A0A096LX43_POEFO Loading...

Family with sequence similarity 237 member A

AlphaFold DB , UniProt , Accession A0A096LX43, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 156 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	53.2	Low	56.6	Low	227 Å²	227	119.4 Å²	119.4	100%	1.118	66%	0.657	S	S	*	*				0	19.8	0	-76.7	168.1	150.9	0	0	114
2	V	47.4	Very low	57.4	Low	119 Å²	119	115.8 Å²	115.8	72%	0.721	64%	0.641	S	S	*	*			trans	-91.9	-29.2	177.2	-176.1	0	0	0	0	114.9	V4	V2-V4 VanDerWaalsContact C-N 3.35Å; V2-V4 PolarHBondContact O-N 3.16Å
3	P	53.5	Low	58.2	Low	90 Å²	90	113.8 Å²	113.8	58%	0.584	63%	0.634	S	S	*	*	H	α-helix	trans	-75.6	-21.5	-174.7	27.9	-32.2	0	0	0	113.7	N7	P3-N7 PolarHBondContact O-ND2 3.45Å
4	V	50.9	Low	58.7	Low	109 Å²	109	116.3 Å²	116.3	66%	0.661	64%	0.635	S	S	*	*	H	α-helix	trans	-75.8	-34.2	-178.6	-177	0	0	0	0	111.5	V2 F6 N7 L8	V2-V4 VanDerWaalsContact C-N 3.35Å; V2-V4 PolarHBondContact O-N 3.16Å; V4-F6 PolarHBondContact O-N 2.94Å; V4-N7 PolarHBondContact O-N 3.24Å; V4-L8 PolarHBondContact O-N 3Å
5	L	54.8	Low	59.3	Low	128 Å²	128	114.5 Å²	114.5	67%	0.67	63%	0.629	S	S	*	*	H	α-helix	trans	-66.7	-38.3	179.9	-141.3	85.3	0	0	0	111.7	L8 T9	L5-L8 PolarHBondContact O-N 3.17Å; L5-T9 PolarHBondContact O-N 2.95Å; L5-T9 VanDerWaalsContact O-N 3.14Å; L5-T9 PolarHBondContact O-OG1 2.84Å
6	F	57.2	Low	59.3	Low	154 Å²	154	115.2 Å²	115.2	68%	0.675	63%	0.631	S	S	*	*	H	α-helix	trans	-67.6	-36.2	-179.4	-138.6	-90.2	0	0	0	112.6	V4 T9 L10	V4-F6 PolarHBondContact O-N 2.94Å; F6-T9 WeakPolarHBondContact CA-OG1 3.39Å; F6-T9 PolarHBondContact O-OG1 3.08Å; F6-L10 WeakPolarHBondContact O-CB 3.31Å; F6-L10 PolarHBondContact O-N 3.02Å; F6-L10 VanDerWaalsContact O-N 3.12Å
7	N	59.2	Low	59.4	Low	112 Å²	112	113.1 Å²	113.1	60%	0.599	62%	0.623	S	S	*	*	H	α-helix	trans	-71.8	-32.6	176.1	-76.5	-73.8	0	0	0	111.9	P3 V4 A11	P3-N7 PolarHBondContact O-ND2 3.45Å; V4-N7 PolarHBondContact O-N 3.24Å; N7-A11 WeakPolarHBondContact O-CB 3.48Å; N7-A11 PolarHBondContact O-N 3.37Å
8	L	59.3	Low	59.4	Low	120 Å²	120	110.6 Å²	110.6	63%	0.628	61%	0.613	S	S	*	*	H	α-helix	trans	-70.5	-40.5	177.8	-156.3	77.7	0	0	0	111.8	V4 L5 T12	V4-L8 PolarHBondContact O-N 3Å; L5-L8 PolarHBondContact O-N 3.17Å; L8-T12 PolarHBondContact O-N 2.73Å; L8-T12 VanDerWaalsContact O-N 3.08Å; L8-T12 PolarHBondContact O-OG1 3.2Å
9	T	60.7	Low	59.2	Low	82 Å²	82	112.2 Å²	112.2	50%	0.503	62%	0.618	S	S	.	*	H	α-helix	trans	-67.8	-38.8	174	26.5	0	0	0	0	112.6	L5 F6 T12 V13	L5-T9 PolarHBondContact O-N 2.95Å; L5-T9 VanDerWaalsContact O-N 3.14Å; L5-T9 PolarHBondContact O-OG1 2.84Å; F6-T9 WeakPolarHBondContact CA-OG1 3.39Å; F6-T9 PolarHBondContact O-OG1 3.08Å; T9-T12 VanDerWaalsContact CA-OG1 3.29Å; T9-T12 WeakPolarHBondContact CA-OG1 3.35Å; T9-T12 PolarHBondContact O-N 2.89Å; T9-T12 PolarHBondContact O-OG1 3.01Å; T9-T12 VanDerWaalsContact O-OG1 3.08Å; T9-V13 VanDerWaalsContact O-CG2 3.28Å; T9-V13 WeakPolarHBondContact O-CG2 3.22Å; T9-V13 PolarHBondContact O-N 2.98Å
10	L	60.8	Low	59	Low	117 Å²	117	111.5 Å²	111.5	61%	0.613	62%	0.621	S	S	*	*	H	α-helix	trans	-65	-43.4	176.5	-151.5	84.3	0	0	0	111.7	F6 V13 F14	F6-L10 WeakPolarHBondContact O-CB 3.31Å; F6-L10 PolarHBondContact O-N 3.02Å; F6-L10 VanDerWaalsContact O-N 3.12Å; L10-V13 PolarHBondContact O-N 3.5Å; L10-F14 WeakPolarHBondContact O-CB 3.41Å; L10-F14 PolarHBondContact O-N 3.23Å
