-E129 PolarHBondContact O-N 2.82Å; R125-I229 VanDerWaalsContact NH2-CG2 3.35Å
126	K	91.8	Very high	90.4	Very high	100 Å²	100	43.7 Å²	43.7	44%	0.435	22%	0.219	S	C	.	.	H	α-helix	trans	-60.9	-41	178.4	-163.3	78.8	-165.5	150.6	0	111.8	I44 T122 L123 E129 V130	I44-K126 HydrophobicContact CD1-CB 4.39Å; I44-K126 HydrophobicContact CG2-CB 4.42Å; I44-K126 HydrophobicContact CG2-CG 3.74Å; T122-K126 WeakPolarHBondContact O-CB 3.33Å; T122-K126 PolarHBondContact O-N 3.14Å; L123-K126 PolarHBondContact O-N 2.87Å; K126-E129 WeakPolarHBondContact CD-OE2 3.22Å; K126-E129 IonicContact NZ-OE1 3.81Å; K126-E129 IonicContact NZ-OE2 2.75Å; K126-E129 PolarHBondContact NZ-OE2 2.94Å; K126-E129 WeakPolarHBondContact O-CB 3.41Å; K126-E129 PolarHBondContact O-N 3.05Å; K126-V130 WeakPolarHBondContact O-CG2 3.09Å; K126-V130 PolarHBondContact O-N 3.05Å; K126-V130 VanDerWaalsContact O-N 3.17Å
127	F	92.9	Very high	90.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.8	-45.9	176.7	177.4	-128.1	0	0	0	111.9	I44 L47 A86 I89 L93 L123 S124 R125 E129 V130 M131 M214 M218	I44-F127 HydrophobicContact CD1-CB 4.03Å; I44-F127 HydrophobicContact CG1-CB 4.3Å; L47-F127 HydrophobicContact CD2-CD2 3.85Å; L47-F127 HydrophobicContact CD2-CE2 3.68Å; A86-F127 HydrophobicContact CB-CE2 3.97Å; A86-F127 HydrophobicContact CB-CZ 3.97Å; I89-F127 HydrophobicContact CB-CD2 4.23Å; I89-F127 HydrophobicContact CB-CE2 4.05Å; I89-F127 HydrophobicContact CB-CZ 4.31Å; I89-F127 HydrophobicContact CD1-CD2 4Å; I89-F127 HydrophobicContact CD1-CE2 3.96Å; I89-F127 HydrophobicContact CG2-CB 4.18Å; I89-F127 HydrophobicContact CG2-CD1 3.96Å; I89-F127 HydrophobicContact CG2-CD2 3.62Å; I89-F127 HydrophobicContact CG2-CE1 4.22Å; I89-F127 HydrophobicContact CG2-CE2 3.91Å; I89-F127 HydrophobicContact CG2-CG 3.64Å; I89-F127 HydrophobicContact CG2-CZ 4.18Å; L93-F127 HydrophobicContact CD1-CB 4.32Å; L93-F127 HydrophobicContact CD1-CD1 3.98Å; L93-F127 HydrophobicContact CD1-CG 4.41Å; L123-F127 WeakPolarHBondContact O-CB 3.35Å; L123-F127 PolarHBondContact O-N 3.4Å; S124-F127 PolarHBondContact O-N 3.06Å; R125-F127 VanDerWaalsContact C-N 3.31Å; R125-F127 PolarHBondContact O-N 3.11Å; F127-E129 VanDerWaalsContact C-N 3.34Å; F127-E129 PolarHBondContact O-N 3.28Å; F127-V130 PolarHBondContact O-N 3.45Å; F127-M131 HydrophobicContact CD2-CG 3.9Å; F127-M131 HydrophobicContact CE1-CG 4.4Å; F127-M131 HydrophobicContact CE2-CG 3.5Å; F127-M131 VanDerWaalsContact CE2-CG 3.5Å; F127-M131 HydrophobicContact CE2-SD 3.8Å; F127-M131 HydrophobicContact CZ-CG 3.79Å; F127-M131 HydrophobicContact CZ-SD 4.26Å; F127-M131 WeakPolarHBondContact O-CG 3.46Å; F127-M131 PolarHBondContact O-N 3.33Å; F127-M214 HydrophobicContact CE1-SD 4.26Å; F127-M214 HydrophobicContact CZ-CG 4.48Å; F127-M214 HydrophobicContact CZ-SD 3.63Å; F127-M218 HydrophobicContact CD1-CE 4.37Å; F127-M218 HydrophobicContact CD1-CG 4.12Å; F127-M218 HydrophobicContact CD1-SD 3.8Å; F127-M218 HydrophobicContact CE1-CG 3.91Å; F127-M218 HydrophobicContact CE1-SD 3.83Å
128	V	90.4	Very high	90.9	Very high	43 Å²	43	39.1 Å²	39.1	26%	0.261	20%	0.201	S	C	.	.	H	α-helix	trans	-62.4	-40.2	176.6	171.2	0	0	0	0	111.8	S124 R125 V130 M131 S132 M218 V222	S124-V128 WeakPolarHBondContact O-CG2 3.41Å; S124-V128 PolarHBondContact O-N 3.4Å; R125-V128 PolarHBondContact O-N 3.41Å; V128-V130 PolarHBondContact O-N 3.45Å; V128-M131 PolarHBondContact O-N 3.3Å; V128-S132 WeakPolarHBondContact O-CB 3.42Å; V128-S132 PolarHBondContact O-N 3.48Å; V128-M218 HydrophobicContact CG2-CB 3.78Å; V128-M218 HydrophobicContact CG2-CE 3.97Å; V128-M218 HydrophobicContact CG2-CG 4.18Å; V128-V222 HydrophobicContact CG2-CG2 4.11Å
129	E	90.6	Very high	91.3	Very high	113 Å²	113	39.6 Å²	39.6	53%	0.528	21%	0.206	S	C	.	.	H	α-helix	trans	-54.5	-53.3	174.3	-176.5	-171	-177.1	0	0	110.9	R125 K126 F127 M131 S132 E133	R125-E129 WeakPolarHBondContact O-CB 3.32Å; R125-E129 PolarHBondContact O-N 2.82Å; K126-E129 WeakPolarHBondContact CD-OE2 3.22Å; K126-E129 IonicContact NZ-OE1 3.81Å; K126-E129 IonicContact NZ-OE2 2.75Å; K126-E129 PolarHBondContact NZ-OE2 2.94Å; K126-E129 WeakPolarHBondContact O-CB 3.41Å; K126-E129 PolarHBondContact O-N 3.05Å; F127-E129 VanDerWaalsContact C-N 3.34Å; F127-E129 PolarHBondContact O-N 3.28Å; E129-M131 PolarHBondContact O-N 2.88Å; E129-S132 PolarHBondContact O-N 2.96Å; E129-E133 PolarHBondContact O-N 3.05Å
130	V	94.5	Very high	91.4	Very high	14 Å²	14	41.4 Å²	41.4	9%	0.085	22%	0.218	C	C	.	.	H	α-helix	trans	-65.4	-39.8	-179.7	176.6	0	0	0	0	111.9	I44 L47 A48 V51 K126 F127 V128 E133 Y134	I44-V130 HydrophobicContact CG2-CG2 4Å; L47-V130 HydrophobicContact CB-CG1 4.36Å; L47-V130 HydrophobicContact CD2-CB 4.46Å; L47-V130 HydrophobicContact CD2-CG1 3.83Å; L47-V130 HydrophobicContact CG-CG1 3.76Å; A48-V130 HydrophobicContact CB-CG1 4.04Å; A48-V130 HydrophobicContact CB-CG2 4.05Å; V51-V130 HydrophobicContact CG2-CG1 4.26Å; K126-V130 WeakPolarHBondContact O-CG2 3.09Å; K126-V130 PolarHBondContact O-N 3.05Å; K126-V130 VanDerWaalsContact O-N 3.17Å; F127-V130 PolarHBondContact O-N 3.45Å; V128-V130 PolarHBondContact O-N 3.45Å; V130-E133 WeakPolarHBondContact O-CB 3.47Å; V130-E133 PolarHBondContact O-N 3.19Å; V130-Y134 PolarHBondContact O-N 2.97Å
131	M	91.8	Very high	91.6	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.025	22%	0.219	C	C	.	.	H	α-helix	trans	-68	-36.8	177.6	-69.9	-53.3	-56.8	0	0	112.3	L47 A86 F127 V128 E129 E133 Y134 N135 L211 M214 F215	L47-M131 HydrophobicContact CD1-SD 4.48Å; L47-M131 HydrophobicContact CD2-SD 3.77Å; A86-M131 HydrophobicContact CB-CE 4.33Å; A86-M131 HydrophobicContact CB-SD 3.92Å; F127-M131 HydrophobicContact CD2-CG 3.9Å; F127-M131 HydrophobicContact CE1-CG 4.4Å; F127-M131 HydrophobicContact CE2-CG 3.5Å; F127-M131 VanDerWaalsContact CE2-CG 3.5Å; F127-M131 HydrophobicContact CE2-SD 3.8Å; F127-M131 HydrophobicContact CZ-CG 3.79Å; F127-M131 HydrophobicContact CZ-SD 4.26Å; F127-M131 WeakPolarHBondContact O-CG 3.46Å; F127-M131 PolarHBondContact O-N 3.33Å; V128-M131 PolarHBondContact O-N 3.3Å; E129-M131 PolarHBondContact O-N 2.88Å; M131-E133 VanDerWaalsContact C-N 3.34Å; M131-Y134 HydrophobicContact CE-CD1 4.12Å; M131-Y134 WeakPolarHBondContact O-CB 3.28Å; M131-Y134 PolarHBondContact O-N 3.48Å; M131-N135 PolarHBondContact O-N 3.2Å; M131-L211 HydrophobicContact CE-CD2 3.21Å; M131-L211 HydrophobicContact CE-CG 4.43Å; M131-M214 HydrophobicContact CE-SD 3.83Å; M131-M214 HydrophobicContact CG-SD 4.45Å; M131-M214 HydrophobicContact SD-SD 4.32Å; M131-F215 HydrophobicContact CB-CE1 3.92Å; M131-F215 HydrophobicContact CB-CZ 4Å; M131-F215 WeakPolarHBondContact O-CZ 3.26Å
132	S	90.9	Very high	92	Very high	57 Å²	57	43.8 Å²	43.8	40%	0.399	23%	0.227	S	C	.	.	H	α-helix	trans	-63.4	-41.9	173.5	-170.4	0	0	0	0	111	V128 E129 Y134 N135 T136	V128-S132 WeakPolarHBondContact O-CB 3.42Å; V128-S132 PolarHBondContact O-N 3.48Å; E129-S132 PolarHBondContact O-N 2.96Å; S132-Y134 VanDerWaalsContact C-N 3.32Å; S132-Y134 PolarHBondContact O-N 3.47Å; S132-N135 PolarHBondContact O-N 2.93Å; S132-T136 PolarHBondContact O-N 3.23Å; S132-T136 PolarHBondContact O-OG1 3.07Å
133	E	92.8	Very high	92.3	Very high	85 Å²	85	45.4 Å²	45.4	40%	0.397	23%	0.229	S	C	.	.	H	α-helix	trans	-61.8	-40.3	174.9	-174	61.8	-153	0	0	111.9	V51 K55 E129 V130 M131 T136 T137	V51-E133 HydrophobicContact CG1-CG 4.32Å; K55-E133 WeakPolarHBondContact CE-OE1 3.33Å; K55-E133 IonicContact NZ-OE1 2.73Å; K55-E133 PolarHBondContact NZ-OE1 3.45Å; E129-E133 PolarHBondContact O-N 3.05Å; V130-E133 WeakPolarHBondContact O-CB 3.47Å; V130-E133 PolarHBondContact O-N 3.19Å; M131-E133 VanDerWaalsContact C-N 3.34Å; E133-T136 PolarHBondContact O-N 3.5Å; E133-T137 WeakPolarHBondContact O-CB 3.47Å; E133-T137 PolarHBondContact O-N 3.25Å; E133-T137 PolarHBondContact O-OG1 3.05Å
134	Y	93.9	Very high	92.4	Very high	2 Å²	2	51 Å²	51	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-61.3	-46.1	172.6	-177.7	-119.1	0	0	0	111.4	V51 V54 I82 V130 M131 S132 T136 T137 Q138 S207 L211	V51-Y134 HydrophobicContact CG1-CD2 4.31Å; V51-Y134 HydrophobicContact CG2-CD2 3.81Å; V51-Y134 HydrophobicContact CG2-CG 4.08Å; V54-Y134 HydrophobicContact CG1-CE2 4.3Å; V54-Y134 HydrophobicContact CG2-CE2 4.45Å; I82-Y134 HydrophobicContact CD1-CD2 3.9Å; I82-Y134 HydrophobicContact CD1-CE2 3.45Å; I82-Y134 VanDerWaalsContact CD1-CE2 3.45Å; I82-Y134 HydrophobicContact CG2-CD1 4.12Å; I82-Y134 HydrophobicContact CG2-CD2 4.44Å; I82-Y134 HydrophobicContact CG2-CE1 3.84Å; I82-Y134 HydrophobicContact CG2-CE2 4.14Å; I82-Y134 HydrophobicContact CG2-CG 4.43Å; V130-Y134 PolarHBondContact O-N 2.97Å; M131-Y134 HydrophobicContact CE-CD1 4.12Å; M131-Y134 WeakPolarHBondContact O-CB 3.28Å; M131-Y134 PolarHBondContact O-N 3.48Å; S132-Y134 VanDerWaalsContact C-N 3.32Å; S132-Y134 PolarHBondContact O-N 3.47Å; Y134-T136 PolarHBondContact O-N 3.02Å; Y134-T137 WeakPolarHBondContact O-CB 3.46Å; Y134-T137 PolarHBondContact O-N 2.93Å; Y134-Q138 HydrophobicContact CD2-CG 4.4Å; Y134-Q138 HydrophobicContact CE1-CG 4.21Å; Y134-Q138 HydrophobicContact CE2-CG 4.11Å; Y134-Q138 WeakPolarHBondContact O-CG 3.47Å; Y134-Q138 PolarHBondContact O-N 2.95Å; Y134-Q138 PolarHBondContact OH-NE2 3.38Å; Y134-S207 PolarHBondContact OH-OG 2.58Å; Y134-L211 HydrophobicContact CD1-CD1 3.38Å; Y134-L211 HydrophobicContact CD1-CD2 3.86Å; Y134-L211 HydrophobicContact CD1-CG 4.16Å; Y134-L211 HydrophobicContact CE1-CD1 3.5Å; Y134-L211 VanDerWaalsContact CE1-CD1 3.5Å; Y134-L211 HydrophobicContact CE1-CD2 3.79Å; Y134-L211 HydrophobicContact CE1-CG 4Å
135	N	91.3	Very high	92.5	Very high	43 Å²	43	50.9 Å²	50.9	23%	0.23	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-45.7	177.4	-176.2	76.2	0	0	0	112.3	M131 S132 T137 Q138 S139 L211 F215	M131-N135 PolarHBondContact O-N 3.2Å; S132-N135 PolarHBondContact O-N 2.93Å; N135-T137 VanDerWaalsContact C-N 3.32Å; N135-T137 PolarHBondContact O-N 3.31Å; N135-Q138 PolarHBondContact O-N 3.47Å; N135-S139 PolarHBondContact O-N 3.46Å; N135-S139 PolarHBondContact O-OG 2.88Å; N135-L211 HydrophobicContact CB-CD1 4.45Å; N135-F215 HydrophobicContact CB-CE2 3.9Å; N135-F215 HydrophobicContact CB-CZ 3.9Å
136	T	92.4	Very high	92.7	Very high	59 Å²	59	46.7 Å²	46.7	36%	0.362	23%	0.234	S	C	.	.	H	α-helix	trans	-59.1	-44.2	175.2	-62.1	0	0	0	0	111.2	S132 E133 Y134 Q138 S139 D140	S132-T136 PolarHBondContact O-N 3.23Å; S132-T136 PolarHBondContact O-OG1 3.07Å; E133-T136 PolarHBondContact O-N 3.5Å; Y134-T136 PolarHBondContact O-N 3.02Å; T136-Q138 VanDerWaalsContact C-N 3.3Å; T136-Q138 PolarHBondContact O-N 3.3Å; T136-S139 PolarHBondContact O-N 3.49Å; T136-D140 WeakPolarHBondContact O-CB 3.4Å; T136-D140 VanDerWaalsContact O-CG 3.32Å; T136-D140 PolarHBondContact O-N 3.01Å
137	T	92.7	Very high	92.8	Very high	10 Å²	10	43.4 Å²	43.4	6%	0.061	23%	0.228	C	C	.	.	H	α-helix	trans	-56.3	-44.8	175.1	-62.7	0	0	0	0	112	V54 K55 E133 Y134 N135 Y141	V54-T137 HydrophobicContact CG1-CG2 4.2Å; K55-T137 HydrophobicContact CB-CG2 4.45Å; K55-T137 WeakPolarHBondContact CE-OG1 3.44Å; K55-T137 HydrophobicContact CG-CG2 3.43Å; K55-T137 VanDerWaalsContact CG-CG2 3.43Å; E133-T137 WeakPolarHBondContact O-CB 3.47Å; E133-T137 PolarHBondContact O-N 3.25Å; E133-T137 PolarHBondContact O-OG1 3.05Å; Y134-T137 WeakPolarHBondContact O-CB 3.46Å; Y134-T137 PolarHBondContact O-N 2.93Å; N135-T137 VanDerWaalsContact C-N 3.32Å; N135-T137 PolarHBondContact O-N 3.31Å; T137-Y141 WeakPolarHBondContact O-CB 3.28Å; T137-Y141 PolarHBondContact O-N 2.94Å; T137-Y141 VanDerWaalsContact O-N 3.07Å
138	Q	92.3	Very high	92.7	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-66.7	-46.3	178.3	-68.6	-50.6	-12.8	0	0	111.3	H58 Y134 N135 T136 D140 Y141 R142 L204 I208	H58-Q138 PolarHBondContact NE2-OE1 3.39Å; H58-Q138 VanDerWaalsContact NE2-OE1 3.1Å; Y134-Q138 HydrophobicContact CD2-CG 4.4Å; Y134-Q138 HydrophobicContact CE1-CG 4.21Å; Y134-Q138 HydrophobicContact CE2-CG 4.11Å; Y134-Q138 WeakPolarHBondContact O-CG 3.47Å; Y134-Q138 PolarHBondContact O-N 2.95Å; Y134-Q138 PolarHBondContact OH-NE2 3.38Å; N135-Q138 PolarHBondContact O-N 3.47Å; T136-Q138 VanDerWaalsContact C-N 3.3Å; T136-Q138 PolarHBondContact O-N 3.3Å; Q138-D140 PolarHBondContact O-N 2.83Å; Q138-Y141 WeakPolarHBondContact O-CB 3.24Å; Q138-Y141 PolarHBondContact O-N 2.96Å; Q138-R142 PolarHBondContact O-N 3.22Å; Q138-L204 HydrophobicContact CB-CD1 3.46Å; Q138-L204 VanDerWaalsContact CB-CD1 3.46Å; Q138-L204 HydrophobicContact CG-CD1 3.86Å; Q138-L204 WeakPolarHBondContact O-CD2 3.49Å; Q138-I208 HydrophobicContact CB-CD1 4.03Å; Q138-I208 HydrophobicContact CB-CG1 3.94Å
139	S	92	Very high	92.8	Very high	52 Å²	52	45.7 Å²	45.7	36%	0.364	23%	0.232	S	C	.	.	H	α-helix	trans	-60.1	-43.5	176.6	-63.5	0	0	0	0	112.7	N135 T136 Y141 R142 E143	N135-S139 PolarHBondContact O-N 3.46Å; N135-S139 PolarHBondContact O-OG 2.88Å; T136-S139 PolarHBondContact O-N 3.49Å; S139-Y141 VanDerWaalsContact C-N 3.3Å; S139-Y141 PolarHBondContact O-N 3.01Å; S139-R142 WeakPolarHBondContact O-CB 3.44Å; S139-R142 PolarHBondContact O-N 3.38Å; S139-E143 PolarHBondContact O-N 2.91Å; S139-E143 VanDerWaalsContact O-N 3.11Å
140	D	93.4	Very high	92.9	Very high	98 Å²	98	42.5 Å²	42.5	52%	0.524	22%	0.217	S	C	.	.	H	α-helix	trans	-62.1	-39.8	176.5	-74.5	-12.1	0	0	0	111.5	T136 Q138 E143 R144	T136-D140 WeakPolarHBondContact O-CB 3.4Å; T136-D140 VanDerWaalsContact O-CG 3.32Å; T136-D140 PolarHBondContact O-N 3.01Å; Q138-D140 PolarHBondContact O-N 2.83Å; D140-E143 PolarHBondContact O-N 3.44Å; D140-R144 VanDerWaalsContact O-CG 3.28Å; D140-R144 WeakPolarHBondContact O-CG 3.38Å; D140-R144 PolarHBondContact O-N 3.1Å; D140-R144 VanDerWaalsContact O-N 3.1Å
141	Y	94.4	Very high	92.7	Very high	7 Å²	7	49.4 Å²	49.4	3%	0.027	24%	0.242	C	C	.	.	H	α-helix	trans	-64.4	-41.8	175.5	-170.3	-112.6	0	0	0	112.1	H58 I61 L62 T137 Q138 S139 E143 R144 C145 E200 L204	H58-Y141 HydrophobicContact CB-CD2 3.32Å; H58-Y141 HydrophobicContact CB-CE2 3.45Å; H58-Y141 VanDerWaalsContact CB-CE2 3.45Å; H58-Y141 HydrophobicContact CB-CG 4.07Å; H58-Y141 AromaticContact CD2-CG 3.89Å; H58-Y141 AromaticContact CE1-CD1 3.43Å; H58-Y141 VanDerWaalsContact CE1-CD1 3.43Å; H58-Y141 WeakPolarHBondContact CE1-CD1 3.36Å; H58-Y141 AromaticContact CE1-CE1 3.74Å; H58-Y141 AromaticContact CE1-CG 3.67Å; H58-Y141 AromaticContact CG-CD2 3.32Å; H58-Y141 AromaticContact CG-CE2 3.58Å; H58-Y141 AromaticContact CG-CG 3.55Å; H58-Y141 AromaticContact ND1-CD1 3.4Å; H58-Y141 WeakPolarHBondContact ND1-CD1 3.34Å; H58-Y141 AromaticContact ND1-CD2 3.4Å; H58-Y141 WeakPolarHBondContact ND1-CD2 3.34Å; H58-Y141 AromaticContact ND1-CE1 3.42Å; H58-Y141 WeakPolarHBondContact ND1-CE1 3.48Å; H58-Y141 AromaticContact ND1-CE2 3.34Å; H58-Y141 VanDerWaalsContact ND1-CE2 3.34Å; H58-Y141 WeakPolarHBondContact ND1-CE2 3.22Å; H58-Y141 AromaticContact ND1-CG 3.4Å; H58-Y141 AromaticContact ND1-CZ 3.4Å; H58-Y141 AromaticContact NE2-CG 3.98Å; H58-Y141 WeakPolarHBondContact O-CE2 3.32Å; I61-Y141 WeakPolarHBondContact CG2-OH 3.43Å; L62-Y141 HydrophobicContact CD1-CD2 3.58Å; L62-Y141 HydrophobicContact CD1-CE2 3.4Å; L62-Y141 HydrophobicContact CD2-CE2 4.31Å; L62-Y141 HydrophobicContact CG-CD2 4.23Å; L62-Y141 HydrophobicContact CG-CE2 3.53Å; T137-Y141 WeakPolarHBondContact O-CB 3.28Å; T137-Y141 PolarHBondContact O-N 2.94Å; T137-Y141 VanDerWaalsContact O-N 3.07Å; Q138-Y141 WeakPolarHBondContact O-CB 3.24Å; Q138-Y141 PolarHBondContact O-N 2.96Å; S139-Y141 VanDerWaalsContact C-N 3.3Å; S139-Y141 PolarHBondContact O-N 3.01Å; Y141-E143 VanDerWaalsContact C-N 3.33Å; Y141-E143 PolarHBondContact O-N 3.37Å; Y141-R144 PolarHBondContact O-N 3.14Å; Y141-C145 VanDerWaalsContact CE1-SG 3.59Å; Y141-C145 PolarHBondContact O-N 3.48Å; Y141-E200 HydrophobicContact CE1-CB 4.28Å; Y141-E200 PolarHBondContact OH-OE2 3.17Å; Y141-L204 HydrophobicContact CD1-CD2 4.11Å
142	R	94.4	Very high	92.6	Very high	45 Å²	45	50.3 Å²	50.3	17%	0.17	25%	0.246	C	C	.	.	H	α-helix	trans	-54.9	-50.7	176.2	-165.5	177.8	177.7	-88.9	2.9	110.8	Q138 S139 R144 C145 K146 E166 I201 L204 E205	Q138-R142 PolarHBondContact O-N 3.22Å; S139-R142 WeakPolarHBondContact O-CB 3.44Å; S139-R142 PolarHBondContact O-N 3.38Å; R142-R144 VanDerWaalsContact C-N 3.31Å; R142-R144 PolarHBondContact O-N 2.82Å; R142-C145 PolarHBondContact O-N 2.88Å; R142-K146 PolarHBondContact O-N 3.05Å; R142-E166 IonicContact CZ-OE1 3.2Å; R142-E166 IonicContact NH1-OE1 2.83Å; R142-E166 PolarHBondContact NH1-OE1 2.99Å; R142-E166 IonicContact NH1-OE2 3.72Å; R142-E166 IonicContact NH2-OE1 3.64Å; R142-E166 PolarHBondContact NH2-OE1 3.42Å; R142-I201 HydrophobicContact CG-CG1 4.44Å; R142-I201 HydrophobicContact CG-CG2 4.28Å; R142-L204 HydrophobicContact CB-CD2 3.33Å; R142-L204 HydrophobicContact CB-CG 4.47Å; R142-L204 HydrophobicContact CG-CD2 3.86Å; R142-E205 IonicContact CZ-OE1 3.29Å; R142-E205 VanDerWaalsContact CZ-OE1 3.29Å; R142-E205 IonicContact NE-OE1 2.92Å; R142-E205 PolarHBondContact NE-OE1 3.43Å; R142-E205 IonicContact NH2-OE1 2.76Å; R142-E205 PolarHBondContact NH2-OE1 3.5Å
143	E	93.8	Very high	92.5	Very high	102 Å²	102	47.6 Å²	47.6	48%	0.477	23%	0.227	S	C	.	.	H	α-helix	trans	-65.1	-38.3	-176.8	-170.4	56.4	-149.2	0	0	111.3	S139 D140 Y141 K146 G147	S139-E143 PolarHBondContact O-N 2.91Å; S139-E143 VanDerWaalsContact O-N 3.11Å; D140-E143 PolarHBondContact O-N 3.44Å; Y141-E143 VanDerWaalsContact C-N 3.33Å; Y141-E143 PolarHBondContact O-N 3.37Å; E143-K146 PolarHBondContact O-N 2.86Å; E143-G147 PolarHBondContact O-N 3.34Å
144	R	94.4	Very high	92.3	Very high	128 Å²	128	48.1 Å²	48.1	48%	0.483	23%	0.23	S	C	.	.	H	α-helix	trans	-65.8	-39.6	174.3	-69	178.9	74.3	-174.9	-0.8	112.4	L62 D140 Y141 R142 G147 R148	L62-R144 HydrophobicContact CD1-CB 3.64Å; L62-R144 HydrophobicContact CD1-CG 4.41Å; L62-R144 HydrophobicContact CD2-CB 4.45Å; D140-R144 VanDerWaalsContact O-CG 3.28Å; D140-R144 WeakPolarHBondContact O-CG 3.38Å; D140-R144 PolarHBondContact O-N 3.1Å; D140-R144 VanDerWaalsContact O-N 3.1Å; Y141-R144 PolarHBondContact O-N 3.14Å; R142-R144 VanDerWaalsContact C-N 3.31Å; R142-R144 PolarHBondContact O-N 2.82Å; R144-G147 PolarHBondContact O-N 3.07Å; R144-R148 WeakPolarHBondContact O-CG 3.42Å; R144-R148 PolarHBondContact O-N 2.96Å
145	C	93.1	Very high	91.9	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-43.9	173.6	-75.3	0	0	0	0	111.6	Y141 R142 G147 R148 I149 R197 I201	Y141-C145 VanDerWaalsContact CE1-SG 3.59Å; Y141-C145 PolarHBondContact O-N 3.48Å; R142-C145 PolarHBondContact O-N 2.88Å; C145-G147 PolarHBondContact O-N 3.3Å; C145-R148 WeakPolarHBondContact O-CB 3.29Å; C145-R148 PolarHBondContact O-N 3.32Å; C145-R148 VanDerWaalsContact O-N 3.17Å; C145-I149 WeakPolarHBondContact O-CG1 3.34Å; C145-I149 PolarHBondContact O-N 3.19Å; C145-R197 HydrophobicContact CB-CB 4.45Å; C145-I201 HydrophobicContact CB-CD1 3.84Å; C145-I201 HydrophobicContact CB-CG1 3.68Å
146	K	93.4	Very high	91.6	Very high	16 Å²	16	51.4 Å²	51.4	7%	0.07	25%	0.247	C	C	.	.	H	α-helix	trans	-56.7	-49.4	174.1	179.6	-179.7	175.4	173.5	0	111.5	R142 E143 R148 I149 Q150 N162 L165 E166 L169	R142-K146 PolarHBondContact O-N 3.05Å; E143-K146 PolarHBondContact O-N 2.86Å; K146-R148 VanDerWaalsContact C-N 3.28Å; K146-R148 PolarHBondContact O-N 3.31Å; K146-I149 PolarHBondContact O-N 3.09Å; K146-I149 VanDerWaalsContact O-N 3.13Å; K146-Q150 PolarHBondContact O-N 2.91Å; K146-N162 PolarHBondContact NZ-O 3.17Å; K146-L165 HydrophobicContact CD-CD2 4.43Å; K146-L165 HydrophobicContact CG-CD2 3.56Å; K146-L165 HydrophobicContact CG-CG 4.14Å; K146-E166 WeakPolarHBondContact CE-OE2 3.43Å; K146-E166 IonicContact NZ-OE2 2.68Å; K146-E166 PolarHBondContact NZ-OE2 2.97Å; K146-L169 HydrophobicContact CB-CD1 4.4Å; K146-L169 HydrophobicContact CD-CD1 4.35Å; K146-L169 HydrophobicContact CG-CD1 4.09Å
147	G	93.2	Very high	91.2	Very high	31 Å²	31	51.8 Å²	51.8	32%	0.32	26%	0.263	S	S	.	.	H	α-helix	trans	-62.1	-32.1	177	0	0	0	0	0	113.8	E143 R144 C145 R151	E143-G147 PolarHBondContact O-N 3.34Å; R144-G147 PolarHBondContact O-N 3.07Å; C145-G147 PolarHBondContact O-N 3.3Å; G147-R151 PolarHBondContact O-N 3.06Å; G147-R151 VanDerWaalsContact O-N 3.14Å
148	R	91.8	Very high	90.7	Very high	92 Å²	92	54.7 Å²	54.7	35%	0.347	27%	0.272	S	S	.	.	H	α-helix	trans	-65.7	-47.3	171.4	-72	-70	-166.7	-170.3	4.2	111.4	L62 R144 C145 K146 Q150 R151 Q152 R197	L62-R148 HydrophobicContact CD2-CG 3.94Å; L62-R148 PolarHBondContact O-NH2 3.01Å; R144-R148 WeakPolarHBondContact O-CG 3.42Å; R144-R148 PolarHBondContact O-N 2.96Å; C145-R148 WeakPolarHBondContact O-CB 3.29Å; C145-R148 PolarHBondContact O-N 3.32Å; C145-R148 VanDerWaalsContact O-N 3.17Å; K146-R148 VanDerWaalsContact C-N 3.28Å; K146-R148 PolarHBondContact O-N 3.31Å; R148-Q150 VanDerWaalsContact C-N 3.33Å; R148-Q150 PolarHBondContact O-N 3.26Å; R148-R151 PolarHBondContact O-N 3.16Å; R148-Q152 WeakPolarHBondContact O-CG 3.32Å; R148-Q152 PolarHBondContact O-N 3.34Å; R148-R197 HydrophobicContact CB-CG 4.29Å
149	I	91.4	Very high	90.3	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.3	-46	177.8	-66.7	168.2	0	0	0	110.5	C145 K146 R151 Q152 L153 L165 L169 F177 I194 R197 H198 I201	C145-I149 WeakPolarHBondContact O-CG1 3.34Å; C145-I149 PolarHBondContact O-N 3.19Å; K146-I149 PolarHBondContact O-N 3.09Å; K146-I149 VanDerWaalsContact O-N 3.13Å; I149-R151 VanDerWaalsContact C-N 3.33Å; I149-R151 PolarHBondContact O-N 2.87Å; I149-Q152 PolarHBondContact O-N 2.86Å; I149-Q152 VanDerWaalsContact O-N 3.13Å; I149-L153 HydrophobicContact CG2-CD1 4.08Å; I149-L153 HydrophobicContact CG2-CG 4.45Å; I149-L153 WeakPolarHBondContact O-CG 3.37Å; I149-L153 PolarHBondContact O-N 3.47Å; I149-L165 HydrophobicContact CG2-CD1 3.7Å; I149-L169 HydrophobicContact CD1-CD2 3.87Å; I149-F177 HydrophobicContact CG2-CD1 4.23Å; I149-F177 HydrophobicContact CG2-CE1 3.96Å; I149-I194 HydrophobicContact CG1-CG2 4.44Å; I149-I194 HydrophobicContact CG2-CG1 4.22Å; I149-I194 HydrophobicContact CG2-CG2 3.99Å; I149-R197 HydrophobicContact CD1-CB 3.88Å; I149-R197 HydrophobicContact CG1-CB 3.68Å; I149-H198 HydrophobicContact CD1-CB 4.41Å; I149-I201 HydrophobicContact CD1-CD1 3.75Å
150	Q	92.5	Very high	90.1	Very high	45 Å²	45	59 Å²	59	21%	0.21	29%	0.292	C	S	.	.	H	α-helix	trans	-55.4	-48.4	176.9	-168.8	172.2	20.3	0	0	111.6	K146 R148 Q152 L153 E154 T160 N162 L165	K146-Q150 PolarHBondContact O-N 2.91Å; R148-Q150 VanDerWaalsContact C-N 3.33Å; R148-Q150 PolarHBondContact O-N 3.26Å; Q150-Q152 VanDerWaalsContact C-N 3.31Å; Q150-Q152 PolarHBondContact O-N 3.27Å; Q150-L153 WeakPolarHBondContact O-CB 3.49Å; Q150-L153 PolarHBondContact O-N 2.8Å; Q150-E154 WeakPolarHBondContact O-CG 3.19Å; Q150-E154 PolarHBondContact O-N 3.46Å; Q150-T160 PolarHBondContact NE2-O 3.37Å; Q150-N162 PolarHBondContact NE2-OD1 2.98Å; Q150-L165 HydrophobicContact CB-CD2 3.69Å; Q150-L165 HydrophobicContact CG-CD2 4.26Å
151	R	90.9	Very high	90	Very high	160 Å²	160	57.5 Å²	57.5	60%	0.604	29%	0.286	S	S	*	.	H	α-helix	trans	-62.7	-36.9	178.5	-169.5	174.3	-174.8	104.2	1.3	112.7	G147 R148 I149 E154 I155	G147-R151 PolarHBondContact O-N 3.06Å; G147-R151 VanDerWaalsContact O-N 3.14Å; R148-R151 PolarHBondContact O-N 3.16Å; I149-R151 VanDerWaalsContact C-N 3.33Å; I149-R151 PolarHBondContact O-N 2.87Å; R151-E154 PolarHBondContact O-N 3.29Å; R151-I155 VanDerWaalsContact O-CG1 3.31Å; R151-I155 WeakPolarHBondContact O-CG1 3.28Å; R151-I155 PolarHBondContact O-N 3.32Å; R151-I155 VanDerWaalsContact O-N 3.11Å
152	Q	89.1	Confident	89.7	Confident	23 Å²	23	60.6 Å²	60.6	11%	0.107	30%	0.303	C	S	.	.	H	α-helix	trans	-69.4	-36.2	176.3	-66.5	-57.7	-23.9	0	0	112.1	R148 I149 Q150 I155 T156 A190 E193 I194	R148-Q152 WeakPolarHBondContact O-CG 3.32Å; R148-Q152 PolarHBondContact O-N 3.34Å; I149-Q152 PolarHBondContact O-N 2.86Å; I149-Q152 VanDerWaalsContact O-N 3.13Å; Q150-Q152 VanDerWaalsContact C-N 3.31Å; Q150-Q152 PolarHBondContact O-N 3.27Å; Q152-I155 PolarHBondContact O-N 3.11Å; Q152-T156 VanDerWaalsContact O-CG2 3.22Å; Q152-T156 WeakPolarHBondContact O-CG2 3.41Å; Q152-T156 PolarHBondContact O-N 2.94Å; Q152-T156 VanDerWaalsContact O-N 3.17Å; Q152-A190 HydrophobicContact CB-CB 4.33Å; Q152-E193 HydrophobicContact CG-CB 4.32Å; Q152-E193 HydrophobicContact CG-CG 4.26Å; Q152-E193 PolarHBondContact NE2-OE1 3.24Å; Q152-E193 PolarHBondContact NE2-OE2 3.46Å; Q152-I194 HydrophobicContact CB-CD1 3.73Å; Q152-I194 HydrophobicContact CB-CG1 3.54Å; Q152-I194 HydrophobicContact CG-CG1 4.28Å
153	L	88.8	Confident	89.4	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-63.6	-42.3	172.5	-69.9	169.8	0	0	0	111.6	I149 Q150 I155 T156 G157 R158 L165 M168 I181 I194	I149-L153 HydrophobicContact CG2-CD1 4.08Å; I149-L153 HydrophobicContact CG2-CG 4.45Å; I149-L153 WeakPolarHBondContact O-CG 3.37Å; I149-L153 PolarHBondContact O-N 3.47Å; Q150-L153 WeakPolarHBondContact O-CB 3.49Å; Q150-L153 PolarHBondContact O-N 2.8Å; L153-I155 VanDerWaalsContact C-N 3.33Å; L153-I155 PolarHBondContact O-N 3.17Å; L153-T156 PolarHBondContact O-N 3.28Å; L153-T156 VanDerWaalsContact O-N 3.09Å; L153-T156 PolarHBondContact O-OG1 3.33Å; L153-G157 PolarHBondContact O-N 2.87Å; L153-R158 CarbonylContact C-O 3.2Å; L153-R158 PolarHBondContact O-N 3.23Å; L153-L165 HydrophobicContact CD1-CD1 4Å; L153-M168 HydrophobicContact CD1-CE 4.39Å; L153-I181 HydrophobicContact CD2-CD1 4.45Å; L153-I194 HydrophobicContact CD2-CD1 3.89Å; L153-I194 HydrophobicContact CG-CD1 4.04Å
154	E	89.2	Confident	89.1	Confident	96 Å²	96	65.3 Å²	65.3	45%	0.449	33%	0.327	S	S	.	.	H	α-helix	trans	-59.9	-41.4	174.6	-70.6	173.6	-178.1	0	0	112.2	Q150 R151 T156 G157 R158	Q150-E154 WeakPolarHBondContact O-CG 3.19Å; Q150-E154 PolarHBondContact O-N 3.46Å; R151-E154 PolarHBondContact O-N 3.29Å; E154-T156 PolarHBondContact O-N 2.98Å; E154-G157 PolarHBondContact O-N 3.08Å; E154-R158 PolarHBondContact N-O 3.27Å
155	I	86.4	Confident	88.9	Confident	91 Å²	91	59.2 Å²	59.2	47%	0.467	30%	0.304	S	S	.	.	H	α-helix	trans	-60.7	-35.8	175.8	-70.1	164.3	0	0	0	111.2	R151 Q152 L153 G157 I186	R151-I155 VanDerWaalsContact O-CG1 3.31Å; R151-I155 WeakPolarHBondContact O-CG1 3.28Å; R151-I155 PolarHBondContact O-N 3.32Å; R151-I155 VanDerWaalsContact O-N 3.11Å; Q152-I155 PolarHBondContact O-N 3.11Å; L153-I155 VanDerWaalsContact C-N 3.33Å; L153-I155 PolarHBondContact O-N 3.17Å; I155-G157 PolarHBondContact O-N 3.34Å; I155-I186 HydrophobicContact CG2-CG2 4.18Å
156	T	84.3	Confident	88.8	Confident	22 Å²	22	61.1 Å²	61.1	14%	0.135	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-0.2	177.1	70.1	0	0	0	0	113.8	Q152 L153 E154 I181 T187 A190 M191	Q152-T156 VanDerWaalsContact O-CG2 3.22Å; Q152-T156 WeakPolarHBondContact O-CG2 3.41Å; Q152-T156 PolarHBondContact O-N 2.94Å; Q152-T156 VanDerWaalsContact O-N 3.17Å; L153-T156 PolarHBondContact O-N 3.28Å; L153-T156 VanDerWaalsContact O-N 3.09Å; L153-T156 PolarHBondContact O-OG1 3.33Å; E154-T156 PolarHBondContact O-N 2.98Å; T156-I181 HydrophobicContact CG2-CD1 4.28Å; T156-I181 HydrophobicContact CG2-CG2 4.39Å; T156-I181 WeakPolarHBondContact OG1-CD1 3.36Å; T156-T187 HydrophobicContact CG2-CG2 3.82Å; T156-A190 HydrophobicContact CG2-CB 3.64Å; T156-M191 HydrophobicContact CG2-CE 3.39Å
157	G	82.6	Confident	88.5	Confident	67 Å²	67	63.8 Å²	63.8	69%	0.691	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.5	11.9	179.8	0	0	0	0	0	114.4	L153 E154 I155	L153-G157 PolarHBondContact O-N 2.87Å; E154-G157 PolarHBondContact O-N 3.08Å; I155-G157 PolarHBondContact O-N 3.34Å
158	R	83.4	Confident	88.3	Confident	71 Å²	71	62.7 Å²	62.7	27%	0.268	32%	0.321	S	S	.	.			trans	-105.4	104.7	177.5	-175.7	173.9	172.9	-179.3	-4.4	109.9	L153 E154 M168 I176 S179	L153-R158 CarbonylContact C-O 3.2Å; L153-R158 PolarHBondContact O-N 3.23Å; E154-R158 PolarHBondContact N-O 3.27Å; R158-M168 PolarHBondContact NH2-SD 3.48Å; R158-I176 PolarHBondContact NH1-O 3.27Å; R158-S179 PolarHBondContact NH1-O 3.44Å
159	N	84.7	Confident	88.1	Confident	134 Å²	134	58.9 Å²	58.9	72%	0.717	31%	0.307	S	S	*	.			trans	-74.6	131.9	168.5	-69.3	-15.9	0	0	0	108.9
160	T	87	Confident	87.8	Confident	10 Å²	10	65.8 Å²	65.8	6%	0.061	34%	0.34	C	S	.	.			trans	-136.5	130.2	-178	-53.9	0	0	0	0	108.6	Q150 E164 L165 M168	Q150-T160 PolarHBondContact NE2-O 3.37Å; T160-E164 HydrophobicContact CG2-CB 3.57Å; T160-L165 HydrophobicContact CG2-CB 3.95Å; T160-M168 HydrophobicContact CG2-SD 3.99Å
161	T	90.6	Very high	87.4	Confident	66 Å²	66	65 Å²	65	41%	0.405	34%	0.339	S	S	.	.			trans	-72.3	166.3	175.5	69.3	0	0	0	0	110.8	E163 E164 L165	T161-E163 VanDerWaalsContact C-N 3.26Å; T161-E163 PolarHBondContact O-N 3.23Å; T161-E164 PolarHBondContact N-OE2 2.91Å; T161-E164 PolarHBondContact O-N 2.76Å; T161-E164 WeakPolarHBondContact OG1-CB 3.44Å; T161-E164 VanDerWaalsContact OG1-CG 3.24Å; T161-E164 WeakPolarHBondContact OG1-CG 3.06Å; T161-E164 PolarHBondContact OG1-N 3.32Å; T161-E164 VanDerWaalsContact OG1-N 3.17Å; T161-L165 WeakPolarHBondContact O-CB 3.35Å; T161-L165 PolarHBondContact O-N 2.85Å
162	N	88.1	Confident	86.5	Confident	72 Å²	72	65.5 Å²	65.5	39%	0.385	35%	0.353	S	S	.	.	H	α-helix	trans	-63.4	-35.5	178.3	-80.5	-15.6	0	0	0	112.3	K146 Q150 E166	K146-N162 PolarHBondContact NZ-O 3.17Å; Q150-N162 PolarHBondContact NE2-OD1 2.98Å; N162-E166 WeakPolarHBondContact O-CB 3.26Å; N162-E166 PolarHBondContact O-N 3.12Å
163	E	88.4	Confident	86	Confident	143 Å²	143	68.6 Å²	68.6	67%	0.668	37%	0.371	S	S	*	.	H	α-helix	trans	-72.5	-42	178.7	-63.9	71.8	-158	0	0	111.4	T161 L165 E166 S167	T161-E163 VanDerWaalsContact C-N 3.26Å; T161-E163 PolarHBondContact O-N 3.23Å; E163-L165 VanDerWaalsContact C-N 3.35Å; E163-E166 PolarHBondContact O-N 3.41Å; E163-S167 PolarHBondContact O-N 3.2Å
164	E	88.4	Confident	85.1	Confident	103 Å²	103	72.5 Å²	72.5	48%	0.481	40%	0.396	S	S	.	.	H	α-helix	trans	-63.2	-43.2	174.4	-73.7	171.2	167.9	0	0	111	T160 T161 E166 S167 M168	T160-E164 HydrophobicContact CG2-CB 3.57Å; T161-E164 PolarHBondContact N-OE2 2.91Å; T161-E164 PolarHBondContact O-N 2.76Å; T161-E164 WeakPolarHBondContact OG1-CB 3.44Å; T161-E164 VanDerWaalsContact OG1-CG 3.24Å; T161-E164 WeakPolarHBondContact OG1-CG 3.06Å; T161-E164 PolarHBondContact OG1-N 3.32Å; T161-E164 VanDerWaalsContact OG1-N 3.17Å; E164-E166 VanDerWaalsContact C-N 3.34Å; E164-E166 PolarHBondContact O-N 2.93Å; E164-S167 PolarHBondContact O-N 3.01Å; E164-M168 VanDerWaalsContact O-CG 3.25Å; E164-M168 WeakPolarHBondContact O-CG 3.4Å; E164-M168 PolarHBondContact O-N 2.89Å
165	L	90	Very high	84.4	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-64.5	-39.7	177.9	179.2	57	0	0	0	111.5	K146 I149 Q150 L153 T160 T161 E163 M168 L169 F177	K146-L165 HydrophobicContact CD-CD2 4.43Å; K146-L165 HydrophobicContact CG-CD2 3.56Å; K146-L165 HydrophobicContact CG-CG 4.14Å; I149-L165 HydrophobicContact CG2-CD1 3.7Å; Q150-L165 HydrophobicContact CB-CD2 3.69Å; Q150-L165 HydrophobicContact CG-CD2 4.26Å; L153-L165 HydrophobicContact CD1-CD1 4Å; T160-L165 HydrophobicContact CG2-CB 3.95Å; T161-L165 WeakPolarHBondContact O-CB 3.35Å; T161-L165 PolarHBondContact O-N 2.85Å; E163-L165 VanDerWaalsContact C-N 3.35Å; L165-M168 WeakPolarHBondContact O-CB 3.45Å; L165-M168 PolarHBondContact O-N 2.93Å; L165-L169 HydrophobicContact CD1-CG 4.47Å; L165-L169 HydrophobicContact CG-CD1 4.39Å; L165-L169 WeakPolarHBondContact O-CG 3.36Å; L165-L169 PolarHBondContact O-N 2.85Å; L165-F177 HydrophobicContact CD1-CE1 4.26Å
166	E	90	Very high	84.2	Confident	40 Å²	40	68 Å²	68	19%	0.187	38%	0.382	C	S	.	.	H	α-helix	trans	-62.1	-46.6	175.5	-157.9	68.1	-159.7	0	0	111.1	R142 K146 N162 E163 E164 M168 L169 E170	R142-E166 IonicContact CZ-OE1 3.2Å; R142-E166 IonicContact NH1-OE1 2.83Å; R142-E166 PolarHBondContact NH1-OE1 2.99Å; R142-E166 IonicContact NH1-OE2 3.72Å; R142-E166 IonicContact NH2-OE1 3.64Å; R142-E166 PolarHBondContact NH2-OE1 3.42Å; K146-E166 WeakPolarHBondContact CE-OE2 3.43Å; K146-E166 IonicContact NZ-OE2 2.68Å; K146-E166 PolarHBondContact NZ-OE2 2.97Å; N162-E166 WeakPolarHBondContact O-CB 3.26Å; N162-E166 PolarHBondContact O-N 3.12Å; E163-E166 PolarHBondContact O-N 3.41Å; E164-E166 VanDerWaalsContact C-N 3.34Å; E164-E166 PolarHBondContact O-N 2.93Å; E166-M168 PolarHBondContact O-N 3.3Å; E166-L169 WeakPolarHBondContact O-CB 3.42Å; E166-L169 PolarHBondContact O-N 2.85Å; E166-E170 WeakPolarHBondContact O-CG 3.48Å; E166-E170 PolarHBondContact O-N 3.45Å
167	S	87.9	Confident	84	Confident	73 Å²	73	67.2 Å²	67.2	51%	0.51	38%	0.377	S	S	.	.	H	α-helix	trans	-59.9	-31.7	175.4	177.5	0	0	0	0	112.6	E163 E164 S171	E163-S167 PolarHBondContact O-N 3.2Å; E164-S167 PolarHBondContact O-N 3.01Å; S167-S171 PolarHBondContact O-N 3.46Å
168	M	88.2	Confident	83.7	Confident	7 Å²	7	67 Å²	67	3%	0.034	36%	0.362	C	S	.	.	H	α-helix	trans	-71.2	-39.7	174.6	-68.8	171.7	66.7	0	0	112.5	L153 R158 T160 E164 L165 E166 S171 I176 F177	L153-M168 HydrophobicContact CD1-CE 4.39Å; R158-M168 PolarHBondContact NH2-SD 3.48Å; T160-M168 HydrophobicContact CG2-SD 3.99Å; E164-M168 VanDerWaalsContact O-CG 3.25Å; E164-M168 WeakPolarHBondContact O-CG 3.4Å; E164-M168 PolarHBondContact O-N 2.89Å; L165-M168 WeakPolarHBondContact O-CB 3.45Å; L165-M168 PolarHBondContact O-N 2.93Å; E166-M168 PolarHBondContact O-N 3.3Å; M168-S171 WeakPolarHBondContact O-CB 3.35Å; M168-S171 PolarHBondContact O-N 3.42Å; M168-S171 PolarHBondContact O-OG 3.45Å; M168-I176 HydrophobicContact CB-CD1 4.27Å; M168-I176 HydrophobicContact CB-CG2 4.1Å; M168-I176 HydrophobicContact CE-CG1 4.28Å; M168-I176 HydrophobicContact CE-CG2 4.17Å; M168-I176 HydrophobicContact CG-CD1 3.86Å; M168-I176 HydrophobicContact CG-CG1 4.03Å; M168-I176 HydrophobicContact CG-CG2 4.42Å; M168-F177 HydrophobicContact CB-CE1 4.01Å; M168-F177 HydrophobicContact CB-CZ 4.23Å; M168-F177 HydrophobicContact CE-CD1 3.5Å; M168-F177 HydrophobicContact CE-CE1 3.82Å; M168-F177 HydrophobicContact CE-CG 4.25Å
169	L	88.5	Confident	83.1	Confident	12 Å²	12	67.5 Å²	67.5	6%	0.063	38%	0.377	C	S	.	.	H	α-helix	trans	-67.8	-34.6	175.8	-68.4	170.7	0	0	0	112.3	K146 I149 L165 E166 S171 F177 I201	K146-L169 HydrophobicContact CB-CD1 4.4Å; K146-L169 HydrophobicContact CD-CD1 4.35Å; K146-L169 HydrophobicContact CG-CD1 4.09Å; I149-L169 HydrophobicContact CD1-CD2 3.87Å; L165-L169 HydrophobicContact CD1-CG 4.47Å; L165-L169 HydrophobicContact CG-CD1 4.39Å; L165-L169 WeakPolarHBondContact O-CG 3.36Å; L165-L169 PolarHBondContact O-N 2.85Å; E166-L169 WeakPolarHBondContact O-CB 3.42Å; E166-L169 PolarHBondContact O-N 2.85Å; L169-S171 PolarHBondContact O-N 3.04Å; L169-F177 HydrophobicContact CD2-CZ 4.05Å; L169-I201 HydrophobicContact CD1-CD1 4.15Å; L169-I201 HydrophobicContact CD2-CD1 3.74Å
170	E	85.6	Confident	82.3	Confident	146 Å²	146	65.2 Å²	65.2	68%	0.682	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-14.4	174.7	-70.5	177.5	179.2	0	0	113.1	E166	E166-E170 WeakPolarHBondContact O-CG 3.48Å; E166-E170 PolarHBondContact O-N 3.45Å
171	S	82.3	Confident	81.7	Confident	27 Å²	27	66.1 Å²	66.1	19%	0.189	39%	0.388	C	S	.	.	S	Bend	trans	-82.1	132.3	-177.9	82.5	0	0	0	0	111.7	S167 M168 L169 N173 I176	S167-S171 PolarHBondContact O-N 3.46Å; M168-S171 WeakPolarHBondContact O-CB 3.35Å; M168-S171 PolarHBondContact O-N 3.42Å; M168-S171 PolarHBondContact O-OG 3.45Å; L169-S171 PolarHBondContact O-N 3.04Å; S171-N173 PolarHBondContact O-N 2.95Å; S171-I176 WeakPolarHBondContact OG-CD1 3.48Å
172	D	73.4	Confident	81	Confident	171 Å²	171	70 Å²	70	91%	0.914	41%	0.406	S	S	*	.	S	Bend	trans	-71.8	11.6	175.1	-76.2	-28.8	0	0	0	113.8	P174	D172-P174 VanDerWaalsContact O-CD 3.31Å; D172-P174 WeakPolarHBondContact O-CD 3.38Å
173	N	78.3	Confident	80.1	Confident	89 Å²	89	72.3 Å²	72.3	48%	0.476	42%	0.415	S	S	.	.			trans	-111	98.2	-176	-175.9	6.3	0	0	0	111.5	S171 A175 I176	S171-N173 PolarHBondContact O-N 2.95Å; N173-A175 PolarHBondContact O-N 3.43Å; N173-A175 VanDerWaalsContact OD1-CB 3.32Å; N173-A175 WeakPolarHBondContact OD1-CB 3.42Å; N173-A175 PolarHBondContact OD1-N 2.95Å; N173-A175 VanDerWaalsContact OD1-N 3.08Å; N173-I176 VanDerWaalsContact O-CB 3.26Å; N173-I176 WeakPolarHBondContact O-CB 3.29Å; N173-I176 WeakPolarHBondContact O-CG2 3.17Å; N173-I176 PolarHBondContact O-N 3.47Å
174	P	68.9	Low	79.6	Confident	83 Å²	83	69.3 Å²	69.3	54%	0.539	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-57	-26.6	177.7	-24.7	33.4	0	0	0	113.8	D172 I176	D172-P174 VanDerWaalsContact O-CD 3.31Å; D172-P174 WeakPolarHBondContact O-CD 3.38Å; P174-I176 PolarHBondContact O-N 2.74Å
175	A	76.1	Confident	79	Confident	47 Å²	47	71 Å²	71	39%	0.388	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-71.2	-9.8	179.2	0	0	0	0	0	113.1	N173 F177 T178 S179	N173-A175 PolarHBondContact O-N 3.43Å; N173-A175 VanDerWaalsContact OD1-CB 3.32Å; N173-A175 WeakPolarHBondContact OD1-CB 3.42Å; N173-A175 PolarHBondContact OD1-N 2.95Å; N173-A175 VanDerWaalsContact OD1-N 3.08Å; A175-F177 PolarHBondContact O-N 3.04Å; A175-T178 WeakPolarHBondContact CA-OG1 3.31Å; A175-T178 PolarHBondContact O-N 3.03Å; A175-T178 PolarHBondContact O-OG1 2.93Å; A175-S179 PolarHBondContact O-N 3.27Å; A175-S179 VanDerWaalsContact O-N 3.07Å
176	I	82.6	Confident	78.3	Confident	44 Å²	44	76.3 Å²	76.3	23%	0.226	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-59.6	-31.5	179.3	-159.3	163.7	0	0	0	112.5	R158 M168 S171 N173 P174	R158-I176 PolarHBondContact NH1-O 3.27Å; M168-I176 HydrophobicContact CB-CD1 4.27Å; M168-I176 HydrophobicContact CB-CG2 4.1Å; M168-I176 HydrophobicContact CE-CG1 4.28Å; M168-I176 HydrophobicContact CE-CG2 4.17Å; M168-I176 HydrophobicContact CG-CD1 3.86Å; M168-I176 HydrophobicContact CG-CG1 4.03Å; M168-I176 HydrophobicContact CG-CG2 4.42Å; S171-I176 WeakPolarHBondContact OG-CD1 3.48Å; N173-I176 VanDerWaalsContact O-CB 3.26Å; N173-I176 WeakPolarHBondContact O-CB 3.29Å; N173-I176 WeakPolarHBondContact O-CG2 3.17Å; N173-I176 PolarHBondContact O-N 3.47Å; P174-I176 PolarHBondContact O-N 2.74Å
177	F	80.1	Confident	77.7	Confident	7 Å²	7	74.9 Å²	74.9	3%	0.031	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-31.7	176.7	-61	-71.5	0	0	0	112	I149 L165 M168 L169 A175 I181 I194 H198	I149-F177 HydrophobicContact CG2-CD1 4.23Å; I149-F177 HydrophobicContact CG2-CE1 3.96Å; L165-F177 HydrophobicContact CD1-CE1 4.26Å; M168-F177 HydrophobicContact CB-CE1 4.01Å; M168-F177 HydrophobicContact CB-CZ 4.23Å; M168-F177 HydrophobicContact CE-CD1 3.5Å; M168-F177 HydrophobicContact CE-CE1 3.82Å; M168-F177 HydrophobicContact CE-CG 4.25Å; L169-F177 HydrophobicContact CD2-CZ 4.05Å; A175-F177 PolarHBondContact O-N 3.04Å; F177-I181 WeakPolarHBondContact O-CD1 3.33Å; F177-I194 HydrophobicContact CB-CG2 3.8Å; F177-I194 HydrophobicContact CD1-CG2 3.65Å; F177-I194 HydrophobicContact CD2-CG2 4.02Å; F177-I194 HydrophobicContact CE1-CG2 4.28Å; F177-I194 HydrophobicContact CG-CG2 3.53Å; F177-H198 HydrophobicContact CE2-CB 4.42Å; F177-H198 AromaticContact CE2-CG 3.94Å
178	T	74.6	Confident	77.5	Confident	63 Å²	63	76.3 Å²	76.3	39%	0.387	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-14.2	179.9	59.1	0	0	0	0	114.2	A175 G180 I181 M191	A175-T178 WeakPolarHBondContact CA-OG1 3.31Å; A175-T178 PolarHBondContact O-N 3.03Å; A175-T178 PolarHBondContact O-OG1 2.93Å; T178-G180 PolarHBondContact O-N 2.9Å; T178-I181 PolarHBondContact O-N 2.77Å; T178-M191 HydrophobicContact CG2-CG 4.13Å; T178-M191 HydrophobicContact CG2-SD 3.77Å
179	S	72	Confident	77.3	Confident	81 Å²	81	81.5 Å²	81.5	57%	0.566	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	121.2	-175.8	-169.5	0	0	0	0	111.6	R158 A175	R158-S179 PolarHBondContact NH1-O 3.44Å; A175-S179 PolarHBondContact O-N 3.27Å; A175-S179 VanDerWaalsContact O-N 3.07Å
180	G	68.3	Low	77.1	Confident	85 Å²	85	81 Å²	81	88%	0.876	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	6.6	176.5	0	0	0	0	0	115.8	T178	T178-G180 PolarHBondContact O-N 2.9Å
181	I	74.1	Confident	77	Confident	29 Å²	29	74.9 Å²	74.9	15%	0.149	43%	0.43	C	S	.	.			trans	-101.1	132.9	-179.7	-59.7	174.4	0	0	0	110.3	L153 T156 F177 T178 T187 M191	L153-I181 HydrophobicContact CD2-CD1 4.45Å; T156-I181 HydrophobicContact CG2-CD1 4.28Å; T156-I181 HydrophobicContact CG2-CG2 4.39Å; T156-I181 WeakPolarHBondContact OG1-CD1 3.36Å; F177-I181 WeakPolarHBondContact O-CD1 3.33Å; T178-I181 PolarHBondContact O-N 2.77Å; I181-T187 HydrophobicContact CG2-CG2 3.61Å; I181-M191 HydrophobicContact CD1-CE 3.39Å; I181-M191 HydrophobicContact CD1-SD 4.05Å
182	I	74.4	Confident	77.2	Confident	149 Å²	149	77.6 Å²	77.6	76%	0.764	44%	0.442	S	S	*	.			trans	-77.1	125.2	173.9	-60.6	174.9	0	0	0	108.7	D184 T187	I182-D184 PolarHBondContact O-N 2.89Å; I182-T187 WeakPolarHBondContact O-CG2 3.21Å; I182-T187 PolarHBondContact O-OG1 3.47Å
183	M	70.9	Confident	77.8	Confident	120 Å²	120	70 Å²	70	59%	0.591	40%	0.401	S	S	*	.			trans	-78.6	112.9	-177.3	-138.5	107.9	-175.4	0	0	110.9	T187 Q188	M183-T187 WeakPolarHBondContact CA-OG1 3.46Å; M183-Q188 HydrophobicContact CE-CG 3.95Å; M183-Q188 HydrophobicContact CG-CG 3.96Å
184	D	77.9	Confident	78.4	Confident	80 Å²	80	65.9 Å²	65.9	43%	0.428	38%	0.379	S	S	.	.			trans	-129.6	178.8	166.9	72.3	19	0	0	0	108.9	I182 I186 T187 Q188	I182-D184 PolarHBondContact O-N 2.89Å; D184-I186 PolarHBondContact O-N 3.08Å; D184-I186 WeakPolarHBondContact OD1-CA 3.4Å; D184-I186 WeakPolarHBondContact OD1-CB 3.33Å; D184-I186 PolarHBondContact OD1-N 2.84Å; D184-T187 PolarHBondContact N-OG1 3.46Å; D184-T187 PolarHBondContact O-N 3.17Å; D184-T187 PolarHBondContact O-OG1 2.91Å; D184-T187 PolarHBondContact OD1-N 3.23Å; D184-T187 PolarHBondContact OD1-OG1 3.42Å; D184-T187 VanDerWaalsContact OD1-OG1 3.07Å; D184-Q188 WeakPolarHBondContact O-CB 3.36Å; D184-Q188 WeakPolarHBondContact O-CG 3.41Å; D184-Q188 PolarHBondContact O-N 3.18Å
185	N	74.3	Confident	79.2	Confident	138 Å²	138	67.4 Å²	67.4	74%	0.738	38%	0.379	S	S	*	.	H	α-helix	trans	-64.2	-27.8	-178.4	-76.2	-27.9	0	0	0	113.1	Q189	N185-Q189 PolarHBondContact O-N 2.73Å
186	I	75.1	Confident	79.9	Confident	111 Å²	111	66.1 Å²	66.1	57%	0.569	37%	0.366	S	S	*	.	H	α-helix	trans	-78	-45.2	-179.3	-62	173.6	0	0	0	109.4	I155 D184 Q188 Q189 A190	I155-I186 HydrophobicContact CG2-CG2 4.18Å; D184-I186 PolarHBondContact O-N 3.08Å; D184-I186 WeakPolarHBondContact OD1-CA 3.4Å; D184-I186 WeakPolarHBondContact OD1-CB 3.33Å; D184-I186 PolarHBondContact OD1-N 2.84Å; I186-Q188 VanDerWaalsContact C-N 3.33Å; I186-Q188 PolarHBondContact O-N 2.72Å; I186-Q189 PolarHBondContact O-N 2.75Å; I186-A190 PolarHBondContact O-N 3.42Å
187	T	78.8	Confident	80.3	Confident	10 Å²	10	64 Å²	64	6%	0.061	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-33.5	176.1	50.2	0	0	0	0	111.6	T156 I181 I182 M183 D184 Q189 A190 M191	T156-T187 HydrophobicContact CG2-CG2 3.82Å; I181-T187 HydrophobicContact CG2-CG2 3.61Å; I182-T187 WeakPolarHBondContact O-CG2 3.21Å; I182-T187 PolarHBondContact O-OG1 3.47Å; M183-T187 WeakPolarHBondContact CA-OG1 3.46Å; D184-T187 PolarHBondContact N-OG1 3.46Å; D184-T187 PolarHBondContact O-N 3.17Å; D184-T187 PolarHBondContact O-OG1 2.91Å; D184-T187 PolarHBondContact OD1-N 3.23Å; D184-T187 PolarHBondContact OD1-OG1 3.42Å; D184-T187 VanDerWaalsContact OD1-OG1 3.07Å; T187-Q189 PolarHBondContact O-N 3.12Å; T187-A190 PolarHBondContact O-N 3.1Å; T187-M191 WeakPolarHBondContact O-CB 3.19Å; T187-M191 WeakPolarHBondContact O-CG 3.3Å; T187-M191 PolarHBondContact O-N 3.16Å
188	Q	82.3	Confident	80.7	Confident	104 Å²	104	64.4 Å²	64.4	49%	0.486	36%	0.357	S	S	.	.	H	α-helix	trans	-59.5	-43.9	171.9	-80.7	-173.2	-5.9	0	0	113.1	M183 D184 I186 M191 N192	M183-Q188 HydrophobicContact CE-CG 3.95Å; M183-Q188 HydrophobicContact CG-CG 3.96Å; D184-Q188 WeakPolarHBondContact O-CB 3.36Å; D184-Q188 WeakPolarHBondContact O-CG 3.41Å; D184-Q188 PolarHBondContact O-N 3.18Å; I186-Q188 VanDerWaalsContact C-N 3.33Å; I186-Q188 PolarHBondContact O-N 2.72Å; Q188-M191 PolarHBondContact O-N 3.25Å; Q188-N192 PolarHBondContact O-N 3.42Å; Q188-N192 VanDerWaalsContact O-N 3.1Å
189	Q	83.8	Confident	81.4	Confident	115 Å²	115	64.8 Å²	64.8	54%	0.537	36%	0.357	S	S	.	.	H	α-helix	trans	-65.8	-43.9	177.2	-176.2	178.2	-19.3	0	0	111.4	N185 I186 T187 M191 N192 E193	N185-Q189 PolarHBondContact O-N 2.73Å; I186-Q189 PolarHBondContact O-N 2.75Å; T187-Q189 PolarHBondContact O-N 3.12Å; Q189-M191 VanDerWaalsContact C-N 3.31Å; Q189-M191 PolarHBondContact O-N 3.45Å; Q189-N192 PolarHBondContact O-N 2.77Å; Q189-E193 PolarHBondContact O-N 2.73Å; Q189-E193 VanDerWaalsContact O-N 3.12Å
190	A	84.8	Confident	82.3	Confident	2 Å²	2	61.8 Å²	61.8	2%	0.017	33%	0.334	C	S	.	.	H	α-helix	trans	-60.1	-41	175.9	0	0	0	0	0	111.8	Q152 T156 I186 T187 E193 I194	Q152-A190 HydrophobicContact CB-CB 4.33Å; T156-A190 HydrophobicContact CG2-CB 3.64Å; I186-A190 PolarHBondContact O-N 3.42Å; T187-A190 PolarHBondContact O-N 3.1Å; A190-E193 PolarHBondContact O-N 3.33Å; A190-I194 VanDerWaalsContact O-CG1 3.26Å; A190-I194 WeakPolarHBondContact O-CG1 3.49Å; A190-I194 PolarHBondContact O-N 3.25Å
191	M	84.3	Confident	83.4	Confident	18 Å²	18	57.9 Å²	57.9	9%	0.089	29%	0.293	C	S	.	.	H	α-helix	trans	-64.8	-42.2	177.9	-71.6	-50.1	106.1	0	0	112.5	T156 T178 I181 T187 Q188 Q189 E193 I194 E195	T156-M191 HydrophobicContact CG2-CE 3.39Å; T178-M191 HydrophobicContact CG2-CG 4.13Å; T178-M191 HydrophobicContact CG2-SD 3.77Å; I181-M191 HydrophobicContact CD1-CE 3.39Å; I181-M191 HydrophobicContact CD1-SD 4.05Å; T187-M191 WeakPolarHBondContact O-CB 3.19Å; T187-M191 WeakPolarHBondContact O-CG 3.3Å; T187-M191 PolarHBondContact O-N 3.16Å; Q188-M191 PolarHBondContact O-N 3.25Å; Q189-M191 VanDerWaalsContact C-N 3.31Å; Q189-M191 PolarHBondContact O-N 3.45Å; M191-E193 VanDerWaalsContact C-N 3.34Å; M191-E193 PolarHBondContact O-N 3.41Å; M191-I194 HydrophobicContact CE-CD1 3.63Å; M191-I194 PolarHBondContact O-N 2.96Å; M191-I194 HydrophobicContact SD-CD1 4.29Å; M191-E195 PolarHBondContact O-N 2.96Å
192	N	85.8	Confident	84.2	Confident	83 Å²	83	59.6 Å²	59.6	44%	0.444	30%	0.301	S	S	.	.	H	α-helix	trans	-62.9	-41.8	177	-172.2	-31.6	0	0	0	111.4	Q188 Q189 E195 T196	Q188-N192 PolarHBondContact O-N 3.42Å; Q188-N192 VanDerWaalsContact O-N 3.1Å; Q189-N192 PolarHBondContact O-N 2.77Å; N192-E195 PolarHBondContact O-N 2.77Å; N192-T196 WeakPolarHBondContact O-CB 3.46Å; N192-T196 PolarHBondContact O-N 3.04Å; N192-T196 PolarHBondContact O-OG1 3.47Å
193	E	87.5	Confident	84.9	Confident	12 Å²	12	56.9 Å²	56.9	6%	0.056	28%	0.284	C	S	.	.	H	α-helix	trans	-63.9	-43.7	175.4	-169.7	176.4	146.3	0	0	111.3	Q152 Q189 A190 M191 E195 T196 R197	Q152-E193 HydrophobicContact CG-CB 4.32Å; Q152-E193 HydrophobicContact CG-CG 4.26Å; Q152-E193 PolarHBondContact NE2-OE1 3.24Å; Q152-E193 PolarHBondContact NE2-OE2 3.46Å; Q189-E193 PolarHBondContact O-N 2.73Å; Q189-E193 VanDerWaalsContact O-N 3.12Å; A190-E193 PolarHBondContact O-N 3.33Å; M191-E193 VanDerWaalsContact C-N 3.34Å; M191-E193 PolarHBondContact O-N 3.41Å; E193-E195 PolarHBondContact O-N 2.92Å; E193-T196 PolarHBondContact O-N 3.45Å; E193-R197 HydrophobicContact CG-CG 4.47Å; E193-R197 VanDerWaalsContact O-CG 3.29Å; E193-R197 WeakPolarHBondContact O-CG 3.24Å; E193-R197 PolarHBondContact O-N 3.49Å
194	I	89.3	Confident	85.8	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-58.3	-48.7	175.8	-70.9	166.5	0	0	0	111	I149 Q152 L153 F177 A190 M191 T196 R197 H198	I149-I194 HydrophobicContact CG1-CG2 4.44Å; I149-I194 HydrophobicContact CG2-CG1 4.22Å; I149-I194 HydrophobicContact CG2-CG2 3.99Å; Q152-I194 HydrophobicContact CB-CD1 3.73Å; Q152-I194 HydrophobicContact CB-CG1 3.54Å; Q152-I194 HydrophobicContact CG-CG1 4.28Å; L153-I194 HydrophobicContact CD2-CD1 3.89Å; L153-I194 HydrophobicContact CG-CD1 4.04Å; F177-I194 HydrophobicContact CB-CG2 3.8Å; F177-I194 HydrophobicContact CD1-CG2 3.65Å; F177-I194 HydrophobicContact CD2-CG2 4.02Å; F177-I194 HydrophobicContact CE1-CG2 4.28Å; F177-I194 HydrophobicContact CG-CG2 3.53Å; A190-I194 VanDerWaalsContact O-CG1 3.26Å; A190-I194 WeakPolarHBondContact O-CG1 3.49Å; A190-I194 PolarHBondContact O-N 3.25Å; M191-I194 HydrophobicContact CE-CD1 3.63Å; M191-I194 PolarHBondContact O-N 2.96Å; M191-I194 HydrophobicContact SD-CD1 4.29Å; I194-T196 VanDerWaalsContact C-N 3.33Å; I194-T196 PolarHBondContact O-N 3.36Å; I194-R197 PolarHBondContact O-N 3.44Å; I194-H198 VanDerWaalsContact O-CB 3.31Å; I194-H198 WeakPolarHBondContact O-CB 3.45Å; I194-H198 PolarHBondContact O-N 3.32Å
195	E	87.4	Confident	86.3	Confident	116 Å²	116	50.1 Å²	50.1	54%	0.542	25%	0.249	S	C	.	.	H	α-helix	trans	-60.5	-43.8	178.9	-176.4	178.6	-175.6	0	0	111.5	M191 N192 E193 R197 H198 N199	M191-E195 PolarHBondContact O-N 2.96Å; N192-E195 PolarHBondContact O-N 2.77Å; E193-E195 PolarHBondContact O-N 2.92Å; E195-R197 PolarHBondContact O-N 2.96Å; E195-H198 PolarHBondContact O-N 3.2Å; E195-N199 WeakPolarHBondContact O-CB 3.39Å; E195-N199 PolarHBondContact O-N 3.01Å; E195-N199 PolarHBondContact O-ND2 3.39Å; E195-N199 VanDerWaalsContact O-ND2 3.11Å
196	T	88.8	Confident	86.9	Confident	19 Å²	19	47.1 Å²	47.1	12%	0.117	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-47.1	176.3	-65.7	0	0	0	0	111.2	P67 N192 E193 I194 N199 E200	P67-T196 HydrophobicContact CG-CG2 4.15Å; N192-T196 WeakPolarHBondContact O-CB 3.46Å; N192-T196 PolarHBondContact O-N 3.04Å; N192-T196 PolarHBondContact O-OG1 3.47Å; E193-T196 PolarHBondContact O-N 3.45Å; I194-T196 VanDerWaalsContact C-N 3.33Å; I194-T196 PolarHBondContact O-N 3.36Å; T196-N199 PolarHBondContact O-N 2.99Å; T196-E200 WeakPolarHBondContact O-CG 3.38Å; T196-E200 PolarHBondContact O-N 3.06Å; T196-E200 VanDerWaalsContact O-N 3.13Å
197	R	90.9	Very high	87.4	Confident	1 Å²	1	42.4 Å²	42.4	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-70.4	-36.1	-179.9	-62.2	-60.4	152.6	-168.2	-0.6	112.9	I61 S64 C145 R148 I149 E193 I194 E195 E200 I201	I61-R197 PolarHBondContact O-NH1 3.39Å; I61-R197 PolarHBondContact O-NH2 3.49Å; S64-R197 PolarHBondContact O-NH2 3.4Å; C145-R197 HydrophobicContact CB-CB 4.45Å; R148-R197 HydrophobicContact CB-CG 4.29Å; I149-R197 HydrophobicContact CD1-CB 3.88Å; I149-R197 HydrophobicContact CG1-CB 3.68Å; E193-R197 HydrophobicContact CG-CG 4.47Å; E193-R197 VanDerWaalsContact O-CG 3.29Å; E193-R197 WeakPolarHBondContact O-CG 3.24Å; E193-R197 PolarHBondContact O-N 3.49Å; I194-R197 PolarHBondContact O-N 3.44Å; E195-R197 PolarHBondContact O-N 2.96Å; R197-E200 IonicContact CZ-OE1 3.75Å; R197-E200 IonicContact CZ-OE2 3.67Å; R197-E200 IonicContact NE-OE2 3.99Å; R197-E200 VanDerWaalsContact NH1-CD 3.33Å; R197-E200 IonicContact NH1-OE1 3.16Å; R197-E200 PolarHBondContact NH1-OE1 3.07Å; R197-E200 VanDerWaalsContact NH1-OE1 3.16Å; R197-E200 IonicContact NH1-OE2 2.73Å; R197-E200 PolarHBondContact NH1-OE2 3.08Å; R197-E200 WeakPolarHBondContact O-CB 3.31Å; R197-E200 PolarHBondContact O-N 3.48Å; R197-I201 WeakPolarHBondContact O-CG1 3.34Å; R197-I201 PolarHBondContact O-N 3.03Å
198	H	90.3	Very high	87.8	Confident	15 Å²	15	43.9 Å²	43.9	7%	0.069	22%	0.216	C	C	.	.	H	α-helix	trans	-62.8	-45.8	175.1	179.9	-127.9	0	0	0	111.1	I149 F177 I194 E195 E200 I201 I202	I149-H198 HydrophobicContact CD1-CB 4.41Å; F177-H198 HydrophobicContact CE2-CB 4.42Å; F177-H198 AromaticContact CE2-CG 3.94Å; I194-H198 VanDerWaalsContact O-CB 3.31Å; I194-H198 WeakPolarHBondContact O-CB 3.45Å; I194-H198 PolarHBondContact O-N 3.32Å; E195-H198 PolarHBondContact O-N 3.2Å; H198-E200 VanDerWaalsContact C-N 3.26Å; H198-E200 PolarHBondContact O-N 2.89Å; H198-I201 WeakPolarHBondContact O-CB 3.21Å; H198-I201 PolarHBondContact O-N 3.46Å; H198-I201 VanDerWaalsContact O-N 3.08Å; H198-I202 WeakPolarHBondContact O-CG1 3.32Å; H198-I202 PolarHBondContact O-N 3.45Å
199	N	89.1	Confident	87.9	Confident	70 Å²	70	46 Å²	46	37%	0.374	22%	0.22	S	C	.	.	H	α-helix	trans	-60.2	-36	174.8	-76.5	-39.8	0	0	0	112.6	E195 T196 I202 K203	E195-N199 WeakPolarHBondContact O-CB 3.39Å; E195-N199 PolarHBondContact O-N 3.01Å; E195-N199 PolarHBondContact O-ND2 3.39Å; E195-N199 VanDerWaalsContact O-ND2 3.11Å; T196-N199 PolarHBondContact O-N 2.99Å; N199-I202 PolarHBondContact O-N 2.93Å; N199-K203 WeakPolarHBondContact O-CG 3.3Å; N199-K203 PolarHBondContact O-N 3.3Å; N199-K203 VanDerWaalsContact O-N 3.14Å
200	E	89.4	Confident	87.7	Confident	18 Å²	18	44.8 Å²	44.8	8%	0.084	22%	0.215	C	C	.	.	H	α-helix	trans	-65.5	-41.1	173.3	-72	171.5	-167.8	0	0	112.3	I61 Y141 T196 R197 H198 I202 K203 L204	I61-E200 WeakPolarHBondContact CG2-OE1 3.5Å; Y141-E200 HydrophobicContact CE1-CB 4.28Å; Y141-E200 PolarHBondContact OH-OE2 3.17Å; T196-E200 WeakPolarHBondContact O-CG 3.38Å; T196-E200 PolarHBondContact O-N 3.06Å; T196-E200 VanDerWaalsContact O-N 3.13Å; R197-E200 IonicContact CZ-OE1 3.75Å; R197-E200 IonicContact CZ-OE2 3.67Å; R197-E200 IonicContact NE-OE2 3.99Å; R197-E200 VanDerWaalsContact NH1-CD 3.33Å; R197-E200 IonicContact NH1-OE1 3.16Å; R197-E200 PolarHBondContact NH1-OE1 3.07Å; R197-E200 VanDerWaalsContact NH1-OE1 3.16Å; R197-E200 IonicContact NH1-OE2 2.73Å; R197-E200 PolarHBondContact NH1-OE2 3.08Å; R197-E200 WeakPolarHBondContact O-CB 3.31Å; R197-E200 PolarHBondContact O-N 3.48Å; H198-E200 VanDerWaalsContact C-N 3.26Å; H198-E200 PolarHBondContact O-N 2.89Å; E200-I202 VanDerWaalsContact C-N 3.34Å; E200-I202 PolarHBondContact O-N 3.03Å; E200-K203 PolarHBondContact O-N 3.18Å; E200-L204 WeakPolarHBondContact O-CB 3.33Å; E200-L204 PolarHBondContact O-N 3.45Å
201	I	92.1	Very high	87.5	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.015	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-41.3	174.5	-69.2	169.2	0	0	0	111	R142 C145 I149 L169 R197 H198 K203 L204 E205	R142-I201 HydrophobicContact CG-CG1 4.44Å; R142-I201 HydrophobicContact CG-CG2 4.28Å; C145-I201 HydrophobicContact CB-CD1 3.84Å; C145-I201 HydrophobicContact CB-CG1 3.68Å; I149-I201 HydrophobicContact CD1-CD1 3.75Å; L169-I201 HydrophobicContact CD1-CD1 4.15Å; L169-I201 HydrophobicContact CD2-CD1 3.74Å; R197-I201 WeakPolarHBondContact O-CG1 3.34Å; R197-I201 PolarHBondContact O-N 3.03Å; H198-I201 WeakPolarHBondContact O-CB 3.21Å; H198-I201 PolarHBondContact O-N 3.46Å; H198-I201 VanDerWaalsContact O-N 3.08Å; I201-K203 PolarHBondContact O-N 2.97Å; I201-L204 VanDerWaalsContact O-CB 3.31Å; I201-L204 WeakPolarHBondContact O-CB 3.45Å; I201-L204 PolarHBondContact O-N 3.1Å; I201-E205 HydrophobicContact CG2-CG 4.29Å; I201-E205 WeakPolarHBondContact CG2-OE1 3.22Å; I201-E205 WeakPolarHBondContact O-CG 3.49Å; I201-E205 PolarHBondContact O-N 3.03Å
202	I	90.2	Very high	87.3	Confident	65 Å²	65	48.9 Å²	48.9	33%	0.333	23%	0.233	S	C	.	.	H	α-helix	trans	-62.4	-46.8	177.7	-66.5	167.8	0	0	0	111.1	H198 N199 E200 L204 E205 N206	H198-I202 WeakPolarHBondContact O-CG1 3.32Å; H198-I202 PolarHBondContact O-N 3.45Å; N199-I202 PolarHBondContact O-N 2.93Å; E200-I202 VanDerWaalsContact C-N 3.34Å; E200-I202 PolarHBondContact O-N 3.03Å; I202-L204 VanDerWaalsContact C-N 3.26Å; I202-L204 PolarHBondContact O-N 3.28Å; I202-E205 PolarHBondContact O-N 3.41Å; I202-N206 VanDerWaalsContact O-CG 3.3Å; I202-N206 PolarHBondContact O-N 3.4Å; I202-N206 PolarHBondContact O-ND2 3.35Å
203	K	89.2	Confident	86.8	Confident	93 Å²	93	50.1 Å²	50.1	40%	0.404	24%	0.24	S	C	.	.	H	α-helix	trans	-60.7	-40.1	178	-71.5	176.7	-174.3	-180	0	111.5	E76 N199 E200 I201 S207	E76-K203 WeakPolarHBondContact OE1-CE 3.12Å; E76-K203 IonicContact OE1-NZ 2.64Å; E76-K203 PolarHBondContact OE1-NZ 3.21Å; N199-K203 WeakPolarHBondContact O-CG 3.3Å; N199-K203 PolarHBondContact O-N 3.3Å; N199-K203 VanDerWaalsContact O-N 3.14Å; E200-K203 PolarHBondContact O-N 3.18Å; I201-K203 PolarHBondContact O-N 2.97Å; K203-S207 PolarHBondContact O-N 3.19Å
204	L	90.2	Very high	86.5	Confident	4 Å²	4	50 Å²	50	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-63.4	-49.9	177.5	177.1	63.7	0	0	0	112.9	Q138 Y141 R142 E200 I201 I202 N206 S207 I208	Q138-L204 HydrophobicContact CB-CD1 3.46Å; Q138-L204 VanDerWaalsContact CB-CD1 3.46Å; Q138-L204 HydrophobicContact CG-CD1 3.86Å; Q138-L204 WeakPolarHBondContact O-CD2 3.49Å; Y141-L204 HydrophobicContact CD1-CD2 4.11Å; R142-L204 HydrophobicContact CB-CD2 3.33Å; R142-L204 HydrophobicContact CB-CG 4.47Å; R142-L204 HydrophobicContact CG-CD2 3.86Å; E200-L204 WeakPolarHBondContact O-CB 3.33Å; E200-L204 PolarHBondContact O-N 3.45Å; I201-L204 VanDerWaalsContact O-CB 3.31Å; I201-L204 WeakPolarHBondContact O-CB 3.45Å; I201-L204 PolarHBondContact O-N 3.1Å; I202-L204 VanDerWaalsContact C-N 3.26Å; I202-L204 PolarHBondContact O-N 3.28Å; L204-N206 VanDerWaalsContact C-N 3.28Å; L204-N206 PolarHBondContact O-N 2.9Å; L204-S207 WeakPolarHBondContact O-CA 3.39Å; L204-S207 WeakPolarHBondContact O-CB 3.26Å; L204-S207 PolarHBondContact O-N 3.36Å; L204-I208 HydrophobicContact CD1-CD1 4.24Å; L204-I208 HydrophobicContact CG-CD1 4.08Å; L204-I208 WeakPolarHBondContact O-CG1 3.45Å; L204-I208 PolarHBondContact O-N 2.83Å
205	E	88.7	Confident	85.9	Confident	54 Å²	54	52.5 Å²	52.5	25%	0.252	25%	0.25	S	S	.	.	H	α-helix	trans	-62.6	-37.3	178.3	-74.2	178.4	176.9	0	0	112	R142 I201 I202 S207 I208 R209	R142-E205 IonicContact CZ-OE1 3.29Å; R142-E205 VanDerWaalsContact CZ-OE1 3.29Å; R142-E205 IonicContact NE-OE1 2.92Å; R142-E205 PolarHBondContact NE-OE1 3.43Å; R142-E205 IonicContact NH2-OE1 2.76Å; R142-E205 PolarHBondContact NH2-OE1 3.5Å; I201-E205 HydrophobicContact CG2-CG 4.29Å; I201-E205 WeakPolarHBondContact CG2-OE1 3.22Å; I201-E205 WeakPolarHBondContact O-CG 3.49Å; I201-E205 PolarHBondContact O-N 3.03Å; I202-E205 PolarHBondContact O-N 3.41Å; E205-S207 VanDerWaalsContact C-N 3.34Å; E205-I208 PolarHBondContact O-N 3.3Å; E205-R209 VanDerWaalsContact O-CB 3.32Å; E205-R209 WeakPolarHBondContact O-CB 3.38Å; E205-R209 PolarHBondContact O-N 3.08Å
206	N	87.8	Confident	85.4	Confident	74 Å²	74	51.6 Å²	51.6	40%	0.396	25%	0.247	S	C	.	.	H	α-helix	trans	-61.5	-43.7	171.5	-70.9	-25	0	0	0	111.4	I202 L204 R209 E210	I202-N206 VanDerWaalsContact O-CG 3.3Å; I202-N206 PolarHBondContact O-N 3.4Å; I202-N206 PolarHBondContact O-ND2 3.35Å; L204-N206 VanDerWaalsContact C-N 3.28Å; L204-N206 PolarHBondContact O-N 2.9Å; N206-R209 PolarHBondContact O-N 3.18Å; N206-R209 PolarHBondContact OD1-NH1 2.95Å; N206-E210 WeakPolarHBondContact O-CG 3.37Å; N206-E210 PolarHBondContact O-N 3.34Å; N206-E210 VanDerWaalsContact O-N 3.09Å
207	S	85.9	Confident	84.7	Confident	12 Å²	12	53.1 Å²	53.1	8%	0.084	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-45.9	175.7	-171.9	0	0	0	0	112.2	Y134 K203 L204 E205 R209 E210 L211	Y134-S207 PolarHBondContact OH-OG 2.58Å; K203-S207 PolarHBondContact O-N 3.19Å; L204-S207 WeakPolarHBondContact O-CA 3.39Å; L204-S207 WeakPolarHBondContact O-CB 3.26Å; L204-S207 PolarHBondContact O-N 3.36Å; E205-S207 VanDerWaalsContact C-N 3.34Å; S207-R209 VanDerWaalsContact C-N 3.33Å; S207-R209 PolarHBondContact O-N 3.25Å; S207-E210 WeakPolarHBondContact O-CB 3.06Å; S207-E210 PolarHBondContact O-N 2.94Å; S207-L211 WeakPolarHBondContact O-CG 3.36Å; S207-L211 PolarHBondContact O-N 3.48Å
208	I	85.8	Confident	83.9	Confident	41 Å²	41	53.2 Å²	53.2	21%	0.21	26%	0.255	C	S	.	.	H	α-helix	trans	-61.9	-40.6	177.9	-66.1	169	0	0	0	110.9	Q138 L204 E205 E210 L211 H212	Q138-I208 HydrophobicContact CB-CD1 4.03Å; Q138-I208 HydrophobicContact CB-CG1 3.94Å; L204-I208 HydrophobicContact CD1-CD1 4.24Å; L204-I208 HydrophobicContact CG-CD1 4.08Å; L204-I208 WeakPolarHBondContact O-CG1 3.45Å; L204-I208 PolarHBondContact O-N 2.83Å; E205-I208 PolarHBondContact O-N 3.3Å; I208-E210 VanDerWaalsContact C-N 3.3Å; I208-E210 PolarHBondContact O-N 3.5Å; I208-L211 WeakPolarHBondContact O-CB 3.37Å; I208-L211 PolarHBondContact O-N 3.15Å; I208-L211 VanDerWaalsContact O-N 3.11Å; I208-H212 PolarHBondContact O-N 3.47Å
209	R	85.8	Confident	83	Confident	148 Å²	148	55.1 Å²	55.1	56%	0.558	27%	0.273	S	S	*	.	H	α-helix	trans	-61.7	-39.3	176.4	-169.4	-179.5	-62.7	104.2	0.1	111.8	E205 N206 S207 L211 H212	E205-R209 VanDerWaalsContact O-CB 3.32Å; E205-R209 WeakPolarHBondContact O-CB 3.38Å; E205-R209 PolarHBondContact O-N 3.08Å; N206-R209 PolarHBondContact O-N 3.18Å; N206-R209 PolarHBondContact OD1-NH1 2.95Å; S207-R209 VanDerWaalsContact C-N 3.33Å; S207-R209 PolarHBondContact O-N 3.25Å; R209-L211 VanDerWaalsContact C-N 3.33Å; R209-H212 WeakPolarHBondContact O-CB 3.45Å; R209-H212 PolarHBondContact O-N 2.93Å
210	E	78.8	Confident	82	Confident	91 Å²	91	57.1 Å²	57.1	43%	0.425	28%	0.282	S	S	.	.	H	α-helix	trans	-69.2	-30.4	174.7	-67.7	179.1	161.6	0	0	112.9	K83 N206 S207 I208	K83-E210 VanDerWaalsContact CD-OE2 3.3Å; K83-E210 WeakPolarHBondContact CD-OE2 3.34Å; K83-E210 WeakPolarHBondContact CE-OE2 3.42Å; K83-E210 IonicContact NZ-OE1 3.72Å; K83-E210 PolarHBondContact NZ-OE1 3.37Å; K83-E210 IonicContact NZ-OE2 2.63Å; K83-E210 PolarHBondContact NZ-OE2 3.3Å; N206-E210 WeakPolarHBondContact O-CG 3.37Å; N206-E210 PolarHBondContact O-N 3.34Å; N206-E210 VanDerWaalsContact O-N 3.09Å; S207-E210 WeakPolarHBondContact O-CB 3.06Å; S207-E210 PolarHBondContact O-N 2.94Å; I208-E210 VanDerWaalsContact C-N 3.3Å; I208-E210 PolarHBondContact O-N 3.5Å
211	L	81.4	Confident	81	Confident	8 Å²	8	57.5 Å²	57.5	4%	0.042	28%	0.284	C	S	.	.	H	α-helix	trans	-68.9	-34.7	172.4	-65.3	-179.1	0	0	0	112.5	M131 Y134 N135 S207 I208 R209 D213 M214 F215	M131-L211 HydrophobicContact CE-CD2 3.21Å; M131-L211 HydrophobicContact CE-CG 4.43Å; Y134-L211 HydrophobicContact CD1-CD1 3.38Å; Y134-L211 HydrophobicContact CD1-CD2 3.86Å; Y134-L211 HydrophobicContact CD1-CG 4.16Å; Y134-L211 HydrophobicContact CE1-CD1 3.5Å; Y134-L211 VanDerWaalsContact CE1-CD1 3.5Å; Y134-L211 HydrophobicContact CE1-CD2 3.79Å; Y134-L211 HydrophobicContact CE1-CG 4Å; N135-L211 HydrophobicContact CB-CD1 4.45Å; S207-L211 WeakPolarHBondContact O-CG 3.36Å; S207-L211 PolarHBondContact O-N 3.48Å; I208-L211 WeakPolarHBondContact O-CB 3.37Å; I208-L211 PolarHBondContact O-N 3.15Å; I208-L211 VanDerWaalsContact O-N 3.11Å; R209-L211 VanDerWaalsContact C-N 3.33Å; L211-D213 VanDerWaalsContact C-N 3.29Å; L211-D213 PolarHBondContact O-N 2.95Å; L211-M214 CarbonylContact O-C 3.58Å; L211-M214 WeakPolarHBondContact O-CA 3.46Å; L211-M214 VanDerWaalsContact O-CB 3.29Å; L211-M214 WeakPolarHBondContact O-CB 3.25Å; L211-M214 PolarHBondContact O-N 3.02Å; L211-F215 HydrophobicContact CB-CD2 4.07Å; L211-F215 HydrophobicContact CB-CE2 3.95Å; L211-F215 HydrophobicContact CD1-CE2 4.39Å; L211-F215 WeakPolarHBondContact O-CD2 3.07Å; L211-F215 PolarHBondContact O-N 2.85Å
212	H	78.3	Confident	79.9	Confident	98 Å²	98	60 Å²	60	45%	0.454	30%	0.299	S	S	.	.	H	α-helix	trans	-55.3	-44.7	-177	178.6	-84.1	0	0	0	112	I208 R209 M214 F215 M216	I208-H212 PolarHBondContact O-N 3.47Å; R209-H212 WeakPolarHBondContact O-CB 3.45Å; R209-H212 PolarHBondContact O-N 2.93Å; H212-M214 PolarHBondContact O-N 3.25Å; H212-F215 PolarHBondContact O-N 3.44Å; H212-M216 WeakPolarHBondContact NE2-CE 3.33Å; H212-M216 WeakPolarHBondContact O-CG 2.97Å; H212-M216 PolarHBondContact O-N 3.47Å
213	D	76.7	Confident	78.7	Confident	108 Å²	108	64.4 Å²	64.4	58%	0.578	32%	0.318	S	S	*	.	H	α-helix	trans	-59.7	-37.1	176.5	-69.6	-10.2	0	0	0	111.9	L211 D217	L211-D213 VanDerWaalsContact C-N 3.29Å; L211-D213 PolarHBondContact O-N 2.95Å; D213-D217 PolarHBondContact O-N 3.34Å
214	M	80	Confident	77.1	Confident	11 Å²	11	64 Å²	64	5%	0.054	33%	0.327	C	S	.	.	H	α-helix	trans	-72.1	-38.4	177.5	-166.3	-175.8	-54.5	0	0	112.3	A86 F127 M131 L211 H212 D217 M218	A86-M214 HydrophobicContact CB-CE 3.56Å; A86-M214 HydrophobicContact CB-SD 3.61Å; F127-M214 HydrophobicContact CE1-SD 4.26Å; F127-M214 HydrophobicContact CZ-CG 4.48Å; F127-M214 HydrophobicContact CZ-SD 3.63Å; M131-M214 HydrophobicContact CE-SD 3.83Å; M131-M214 HydrophobicContact CG-SD 4.45Å; M131-M214 HydrophobicContact SD-SD 4.32Å; L211-M214 CarbonylContact O-C 3.58Å; L211-M214 WeakPolarHBondContact O-CA 3.46Å; L211-M214 VanDerWaalsContact O-CB 3.29Å; L211-M214 WeakPolarHBondContact O-CB 3.25Å; L211-M214 PolarHBondContact O-N 3.02Å; H212-M214 PolarHBondContact O-N 3.25Å; M214-D217 PolarHBondContact O-N 3.15Å; M214-M218 WeakPolarHBondContact O-CB 3.47Å; M214-M218 WeakPolarHBondContact O-CG 3.47Å; M214-M218 PolarHBondContact O-N 2.58Å
215	F	76.9	Confident	75.4	Confident	53 Å²	53	65.2 Å²	65.2	23%	0.232	33%	0.333	C	S	.	.	H	α-helix	trans	-66.2	-38.3	175.9	-80.6	-60.8	0	0	0	112.4	M131 N135 L211 H212 M218 A219	M131-F215 HydrophobicContact CB-CE1 3.92Å; M131-F215 HydrophobicContact CB-CZ 4Å; M131-F215 WeakPolarHBondContact O-CZ 3.26Å; N135-F215 HydrophobicContact CB-CE2 3.9Å; N135-F215 HydrophobicContact CB-CZ 3.9Å; L211-F215 HydrophobicContact CB-CD2 4.07Å; L211-F215 HydrophobicContact CB-CE2 3.95Å; L211-F215 HydrophobicContact CD1-CE2 4.39Å; L211-F215 WeakPolarHBondContact O-CD2 3.07Å; L211-F215 PolarHBondContact O-N 2.85Å; H212-F215 PolarHBondContact O-N 3.44Å; F215-M218 PolarHBondContact O-N 3.49Å; F215-A219 VanDerWaalsContact O-CB 3.28Å; F215-A219 WeakPolarHBondContact O-CB 3.4Å; F215-A219 PolarHBondContact O-N 3.08Å
216	M	78	Confident	73.8	Confident	98 Å²	98	64.7 Å²	64.7	48%	0.483	34%	0.342	S	S	.	.	H	α-helix	trans	-63.8	-45	176.3	-69.6	-60.6	157	0	0	111.5	H212 M218 M220	H212-M216 WeakPolarHBondContact NE2-CE 3.33Å; H212-M216 WeakPolarHBondContact O-CG 2.97Å; H212-M216 PolarHBondContact O-N 3.47Å; M216-M218 VanDerWaalsContact C-N 3.34Å; M216-M218 PolarHBondContact O-N 3.21Å; M216-M220 PolarHBondContact O-N 3.44Å
217	D	73.5	Confident	71.9	Confident	50 Å²	50	70.4 Å²	70.4	27%	0.267	37%	0.366	S	S	.	.	H	α-helix	trans	-59.6	-44	173.1	-87.5	-10	0	0	0	111.8	R90 D213 M214 L221	R90-D217 IonicContact CZ-OD2 3.94Å; R90-D217 IonicContact NH1-OD2 3.51Å; R90-D217 PolarHBondContact NH1-OD2 3.46Å; D213-D217 PolarHBondContact O-N 3.34Å; M214-D217 PolarHBondContact O-N 3.15Å; D217-L221 WeakPolarHBondContact O-CG 3.33Å; D217-L221 PolarHBondContact O-N 2.73Å
218	M	73.9	Confident	70.1	Confident	4 Å²	4	75.1 Å²	75.1	2%	0.02	39%	0.389	C	S	.	.	H	α-helix	trans	-73.7	-33.8	-177	-74.2	-50.7	-39.2	0	0	113.6	F127 V128 M214 F215 M216 M220 L221 V222	F127-M218 HydrophobicContact CD1-CE 4.37Å; F127-M218 HydrophobicContact CD1-CG 4.12Å; F127-M218 HydrophobicContact CD1-SD 3.8Å; F127-M218 HydrophobicContact CE1-CG 3.91Å; F127-M218 HydrophobicContact CE1-SD 3.83Å; V128-M218 HydrophobicContact CG2-CB 3.78Å; V128-M218 HydrophobicContact CG2-CE 3.97Å; V128-M218 HydrophobicContact CG2-CG 4.18Å; M214-M218 WeakPolarHBondContact O-CB 3.47Å; M214-M218 WeakPolarHBondContact O-CG 3.47Å; M214-M218 PolarHBondContact O-N 2.58Å; F215-M218 PolarHBondContact O-N 3.49Å; M216-M218 VanDerWaalsContact C-N 3.34Å; M216-M218 PolarHBondContact O-N 3.21Å; M218-M220 VanDerWaalsContact C-N 3.33Å; M218-L221 HydrophobicContact CE-CB 3.84Å; M218-L221 HydrophobicContact CE-CD1 3.83Å; M218-L221 PolarHBondContact O-N 3.03Å; M218-L221 HydrophobicContact SD-CD1 3.58Å; M218-L221 VanDerWaalsContact SD-CD1 3.58Å; M218-V222 HydrophobicContact CE-CG2 4.35Å; M218-V222 WeakPolarHBondContact O-CG2 3.19Å; M218-V222 PolarHBondContact O-N 3.47Å
219	A	71.3	Confident	68.4	Low	54 Å²	54	74.9 Å²	74.9	45%	0.446	39%	0.387	S	S	.	.	H	α-helix	trans	-60.6	-45.6	174.1	0	0	0	0	0	110.3	F215 L221 V222 E223	F215-A219 VanDerWaalsContact O-CB 3.28Å; F215-A219 WeakPolarHBondContact O-CB 3.4Å; F215-A219 PolarHBondContact O-N 3.08Å; A219-L221 PolarHBondContact O-N 3.33Å; A219-V222 PolarHBondContact O-N 3.38Å; A219-E223 WeakPolarHBondContact O-CB 3.36Å; A219-E223 PolarHBondContact O-N 2.91Å
220	M	69.1	Low	66.7	Low	113 Å²	113	75.2 Å²	75.2	56%	0.557	40%	0.4	S	S	*	.	H	α-helix	trans	-62.2	-41.9	173.7	-68.7	-173.2	-70	0	0	112.2	M216 M218 S224	M216-M220 PolarHBondContact O-N 3.44Å; M218-M220 VanDerWaalsContact C-N 3.33Å; M220-S224 VanDerWaalsContact O-CB 3.32Å; M220-S224 WeakPolarHBondContact O-CB 3.32Å; M220-S224 PolarHBondContact O-N 3.23Å; M220-S224 PolarHBondContact O-OG 2.75Å
221	L	67.9	Low	65.2	Low	26 Å²	26	78.7 Å²	78.7	14%	0.136	41%	0.409	C	S	.	.	H	α-helix	trans	-63.9	-40.1	177.6	-77.5	168.7	0	0	0	112.1	Q97 D217 M218 A219 S224 Q225	Q97-L221 HydrophobicContact CG-CD2 4.09Å; D217-L221 WeakPolarHBondContact O-CG 3.33Å; D217-L221 PolarHBondContact O-N 2.73Å; M218-L221 HydrophobicContact CE-CB 3.84Å; M218-L221 HydrophobicContact CE-CD1 3.83Å; M218-L221 PolarHBondContact O-N 3.03Å; M218-L221 HydrophobicContact SD-CD1 3.58Å; M218-L221 VanDerWaalsContact SD-CD1 3.58Å; A219-L221 PolarHBondContact O-N 3.33Å; L221-S224 PolarHBondContact O-OG 2.88Å; L221-Q225 VanDerWaalsContact O-CG 3.24Å; L221-Q225 WeakPolarHBondContact O-CG 3.42Å; L221-Q225 PolarHBondContact O-NE2 3.17Å
222	V	68.9	Low	63.7	Low	54 Å²	54	85.5 Å²	85.5	33%	0.327	44%	0.444	S	S	.	.	H	α-helix	trans	-77.6	-38.7	179.9	175.4	0	0	0	0	111.8	V128 M218 A219 Q225	V128-V222 HydrophobicContact CG2-CG2 4.11Å; M218-V222 HydrophobicContact CE-CG2 4.35Å; M218-V222 WeakPolarHBondContact O-CG2 3.19Å; M218-V222 PolarHBondContact O-N 3.47Å; A219-V222 PolarHBondContact O-N 3.38Å; V222-Q225 PolarHBondContact O-N 3.14Å
223	E	63.8	Low	62.1	Low	158 Å²	158	87.7 Å²	87.7	74%	0.738	45%	0.454	S	S	*	.	H	α-helix	trans	-65.2	-44.1	179.3	-175.6	175	-164.7	0	0	112.2	A219 Q225 G226	A219-E223 WeakPolarHBondContact O-CB 3.36Å; A219-E223 PolarHBondContact O-N 2.91Å; E223-Q225 PolarHBondContact O-N 3.14Å; E223-Q225 VanDerWaalsContact O-N 3.16Å; E223-G226 PolarHBondContact O-N 3.12Å
224	S	57.3	Low	60.9	Low	85 Å²	85	86.8 Å²	86.8	59%	0.594	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.2	177.9	56.9	0	0	0	0	114.2	M220 L221	M220-S224 VanDerWaalsContact O-CB 3.32Å; M220-S224 WeakPolarHBondContact O-CB 3.32Å; M220-S224 PolarHBondContact O-N 3.23Å; M220-S224 PolarHBondContact O-OG 2.75Å; L221-S224 PolarHBondContact O-OG 2.88Å
225	Q	54.6	Low	59.5	Low	30 Å²	30	88.6 Å²	88.6	14%	0.14	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-18.6	179.6	-72.6	177.7	70.9	0	0	113.6	H120 S121 L221 V222 E223	H120-Q225 PolarHBondContact CE1-NE2 3.37Å; H120-Q225 PolarHBondContact ND1-NE2 3.07Å; H120-Q225 PolarHBondContact ND1-OE1 2.97Å; S121-Q225 PolarHBondContact OG-OE1 3.38Å; S121-Q225 VanDerWaalsContact OG-OE1 3.07Å; L221-Q225 VanDerWaalsContact O-CG 3.24Å; L221-Q225 WeakPolarHBondContact O-CG 3.42Å; L221-Q225 PolarHBondContact O-NE2 3.17Å; V222-Q225 PolarHBondContact O-N 3.14Å; E223-Q225 PolarHBondContact O-N 3.14Å; E223-Q225 VanDerWaalsContact O-N 3.16Å
226	G	53.3	Low	58.5	Low	43 Å²	43	90.5 Å²	90.5	44%	0.443	47%	0.469	S	S	.	.			trans	60.4	169.8	176.7	0	0	0	0	0	116	E223 M228	E223-G226 PolarHBondContact O-N 3.12Å; G226-M228 PolarHBondContact O-N 3.4Å
227	E	48.7	Very low	57.1	Low	193 Å²	193	91 Å²	91	90%	0.902	47%	0.474	S	S	*	.	S	Bend	trans	-63	7.2	174.8	-81.1	-173	148.6	0	0	114.6	I229	E227-I229 PolarHBondContact O-N 3.2Å; E227-I229 VanDerWaalsContact O-N 3.14Å
228	M	48.1	Very low	55.9	Low	112 Å²	112	92 Å²	92	55%	0.552	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	16.7	-166.7	-142.9	-169.2	-61.2	0	0	114.2	G226 Y234	G226-M228 PolarHBondContact O-N 3.4Å; M228-Y234 HydrophobicContact CG-CD1 3.77Å; M228-Y234 HydrophobicContact CG-CE1 3.43Å; M228-Y234 VanDerWaalsContact CG-CE1 3.43Å; M228-Y234 HydrophobicContact CG-CE2 4.47Å; M228-Y234 HydrophobicContact CG-CG 4.43Å; M228-Y234 HydrophobicContact SD-CD1 4.16Å; M228-Y234 HydrophobicContact SD-CE1 3.21Å; M228-Y234 WeakPolarHBondContact SD-CE1 3.49Å; M228-Y234 HydrophobicContact SD-CE2 4.47Å; M228-Y234 PolarHBondContact SD-OH 3.46Å
229	I	50.8	Low	54.9	Low	35 Å²	35	94 Å²	94	18%	0.179	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-14.4	-176.6	-65.5	-179.8	0	0	0	112.6	T118 S121 R125 E227	T118-I229 HydrophobicContact CG2-CG2 4.48Å; S121-I229 VanDerWaalsContact OG-CD1 3.22Å; S121-I229 WeakPolarHBondContact OG-CD1 3.44Å; R125-I229 VanDerWaalsContact NH2-CG2 3.35Å; E227-I229 PolarHBondContact O-N 3.2Å; E227-I229 VanDerWaalsContact O-N 3.14Å
230	D	49.5	Very low	54.1	Low	155 Å²	155	95.3 Å²	95.3	83%	0.829	49%	0.493	S	S	*	.	S	Bend	trans	-91.2	2.2	-177.8	-140	20.2	0	0	0	114.3
231	R	48.4	Very low	53.2	Low	165 Å²	165	94.4 Å²	94.4	62%	0.623	49%	0.491	S	S	*	.			trans	-103.3	96	171.8	-70.4	-169.8	-172.1	-152	5.4	110.2	E233 Y234 N235	R231-E233 HydrophobicContact CB-CB 4.36Å; R231-E233 PolarHBondContact O-N 3Å; R231-Y234 PolarHBondContact O-N 3.12Å; R231-N235 PolarHBondContact O-N 3.45Å
232	I	49	Very low	52.5	Low	150 Å²	150	98.6 Å²	98.6	77%	0.769	51%	0.506	S	S	*	.	H	α-helix	trans	-44.1	-33.8	156.5	-65.3	172.6	0	0	0	110	V236	I232-V236 VanDerWaalsContact O-CG2 3.24Å; I232-V236 WeakPolarHBondContact O-CG2 3.47Å; I232-V236 PolarHBondContact O-N 3.35Å
233	E	43.6	Very low	52.1	Low	144 Å²	144	100.6 Å²	100.6	67%	0.673	52%	0.518	S	S	*	.	H	α-helix	trans	-66.3	-37.8	176.4	-150.4	171.6	-149.5	0	0	114.2	R231 V236 D237	R231-E233 HydrophobicContact CB-CB 4.36Å; R231-E233 PolarHBondContact O-N 3Å; E233-V236 PolarHBondContact O-N 3.11Å; E233-D237 PolarHBondContact O-N 2.97Å; E233-D237 VanDerWaalsContact O-N 3.1Å
234	Y	52.2	Low	51.6	Low	89 Å²	89	99.4 Å²	99.4	35%	0.349	51%	0.512	S	S	.	.	H	α-helix	trans	-75.3	-36.5	-177.2	-174.7	-95.6	0	0	0	112.7	M228 R231 V236 D237 H238	M228-Y234 HydrophobicContact CG-CD1 3.77Å; M228-Y234 HydrophobicContact CG-CE1 3.43Å; M228-Y234 VanDerWaalsContact CG-CE1 3.43Å; M228-Y234 HydrophobicContact CG-CE2 4.47Å; M228-Y234 HydrophobicContact CG-CG 4.43Å; M228-Y234 HydrophobicContact SD-CD1 4.16Å; M228-Y234 HydrophobicContact SD-CE1 3.21Å; M228-Y234 WeakPolarHBondContact SD-CE1 3.49Å; M228-Y234 HydrophobicContact SD-CE2 4.47Å; M228-Y234 PolarHBondContact SD-OH 3.46Å; R231-Y234 PolarHBondContact O-N 3.12Å; Y234-V236 VanDerWaalsContact C-N 3.32Å; Y234-D237 PolarHBondContact O-N 3.49Å; Y234-H238 AromaticContact CD1-CD2 3.99Å; Y234-H238 AromaticContact CE1-CD2 3.51Å; Y234-H238 AromaticContact CE1-NE2 3.58Å; Y234-H238 AromaticContact CE2-NE2 3.66Å; Y234-H238 AromaticContact CZ-CD2 3.62Å; Y234-H238 AromaticContact CZ-NE2 3.17Å; Y234-H238 PolarHBondContact O-CD2 3.2Å; Y234-H238 PolarHBondContact O-N 3.35Å; Y234-H238 PolarHBondContact OH-NE2 3.5Å; Y234-H238 VanDerWaalsContact OH-NE2 3.1Å
235	N	50.7	Low	51.5	Low	50 Å²	50	103.5 Å²	103.5	27%	0.267	51%	0.514	S	S	.	.	H	α-helix	trans	-71.4	-27.3	174.8	-99	-6.4	0	0	0	112.7	R114 T118 R231 S239	R114-N235 WeakPolarHBondContact CD-OD1 3.36Å; T118-N235 PolarHBondContact OG1-ND2 2.91Å; R231-N235 PolarHBondContact O-N 3.45Å; N235-S239 PolarHBondContact O-OG 3.22Å
236	V	55.3	Low	51.7	Low	92 Å²	92	104.8 Å²	104.8	56%	0.558	53%	0.53	S	S	*	.	H	α-helix	trans	-75.1	-39.1	174.1	171.8	0	0	0	0	111	I232 E233 Y234 H238 S239	I232-V236 VanDerWaalsContact O-CG2 3.24Å; I232-V236 WeakPolarHBondContact O-CG2 3.47Å; I232-V236 PolarHBondContact O-N 3.35Å; E233-V236 PolarHBondContact O-N 3.11Å; Y234-V236 VanDerWaalsContact C-N 3.32Å; V236-H238 PolarHBondContact O-N 3.25Å; V236-S239 WeakPolarHBondContact O-CB 3.09Å; V236-S239 PolarHBondContact O-N 3.09Å
237	D	49.2	Very low	52.2	Low	109 Å²	109	105.7 Å²	105.7	58%	0.583	53%	0.527	S	S	*	.	H	α-helix	trans	-60.1	-44.2	179.2	-159	39	0	0	0	112.2	E233 Y234 S239 V240	E233-D237 PolarHBondContact O-N 2.97Å; E233-D237 VanDerWaalsContact O-N 3.1Å; Y234-D237 PolarHBondContact O-N 3.49Å; D237-S239 PolarHBondContact O-N 2.97Å; D237-S239 VanDerWaalsContact O-N 3.17Å; D237-V240 WeakPolarHBondContact O-CB 3.17Å; D237-V240 WeakPolarHBondContact O-CG2 3.48Å; D237-V240 PolarHBondContact O-N 3.19Å
238	H	49.3	Very low	53.1	Low	72 Å²	72	99 Å²	99	33%	0.333	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-2.5	174.9	-74.9	-60.3	0	0	0	115.3	R114 Y234 V236	R114-H238 PolarHBondContact NH1-O 3.03Å; R114-H238 VanDerWaalsContact NH1-O 3.1Å; Y234-H238 AromaticContact CD1-CD2 3.99Å; Y234-H238 AromaticContact CE1-CD2 3.51Å; Y234-H238 AromaticContact CE1-NE2 3.58Å; Y234-H238 AromaticContact CE2-NE2 3.66Å; Y234-H238 AromaticContact CZ-CD2 3.62Å; Y234-H238 AromaticContact CZ-NE2 3.17Å; Y234-H238 PolarHBondContact O-CD2 3.2Å; Y234-H238 PolarHBondContact O-N 3.35Å; Y234-H238 PolarHBondContact OH-NE2 3.5Å; Y234-H238 VanDerWaalsContact OH-NE2 3.1Å; V236-H238 PolarHBondContact O-N 3.25Å
239	S	52.8	Low	54.2	Low	44 Å²	44	97.9 Å²	97.9	31%	0.308	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-16.1	173.5	-60.5	0	0	0	0	112.3	R114 N235 V236 D237	R114-S239 PolarHBondContact NH2-OG 3.48Å; N235-S239 PolarHBondContact O-OG 3.22Å; V236-S239 WeakPolarHBondContact O-CB 3.09Å; V236-S239 PolarHBondContact O-N 3.09Å; D237-S239 PolarHBondContact O-N 2.97Å; D237-S239 VanDerWaalsContact O-N 3.17Å
240	V	53	Low	55.1	Low	82 Å²	82	100.2 Å²	100.2	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-66.9	-37.5	-178.9	-179.7	0	0	0	0	111.9	D237 Y242 V243 E244	D237-V240 WeakPolarHBondContact O-CB 3.17Å; D237-V240 WeakPolarHBondContact O-CG2 3.48Å; D237-V240 PolarHBondContact O-N 3.19Å; V240-Y242 VanDerWaalsContact C-N 3.27Å; V240-Y242 PolarHBondContact O-N 3.22Å; V240-V243 PolarHBondContact O-N 3.06Å; V240-E244 PolarHBondContact O-N 3.43Å
241	D	50.3	Low	56	Low	95 Å²	95	99.4 Å²	99.4	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-59.5	-31.5	-179.1	-94.8	16.8	0	0	0	114.2	R245	D241-R245 PolarHBondContact O-N 3.33Å
242	Y	53.8	Low	57.3	Low	114 Å²	114	96.3 Å²	96.3	45%	0.447	49%	0.494	S	S	.	.	H	α-helix	trans	-76.1	-36.6	-179.9	-85.8	-86	0	0	0	112.8	S109 V240 E244 A246	S109-Y242 WeakPolarHBondContact O-CE2 3.47Å; S109-Y242 VanDerWaalsContact O-CZ 3.27Å; S109-Y242 PolarHBondContact O-OH 2.97Å; V240-Y242 VanDerWaalsContact C-N 3.27Å; V240-Y242 PolarHBondContact O-N 3.22Å; Y242-E244 VanDerWaalsContact C-N 3.31Å; Y242-A246 WeakPolarHBondContact O-CB 3.35Å; Y242-A246 PolarHBondContact O-N 3.03Å
243	V	59.9	Low	58.2	Low	96 Å²	96	91.9 Å²	91.9	58%	0.582	48%	0.48	S	S	*	.	H	α-helix	trans	-66.5	-39	174.5	178.1	0	0	0	0	109.7	V240 R245 A246 V247	V240-V243 PolarHBondContact O-N 3.06Å; V243-R245 PolarHBondContact O-N 3.3Å; V243-A246 PolarHBondContact O-N 3.09Å; V243-V247 HydrophobicContact CG1-CG2 4.18Å; V243-V247 WeakPolarHBondContact O-CB 3.39Å; V243-V247 WeakPolarHBondContact O-CG2 3.34Å; V243-V247 PolarHBondContact O-N 3.27Å
244	E	53.3	Low	59.6	Low	132 Å²	132	89.2 Å²	89.2	62%	0.617	47%	0.474	S	S	*	.	H	α-helix	trans	-65.5	-40.6	179.5	-166.5	169.3	-164.6	0	0	112.6	V240 Y242 V247 S248	V240-E244 PolarHBondContact O-N 3.43Å; Y242-E244 VanDerWaalsContact C-N 3.31Å; E244-V247 PolarHBondContact O-N 3.45Å; E244-S248 WeakPolarHBondContact O-CB 3.44Å; E244-S248 PolarHBondContact O-N 2.98Å
245	R	55.8	Low	60.6	Low	171 Å²	171	91.8 Å²	91.8	65%	0.645	49%	0.487	S	S	*	.	H	α-helix	trans	-66.1	-43.5	173	-72.2	-175.3	-174.8	-173	4.4	112.5	D241 V243 V247 S248 D249	D241-R245 PolarHBondContact O-N 3.33Å; V243-R245 PolarHBondContact O-N 3.3Å; R245-V247 VanDerWaalsContact C-N 3.34Å; R245-V247 PolarHBondContact O-N 2.95Å; R245-S248 WeakPolarHBondContact O-CB 3.39Å; R245-S248 PolarHBondContact O-N 3.49Å; R245-S248 VanDerWaalsContact O-N 3.14Å; R245-D249 PolarHBondContact O-N 2.96Å
246	A	58.6	Low	61.8	Low	57 Å²	57	97.3 Å²	97.3	47%	0.471	51%	0.505	S	S	.	.	H	α-helix	trans	-62.6	-39.5	176.2	0	0	0	0	0	112.3	Y242 V243 S248 D249 T250	Y242-A246 WeakPolarHBondContact O-CB 3.35Å; Y242-A246 PolarHBondContact O-N 3.03Å; V243-A246 PolarHBondContact O-N 3.09Å; A246-S248 VanDerWaalsContact C-N 3.35Å; A246-D249 PolarHBondContact O-N 2.97Å; A246-T250 WeakPolarHBondContact O-CB 3.43Å; A246-T250 VanDerWaalsContact O-CG2 3.23Å; A246-T250 WeakPolarHBondContact O-CG2 3.42Å; A246-T250 PolarHBondContact O-N 3.18Å; A246-T250 PolarHBondContact O-OG1 3.12Å
247	V	64.1	Low	62.4	Low	63 Å²	63	98 Å²	98	38%	0.382	50%	0.502	S	S	.	.	H	α-helix	trans	-66.5	-36.7	173.5	170.7	0	0	0	0	111.5	V243 E244 R245 T250 K251	V243-V247 HydrophobicContact CG1-CG2 4.18Å; V243-V247 WeakPolarHBondContact O-CB 3.39Å; V243-V247 WeakPolarHBondContact O-CG2 3.34Å; V243-V247 PolarHBondContact O-N 3.27Å; E244-V247 PolarHBondContact O-N 3.45Å; R245-V247 VanDerWaalsContact C-N 3.34Å; R245-V247 PolarHBondContact O-N 2.95Å; V247-T250 WeakPolarHBondContact CA-OG1 3.41Å; V247-T250 PolarHBondContact O-OG1 2.85Å; V247-K251 HydrophobicContact CG1-CD 4.42Å; V247-K251 WeakPolarHBondContact O-CB 3.28Å; V247-K251 WeakPolarHBondContact O-CG 3.38Å; V247-K251 PolarHBondContact O-N 3.1Å; V247-K251 VanDerWaalsContact O-N 3.09Å
248	S	68.5	Low	63.6	Low	51 Å²	51	94.7 Å²	94.7	36%	0.357	49%	0.487	S	S	.	.	H	α-helix	trans	-66.8	-44.7	176.1	-170.8	0	0	0	0	112	E244 R245 A246 K251 K252	E244-S248 WeakPolarHBondContact O-CB 3.44Å; E244-S248 PolarHBondContact O-N 2.98Å; R245-S248 WeakPolarHBondContact O-CB 3.39Å; R245-S248 PolarHBondContact O-N 3.49Å; R245-S248 VanDerWaalsContact O-N 3.14Å; A246-S248 VanDerWaalsContact C-N 3.35Å; S248-K251 WeakPolarHBondContact O-CB 3.41Å; S248-K251 PolarHBondContact O-N 3.43Å; S248-K252 WeakPolarHBondContact O-CG 3.23Å; S248-K252 PolarHBondContact O-N 2.92Å
249	D	71.2	Confident	64.9	Low	89 Å²	89	97.6 Å²	97.6	48%	0.476	50%	0.499	S	S	.	.	H	α-helix	trans	-74.6	-34.8	-177.4	-70.6	-19.6	0	0	0	112.3	R245 A246 K252 A253	R245-D249 PolarHBondContact O-N 2.96Å; A246-D249 PolarHBondContact O-N 2.97Å; D249-K252 PolarHBondContact O-N 2.87Å; D249-K252 IonicContact OD1-NZ 2.87Å; D249-K252 PolarHBondContact OD1-NZ 2.89Å; D249-A253 WeakPolarHBondContact O-CB 3.44Å; D249-A253 PolarHBondContact O-N 3.44Å
250	T	69.6	Low	65.9	Low	85 Å²	85	98 Å²	98	52%	0.521	51%	0.505	S	S	.	.	H	α-helix	trans	-62.6	-41.7	168.6	51.4	0	0	0	0	111.7	A246 V247 K252 A253 V254	A246-T250 WeakPolarHBondContact O-CB 3.43Å; A246-T250 VanDerWaalsContact O-CG2 3.23Å; A246-T250 WeakPolarHBondContact O-CG2 3.42Å; A246-T250 PolarHBondContact O-N 3.18Å; A246-T250 PolarHBondContact O-OG1 3.12Å; V247-T250 WeakPolarHBondContact CA-OG1 3.41Å; V247-T250 PolarHBondContact O-OG1 2.85Å; T250-K252 PolarHBondContact O-N 2.76Å; T250-A253 PolarHBondContact O-N 3.46Å; T250-V254 WeakPolarHBondContact O-CG2 3.47Å; T250-V254 PolarHBondContact O-N 2.78Å
251	K	68.2	Low	67	Low	138 Å²	138	100.1 Å²	100.1	60%	0.6	50%	0.504	S	S	*	.	H	α-helix	trans	-61	-41	172.9	-82.7	176.8	-178.7	172.4	0	112.5	V247 S248 K255	V247-K251 HydrophobicContact CG1-CD 4.42Å; V247-K251 WeakPolarHBondContact O-CB 3.28Å; V247-K251 WeakPolarHBondContact O-CG 3.38Å; V247-K251 PolarHBondContact O-N 3.1Å; V247-K251 VanDerWaalsContact O-N 3.09Å; S248-K251 WeakPolarHBondContact O-CB 3.41Å; S248-K251 PolarHBondContact O-N 3.43Å; K251-K255 WeakPolarHBondContact O-CG 3.43Å; K251-K255 PolarHBondContact O-N 3.1Å; K251-K255 VanDerWaalsContact O-N 3.1Å
252	K	74.3	Confident	68.3	Low	99 Å²	99	104.6 Å²	104.6	43%	0.43	51%	0.514	S	S	.	.	H	α-helix	trans	-65.4	-44.5	175	-70.9	172.6	-161.4	153.6	0	111	S248 D249 T250 V254 K255 Y256	S248-K252 WeakPolarHBondContact O-CG 3.23Å; S248-K252 PolarHBondContact O-N 2.92Å; D249-K252 PolarHBondContact O-N 2.87Å; D249-K252 IonicContact OD1-NZ 2.87Å; D249-K252 PolarHBondContact OD1-NZ 2.89Å; T250-K252 PolarHBondContact O-N 2.76Å; K252-V254 PolarHBondContact O-N 2.85Å; K252-K255 WeakPolarHBondContact O-CB 3.45Å; K252-K255 PolarHBondContact O-N 2.82Å; K252-K255 VanDerWaalsContact O-N 3.12Å; K252-Y256 HydrophobicContact CB-CD2 4.37Å; K252-Y256 HydrophobicContact CB-CE2 4.19Å; K252-Y256 WeakPolarHBondContact O-CD2 3.45Å; K252-Y256 PolarHBondContact O-N 3.39Å
253	A	68.5	Low	69.5	Low	58 Å²	58	106.2 Å²	106.2	48%	0.479	52%	0.523	S	S	.	.	H	α-helix	trans	-58.3	-45.7	178.1	0	0	0	0	0	111.8	D249 T250 K255 Y256 Q257	D249-A253 WeakPolarHBondContact O-CB 3.44Å; D249-A253 PolarHBondContact O-N 3.44Å; T250-A253 PolarHBondContact O-N 3.46Å; A253-K255 VanDerWaalsContact C-N 3.35Å; A253-K255 PolarHBondContact O-N 2.8Å; A253-Y256 PolarHBondContact O-N 2.87Å; A253-Q257 WeakPolarHBondContact O-CB 3.39Å; A253-Q257 PolarHBondContact O-N 3.22Å
254	V	73	Confident	70.5	Confident	88 Å²	88	109 Å²	109	53%	0.533	53%	0.527	S	S	.	.	H	α-helix	trans	-61.3	-42.1	174.5	173.2	0	0	0	0	111.5	T250 K252 Q257 S258	T250-V254 WeakPolarHBondContact O-CG2 3.47Å; T250-V254 PolarHBondContact O-N 2.78Å; K252-V254 PolarHBondContact O-N 2.85Å; V254-Q257 PolarHBondContact O-N 3.26Å; V254-S258 WeakPolarHBondContact O-CB 3.46Å; V254-S258 PolarHBondContact O-N 2.86Å; V254-S258 PolarHBondContact O-OG 3.42Å
255	K	73.8	Confident	71.9	Confident	143 Å²	143	107.4 Å²	107.4	62%	0.622	52%	0.522	S	S	*	.	H	α-helix	trans	-61.6	-44.2	175	-78.7	-178	179.9	179.1	0	111.7	K251 K252 A253 S258 K259	K251-K255 WeakPolarHBondContact O-CG 3.43Å; K251-K255 PolarHBondContact O-N 3.1Å; K251-K255 VanDerWaalsContact O-N 3.1Å; K252-K255 WeakPolarHBondContact O-CB 3.45Å; K252-K255 PolarHBondContact O-N 2.82Å; K252-K255 VanDerWaalsContact O-N 3.12Å; A253-K255 VanDerWaalsContact C-N 3.35Å; A253-K255 PolarHBondContact O-N 2.8Å; K255-S258 PolarHBondContact O-N 3.25Å; K255-S258 PolarHBondContact O-OG 2.97Å; K255-K259 WeakPolarHBondContact O-CG 3.43Å; K255-K259 PolarHBondContact O-N 3.36Å; K255-K259 VanDerWaalsContact O-N 3.1Å
256	Y	74.6	Confident	73.1	Confident	166 Å²	166	105.4 Å²	105.4	65%	0.651	52%	0.522	S	S	*	.	H	α-helix	trans	-64	-44.2	176.5	-75	-64	0	0	0	112.1	K252 A253 S258 K259 A260	K252-Y256 HydrophobicContact CB-CD2 4.37Å; K252-Y256 HydrophobicContact CB-CE2 4.19Å; K252-Y256 WeakPolarHBondContact O-CD2 3.45Å; K252-Y256 PolarHBondContact O-N 3.39Å; A253-Y256 PolarHBondContact O-N 2.87Å; Y256-S258 VanDerWaalsContact C-N 3.33Å; Y256-S258 PolarHBondContact O-N 3.1Å; Y256-K259 PolarHBondContact O-N 2.9Å; Y256-A260 WeakPolarHBondContact O-CB 3.07Å; Y256-A260 PolarHBondContact O-N 3.04Å
257	Q	68.9	Low	74.4	Confident	105 Å²	105	107.8 Å²	107.8	49%	0.491	53%	0.526	S	S	.	.	H	α-helix	trans	-60.2	-42.6	176.8	-162.5	-164	41.5	0	0	111.6	A253 V254 A260 R261	A253-Q257 WeakPolarHBondContact O-CB 3.39Å; A253-Q257 PolarHBondContact O-N 3.22Å; V254-Q257 PolarHBondContact O-N 3.26Å; Q257-A260 PolarHBondContact O-N 3.13Å; Q257-R261 PolarHBondContact O-N 3.18Å
258	S	73.6	Confident	75.5	Confident	41 Å²	41	109.9 Å²	109.9	29%	0.287	53%	0.534	S	S	.	.	H	α-helix	trans	-64.9	-39.5	177.5	74.6	0	0	0	0	112.9	V254 K255 Y256 R262	V254-S258 WeakPolarHBondContact O-CB 3.46Å; V254-S258 PolarHBondContact O-N 2.86Å; V254-S258 PolarHBondContact O-OG 3.42Å; K255-S258 PolarHBondContact O-N 3.25Å; K255-S258 PolarHBondContact O-OG 2.97Å; Y256-S258 VanDerWaalsContact C-N 3.33Å; Y256-S258 PolarHBondContact O-N 3.1Å; S258-R262 WeakPolarHBondContact O-CG 3.42Å; S258-R262 PolarHBondContact O-N 3.41Å
259	K	76.4	Confident	76.5	Confident	132 Å²	132	111.7 Å²	111.7	57%	0.574	54%	0.538	S	S	*	.	H	α-helix	trans	-68.4	-39.9	175.4	-72.9	-179.4	179.3	-177.6	0	111.6	K255 Y256 R262 K263	K255-K259 WeakPolarHBondContact O-CG 3.43Å; K255-K259 PolarHBondContact O-N 3.36Å; K255-K259 VanDerWaalsContact O-N 3.1Å; Y256-K259 PolarHBondContact O-N 2.9Å; K259-R262 PolarHBondContact O-N 3.44Å; K259-K263 WeakPolarHBondContact O-CG 3.46Å; K259-K263 PolarHBondContact O-N 3.29Å
260	A	73.9	Confident	77.2	Confident	53 Å²	53	111.1 Å²	111.1	44%	0.438	54%	0.54	S	S	.	.	H	α-helix	trans	-63.3	-42.5	176.1	0	0	0	0	0	111.8	Y256 Q257 R262 K263 K264	Y256-A260 WeakPolarHBondContact O-CB 3.07Å; Y256-A260 PolarHBondContact O-N 3.04Å; Q257-A260 PolarHBondContact O-N 3.13Å; A260-R262 PolarHBondContact O-N 3.05Å; A260-K263 PolarHBondContact O-N 2.93Å; A260-K264 PolarHBondContact O-N 3.04Å
261	R	77.1	Confident	78.1	Confident	126 Å²	126	110.8 Å²	110.8	48%	0.475	54%	0.541	S	S	.	.	H	α-helix	trans	-59	-45.6	173.8	-79.4	-168.9	-75.4	-106.4	-4.9	112.4	Q257 K263 K264 I265	Q257-R261 PolarHBondContact O-N 3.18Å; R261-K263 PolarHBondContact O-N 3.46Å; R261-K264 PolarHBondContact O-N 3.3Å; R261-I265 WeakPolarHBondContact O-CG1 3.48Å; R261-I265 PolarHBondContact O-N 3.09Å
262	R	77.5	Confident	79.2	Confident	189 Å²	189	108.2 Å²	108.2	71%	0.713	54%	0.536	S	S	*	.	H	α-helix	trans	-62.4	-40.7	177.1	-69.8	179.8	-173.9	-170.4	1.9	112.4	S258 K259 A260 I265 M266	S258-R262 WeakPolarHBondContact O-CG 3.42Å; S258-R262 PolarHBondContact O-N 3.41Å; K259-R262 PolarHBondContact O-N 3.44Å; A260-R262 PolarHBondContact O-N 3.05Å; R262-I265 PolarHBondContact O-N 3.37Å; R262-M266 WeakPolarHBondContact O-CG 3.46Å; R262-M266 PolarHBondContact O-N 3.49Å; R262-M266 VanDerWaalsContact O-N 3.09Å
263	K	78.9	Confident	80	Confident	149 Å²	149	107.4 Å²	107.4	65%	0.648	54%	0.539	S	S	*	.	H	α-helix	trans	-65.7	-41.1	175.6	-72.9	-175.1	176.9	-171.7	0	112.2	K259 A260 R261 I265 M266 I267	K259-K263 WeakPolarHBondContact O-CG 3.46Å; K259-K263 PolarHBondContact O-N 3.29Å; A260-K263 PolarHBondContact O-N 2.93Å; R261-K263 PolarHBondContact O-N 3.46Å; K263-I265 PolarHBondContact O-N 3.49Å; K263-M266 PolarHBondContact O-N 2.98Å; K263-I267 WeakPolarHBondContact O-CG1 3.33Å; K263-I267 PolarHBondContact O-N 3.02Å
264	K	80.3	Confident	81	Confident	153 Å²	153	109.7 Å²	109.7	67%	0.665	54%	0.543	S	S	*	.	H	α-helix	trans	-59	-45.6	174.2	-82.7	-168.9	175.3	-173.7	0	111.9	A260 R261 M266 I267 I268	A260-K264 PolarHBondContact O-N 3.04Å; R261-K264 PolarHBondContact O-N 3.3Å; K264-M266 PolarHBondContact O-N 3.46Å; K264-I267 PolarHBondContact O-N 3.36Å; K264-I268 WeakPolarHBondContact O-CG1 3.36Å; K264-I268 PolarHBondContact O-N 3.33Å
265	I	83.1	Confident	81.8	Confident	100 Å²	100	107.4 Å²	107.4	51%	0.513	54%	0.537	S	S	.	.	H	α-helix	trans	-62	-43.9	178.2	-67.2	168.7	0	0	0	111	R261 R262 K263 I267 I268 I269	R261-I265 WeakPolarHBondContact O-CG1 3.48Å; R261-I265 PolarHBondContact O-N 3.09Å; R262-I265 PolarHBondContact O-N 3.37Å; K263-I265 PolarHBondContact O-N 3.49Å; I265-I267 VanDerWaalsContact C-N 3.34Å; I265-I267 PolarHBondContact O-N 3.42Å; I265-I268 PolarHBondContact O-N 3.44Å; I265-I269 HydrophobicContact CG2-CD1 3.88Å; I265-I269 HydrophobicContact CG2-CG1 4.48Å; I265-I269 WeakPolarHBondContact O-CG1 3.33Å; I265-I269 PolarHBondContact O-N 2.97Å
266	M	81.1	Confident	82.5	Confident	129 Å²	129	105.4 Å²	105.4	64%	0.635	53%	0.532	S	S	*	.	H	α-helix	trans	-62	-40.1	176.9	-74.9	-67.1	176.7	0	0	112.6	R262 K263 K264 I269 C270	R262-M266 WeakPolarHBondContact O-CG 3.46Å; R262-M266 PolarHBondContact O-N 3.49Å; R262-M266 VanDerWaalsContact O-N 3.09Å; K263-M266 PolarHBondContact O-N 2.98Å; K264-M266 PolarHBondContact O-N 3.46Å; M266-I269 PolarHBondContact O-N 3.26Å; M266-C270 PolarHBondContact O-N 3.25Å; M266-C270 PolarHBondContact O-SG 2.99Å; M266-C270 VanDerWaalsContact O-SG 3.36Å
267	I	85.4	Confident	83.2	Confident	107 Å²	107	101 Å²	101	55%	0.549	52%	0.523	S	S	.	.	H	α-helix	trans	-63.6	-44	175.5	-68.7	167.6	0	0	0	110.8	K263 K264 I265 I269 C270 C271	K263-I267 WeakPolarHBondContact O-CG1 3.33Å; K263-I267 PolarHBondContact O-N 3.02Å; K264-I267 PolarHBondContact O-N 3.36Å; I265-I267 VanDerWaalsContact C-N 3.34Å; I265-I267 PolarHBondContact O-N 3.42Å; I267-I269 PolarHBondContact O-N 3.23Å; I267-C270 PolarHBondContact O-N 3.01Å; I267-C271 PolarHBondContact O-N 3.42Å; I267-C271 PolarHBondContact O-SG 3.48Å
268	I	87.7	Confident	84.1	Confident	107 Å²	107	101 Å²	101	55%	0.549	53%	0.525	S	S	.	.	H	α-helix	trans	-60.1	-45.9	177.8	-68.5	166	0	0	0	110.8	K264 I265 C270 C271 V272	K264-I268 WeakPolarHBondContact O-CG1 3.36Å; K264-I268 PolarHBondContact O-N 3.33Å; I265-I268 PolarHBondContact O-N 3.44Å; I268-C270 PolarHBondContact O-N 3.28Å; I268-C271 PolarHBondContact O-N 3Å; I268-V272 HydrophobicContact CG2-CG2 4.48Å; I268-V272 WeakPolarHBondContact O-CG2 3.35Å; I268-V272 PolarHBondContact O-N 3.26Å
269	I	88.8	Confident	84.6	Confident	89 Å²	89	102 Å²	102	46%	0.456	54%	0.536	S	S	.	.	H	α-helix	trans	-60.3	-45.9	177.6	-66.9	167.8	0	0	0	110.6	I265 M266 I267 C271 V272 V273	I265-I269 HydrophobicContact CG2-CD1 3.88Å; I265-I269 HydrophobicContact CG2-CG1 4.48Å; I265-I269 WeakPolarHBondContact O-CG1 3.33Å; I265-I269 PolarHBondContact O-N 2.97Å; M266-I269 PolarHBondContact O-N 3.26Å; I267-I269 PolarHBondContact O-N 3.23Å; I269-C271 VanDerWaalsContact C-N 3.34Å; I269-C271 PolarHBondContact O-N 3.46Å; I269-V272 PolarHBondContact O-N 3.3Å; I269-V273 WeakPolarHBondContact O-CG2 3.47Å; I269-V273 PolarHBondContact O-N 3.26Å
270	C	87.6	Confident	84.9	Confident	76 Å²	76	99.4 Å²	99.4	51%	0.514	53%	0.534	S	S	.	.	H	α-helix	trans	-59.3	-42.8	176.2	-72.9	0	0	0	0	112.4	M266 I267 I268 V273 L274	M266-C270 PolarHBondContact O-N 3.25Å; M266-C270 PolarHBondContact O-SG 2.99Å; M266-C270 VanDerWaalsContact O-SG 3.36Å; I267-C270 PolarHBondContact O-N 3.01Å; I268-C270 PolarHBondContact O-N 3.28Å; C270-V273 PolarHBondContact O-N 3.24Å; C270-L274 WeakPolarHBondContact O-CB 3.35Å; C270-L274 WeakPolarHBondContact O-CG 3.39Å; C270-L274 PolarHBondContact O-N 3.43Å
271	C	88.4	Confident	85.3	Confident	79 Å²	79	102 Å²	102	53%	0.534	54%	0.54	S	S	.	.	H	α-helix	trans	-63.5	-40.5	177.2	-69.9	0	0	0	0	112.4	I267 I268 I269 L274 G275	I267-C271 PolarHBondContact O-N 3.42Å; I267-C271 PolarHBondContact O-SG 3.48Å; I268-C271 PolarHBondContact O-N 3Å; I269-C271 VanDerWaalsContact C-N 3.34Å; I269-C271 PolarHBondContact O-N 3.46Å; C271-L274 PolarHBondContact O-N 2.93Å; C271-G275 PolarHBondContact O-N 2.99Å
272	V	91.1	Very high	85.5	Confident	84 Å²	84	99.7 Å²	99.7	51%	0.509	54%	0.539	S	S	.	.	H	α-helix	trans	-64.4	-45.9	177	171.8	0	0	0	0	111	I268 I269 L274 G275 I276	I268-V272 HydrophobicContact CG2-CG2 4.48Å; I268-V272 WeakPolarHBondContact O-CG2 3.35Å; I268-V272 PolarHBondContact O-N 3.26Å; I269-V272 PolarHBondContact O-N 3.3Å; V272-L274 PolarHBondContact O-N 3.01Å; V272-G275 PolarHBondContact O-N 3.47Å; V272-I276 HydrophobicContact CG1-CD1 4.01Å; V272-I276 WeakPolarHBondContact O-CG1 3.37Å; V272-I276 PolarHBondContact O-N 3.48Å
273	V	90.8	Very high	85.3	Confident	81 Å²	81	92.3 Å²	92.3	49%	0.491	52%	0.522	S	S	.	.	H	α-helix	trans	-61.5	-45.5	177.9	173.5	0	0	0	0	111	I269 C270 G275 I276 V277	I269-V273 WeakPolarHBondContact O-CG2 3.47Å; I269-V273 PolarHBondContact O-N 3.26Å; C270-V273 PolarHBondContact O-N 3.24Å; V273-G275 VanDerWaalsContact C-N 3.32Å; V273-G275 PolarHBondContact O-N 3.49Å; V273-I276 PolarHBondContact O-N 3.01Å; V273-V277 WeakPolarHBondContact O-CG2 3.41Å; V273-V277 PolarHBondContact O-N 2.91Å
274	L	89.6	Confident	84.9	Confident	106 Å²	106	87.8 Å²	87.8	56%	0.555	52%	0.517	S	S	*	.	H	α-helix	trans	-60.3	-42.1	175.8	-75.2	170.4	0	0	0	111.9	C270 C271 V272 I276 V277 I278	C270-L274 WeakPolarHBondContact O-CB 3.35Å; C270-L274 WeakPolarHBondContact O-CG 3.39Å; C270-L274 PolarHBondContact O-N 3.43Å; C271-L274 PolarHBondContact O-N 2.93Å; V272-L274 PolarHBondContact O-N 3.01Å; L274-I276 PolarHBondContact O-N 3.31Å; L274-V277 PolarHBondContact O-N 3.3Å; L274-I278 VanDerWaalsContact O-CG1 3.28Å; L274-I278 WeakPolarHBondContact O-CG1 3.33Å; L274-I278 PolarHBondContact O-N 2.86Å
275	G	89.3	Confident	84.4	Confident	40 Å²	40	85.3 Å²	85.3	41%	0.412	52%	0.515	S	S	.	.	H	α-helix	trans	-59.4	-43.5	175.6	0	0	0	0	0	112.9	C271 V272 V273 I278 A279	C271-G275 PolarHBondContact O-N 2.99Å; V272-G275 PolarHBondContact O-N 3.47Å; V273-G275 VanDerWaalsContact C-N 3.32Å; V273-G275 PolarHBondContact O-N 3.49Å; G275-I278 PolarHBondContact O-N 2.94Å; G275-A279 WeakPolarHBondContact O-CB 3.28Å; G275-A279 PolarHBondContact O-N 3.36Å
276	I	89.5	Confident	83.2	Confident	102 Å²	102	87.7 Å²	87.7	52%	0.523	53%	0.528	S	S	.	.	H	α-helix	trans	-64.2	-43.8	177	-66.2	165.9	0	0	0	111	V272 V273 L274 I278 A279 S280	V272-I276 HydrophobicContact CG1-CD1 4.01Å; V272-I276 WeakPolarHBondContact O-CG1 3.37Å; V272-I276 PolarHBondContact O-N 3.48Å; V273-I276 PolarHBondContact O-N 3.01Å; L274-I276 PolarHBondContact O-N 3.31Å; I276-I278 PolarHBondContact O-N 3.44Å; I276-A279 PolarHBondContact O-N 2.7Å; I276-S280 WeakPolarHBondContact O-CB 3.37Å; I276-S280 PolarHBondContact O-N 3.44Å; I276-S280 PolarHBondContact O-OG 2.77Å
277	V	88.7	Confident	81.7	Confident	73 Å²	73	89.2 Å²	89.2	44%	0.442	55%	0.552	S	S	.	*	H	α-helix	trans	-61.3	-46.5	178.5	171.5	0	0	0	0	110.6	V273 L274 S280 I281	V273-V277 WeakPolarHBondContact O-CG2 3.41Å; V273-V277 PolarHBondContact O-N 2.91Å; L274-V277 PolarHBondContact O-N 3.3Å; V277-S280 PolarHBondContact O-N 3.06Å; V277-I281 HydrophobicContact CG1-CD1 3.9Å; V277-I281 WeakPolarHBondContact O-CG1 3.35Å; V277-I281 PolarHBondContact O-N 3.38Å
278	I	86.9	Confident	81.5	Confident	105 Å²	105	88.3 Å²	88.3	54%	0.538	55%	0.552	S	S	.	*	H	α-helix	trans	-62.5	-45.9	178.1	-66.7	166.5	0	0	0	110.6	L274 G275 I276 S280 I281 V282	L274-I278 VanDerWaalsContact O-CG1 3.28Å; L274-I278 WeakPolarHBondContact O-CG1 3.33Å; L274-I278 PolarHBondContact O-N 2.86Å; G275-I278 PolarHBondContact O-N 2.94Å; I276-I278 PolarHBondContact O-N 3.44Å; I278-S280 VanDerWaalsContact C-N 3.3Å; I278-S280 PolarHBondContact O-N 2.98Å; I278-I281 PolarHBondContact O-N 3.5Å; I278-V282 HydrophobicContact CG2-CG2 4.38Å; I278-V282 WeakPolarHBondContact O-CG2 3.37Å; I278-V282 PolarHBondContact O-N 3.36Å
279	A	84.2	Confident	81.2	Confident	63 Å²	63	87.3 Å²	87.3	52%	0.521	55%	0.552	S	S	.	*	H	α-helix	trans	-61.6	-37.3	178.1	0	0	0	0	0	112.6	G275 I276 G283	G275-A279 WeakPolarHBondContact O-CB 3.28Å; G275-A279 PolarHBondContact O-N 3.36Å; I276-A279 PolarHBondContact O-N 2.7Å; A279-G283 PolarHBondContact O-N 2.94Å
280	S	82.7	Confident	80.8	Confident	77 Å²	77	87.2 Å²	87.2	54%	0.538	56%	0.557	S	S	.	*	H	α-helix	trans	-67.9	-40.1	177.8	-53.5	0	0	0	0	111.9	I276 V277 I278 G284	I276-S280 WeakPolarHBondContact O-CB 3.37Å; I276-S280 PolarHBondContact O-N 3.44Å; I276-S280 PolarHBondContact O-OG 2.77Å; V277-S280 PolarHBondContact O-N 3.06Å; I278-S280 VanDerWaalsContact C-N 3.3Å; I278-S280 PolarHBondContact O-N 2.98Å; S280-G284 PolarHBondContact O-N 3.24Å
281	I	83.4	Confident	80.4	Confident	107 Å²	107	87.9 Å²	87.9	55%	0.549	56%	0.56	S	S	.	*	H	α-helix	trans	-66.8	-49.4	176.7	-66.2	165	0	0	0	109.9	V277 I278 G284 T285	V277-I281 HydrophobicContact CG1-CD1 3.9Å; V277-I281 WeakPolarHBondContact O-CG1 3.35Å; V277-I281 PolarHBondContact O-N 3.38Å; I278-I281 PolarHBondContact O-N 3.5Å; I281-G284 PolarHBondContact O-N 2.97Å; I281-T285 WeakPolarHBondContact O-CG2 3.41Å; I281-T285 PolarHBondContact O-N 3.28Å; I281-T285 PolarHBondContact O-OG1 3.12Å; I281-T285 VanDerWaalsContact O-OG1 3.12Å
282	V	81.3	Confident	79.9	Confident	78 Å²	78	88.4 Å²	88.4	47%	0.473	56%	0.561	S	S	.	*	H	α-helix	trans	-64.7	-43.4	-179.3	176.2	0	0	0	0	111.2	I278 T285 L286	I278-V282 HydrophobicContact CG2-CG2 4.38Å; I278-V282 WeakPolarHBondContact O-CG2 3.37Å; I278-V282 PolarHBondContact O-N 3.36Å; V282-T285 WeakPolarHBondContact CA-OG1 3.37Å; V282-T285 PolarHBondContact O-N 2.95Å; V282-T285 PolarHBondContact O-OG1 3.25Å; V282-L286 PolarHBondContact O-N 3.44Å; V282-L286 VanDerWaalsContact O-N 3.11Å
283	G	73.5	Confident	79.1	Confident	33 Å²	33	88.7 Å²	88.7	34%	0.34	57%	0.565	S	S	.	*	H	α-helix	trans	-65.3	-37.1	177	0	0	0	0	0	113.5	A279 T285 L286 S287	A279-G283 PolarHBondContact O-N 2.94Å; G283-T285 VanDerWaalsContact C-N 3.32Å; G283-L286 PolarHBondContact O-N 3.11Å; G283-S287 PolarHBondContact O-N 2.8Å; G283-S287 PolarHBondContact O-OG 3.02Å
284	G	69	Low	78.3	Confident	54 Å²	54	89.3 Å²	89.3	56%	0.557	57%	0.57	S	S	*	*	H	α-helix	trans	-71.8	-23.6	174.4	0	0	0	0	0	113.9	S280 I281	S280-G284 PolarHBondContact O-N 3.24Å; I281-G284 PolarHBondContact O-N 2.97Å
285	T	70.1	Confident	77.4	Confident	102 Å²	102	88 Å²	88	63%	0.626	57%	0.571	S	S	*	*	H	α-helix	trans	-86.8	-17.7	174.3	53.4	0	0	0	0	114.2	I281 V282 G283	I281-T285 WeakPolarHBondContact O-CG2 3.41Å; I281-T285 PolarHBondContact O-N 3.28Å; I281-T285 PolarHBondContact O-OG1 3.12Å; I281-T285 VanDerWaalsContact O-OG1 3.12Å; V282-T285 WeakPolarHBondContact CA-OG1 3.37Å; V282-T285 PolarHBondContact O-N 2.95Å; V282-T285 PolarHBondContact O-OG1 3.25Å; G283-T285 VanDerWaalsContact C-N 3.32Å
286	L	57.5	Low	76.5	Confident	149 Å²	149	92 Å²	92	78%	0.78	58%	0.584	S	S	*	*	H	α-helix	trans	-101.7	-3.2	179.6	-110.9	78.1	0	0	0	114	V282 G283	V282-L286 PolarHBondContact O-N 3.44Å; V282-L286 VanDerWaalsContact O-N 3.11Å; G283-L286 PolarHBondContact O-N 3.11Å
287	S	50.7	Low	75.3	Confident	161 Å²	161	91.1 Å²	91.1	100%	1.126	59%	0.59	S	S	*	*			trans	-101.9	0	174.4	-52.1	0	0	0	0	110.4	G283	G283-S287 PolarHBondContact O-N 2.8Å; G283-S287 PolarHBondContact O-OG 3.02Å

Retrieved 287 of 287 residues in 491.1 ms (Link to these results)

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