11	A	65.8	Low	58.6	Low	55 Å²	55	109.4 Å²	109.4	46%	0.455	62%	0.618	S	S	.	*	H	α-helix	trans	-64.3	-41.1	178	0	0	0	0	0	112	N7 F14 V15	N7-A11 WeakPolarHBondContact O-CB 3.48Å; N7-A11 PolarHBondContact O-N 3.37Å; A11-F14 PolarHBondContact O-N 2.96Å; A11-V15 VanDerWaalsContact O-CG2 3.31Å; A11-V15 WeakPolarHBondContact O-CG2 3.48Å; A11-V15 PolarHBondContact O-N 2.91Å
12	T	66.1	Low	58.5	Low	76 Å²	76	103.1 Å²	103.1	47%	0.466	59%	0.592	S	S	.	*	H	α-helix	trans	-67.2	-41.5	177.7	29.8	0	0	0	0	112.4	L8 T9 F14 V15 L16	L8-T12 PolarHBondContact O-N 2.73Å; L8-T12 VanDerWaalsContact O-N 3.08Å; L8-T12 PolarHBondContact O-OG1 3.2Å; T9-T12 VanDerWaalsContact CA-OG1 3.29Å; T9-T12 WeakPolarHBondContact CA-OG1 3.35Å; T9-T12 PolarHBondContact O-N 2.89Å; T9-T12 PolarHBondContact O-OG1 3.01Å; T9-T12 VanDerWaalsContact O-OG1 3.08Å; T12-F14 VanDerWaalsContact C-N 3.31Å; T12-F14 PolarHBondContact O-N 2.96Å; T12-V15 PolarHBondContact O-N 2.85Å; T12-L16 WeakPolarHBondContact O-CB 3.29Å; T12-L16 PolarHBondContact O-N 3.05Å
13	V	67.1	Low	58.6	Low	90 Å²	90	102.7 Å²	102.7	55%	0.545	59%	0.592	S	S	.	*	H	α-helix	trans	-62.5	-40.3	173.8	172.6	0	0	0	0	111.1	T9 L10 L16 T17	T9-V13 VanDerWaalsContact O-CG2 3.28Å; T9-V13 WeakPolarHBondContact O-CG2 3.22Å; T9-V13 PolarHBondContact O-N 2.98Å; L10-V13 PolarHBondContact O-N 3.5Å; V13-L16 PolarHBondContact O-N 3.16Å; V13-T17 WeakPolarHBondContact O-CB 3.4Å; V13-T17 PolarHBondContact O-N 2.86Å; V13-T17 PolarHBondContact O-OG1 3.49Å
14	F	66.1	Low	58.3	Low	149 Å²	149	106.5 Å²	106.5	65%	0.654	61%	0.607	S	S	*	*	H	α-helix	trans	-64.4	-44.8	178.4	-156.4	-97.5	0	0	0	111.6	L10 A11 T12 T17 C18	L10-F14 WeakPolarHBondContact O-CB 3.41Å; L10-F14 PolarHBondContact O-N 3.23Å; A11-F14 PolarHBondContact O-N 2.96Å; T12-F14 VanDerWaalsContact C-N 3.31Å; T12-F14 PolarHBondContact O-N 2.96Å; F14-T17 PolarHBondContact O-N 3.32Å; F14-C18 PolarHBondContact O-N 3Å; F14-C18 PolarHBondContact O-SG 3.43Å
15	V	66.7	Low	58.4	Low	89 Å²	89	113.2 Å²	113.2	54%	0.539	62%	0.62	S	S	.	*	H	α-helix	trans	-65.5	-40.1	177.4	174	0	0	0	0	112.1	A11 T12 T17 C18 M19	A11-V15 VanDerWaalsContact O-CG2 3.31Å; A11-V15 WeakPolarHBondContact O-CG2 3.48Å; A11-V15 PolarHBondContact O-N 2.91Å; T12-V15 PolarHBondContact O-N 2.85Å; V15-T17 VanDerWaalsContact C-N 3.33Å; V15-T17 PolarHBondContact O-N 2.96Å; V15-C18 PolarHBondContact O-N 3.07Å; V15-M19 PolarHBondContact O-N 3.37Å
16	L	60.3	Low	57.9	Low	126 Å²	126	110.2 Å²	110.2	66%	0.66	62%	0.62	S	S	*	*	H	α-helix	trans	-62.6	-39.6	174.5	-94.5	146.3	0	0	0	112	T12 V13 M19 S20	T12-L16 WeakPolarHBondContact O-CB 3.29Å; T12-L16 PolarHBondContact O-N 3.05Å; V13-L16 PolarHBondContact O-N 3.16Å; L16-M19 PolarHBondContact O-N 3.36Å; L16-S20 PolarHBondContact O-N 3.48Å; L16-S20 VanDerWaalsContact O-N 3.07Å; L16-S20 PolarHBondContact O-OG 2.88Å
17	T	60.3	Low	57.3	Low	80 Å²	80	111 Å²	111	49%	0.491	63%	0.626	S	S	.	*	H	α-helix	trans	-65.2	-43.4	175.7	-51.8	0	0	0	0	110.7	V13 F14 V15 M19 S20 A21	V13-T17 WeakPolarHBondContact O-CB 3.4Å; V13-T17 PolarHBondContact O-N 2.86Å; V13-T17 PolarHBondContact O-OG1 3.49Å; F14-T17 PolarHBondContact O-N 3.32Å; V15-T17 VanDerWaalsContact C-N 3.33Å; V15-T17 PolarHBondContact O-N 2.96Å; T17-M19 PolarHBondContact O-N 3.01Å; T17-S20 PolarHBondContact O-N 3.3Å; T17-S20 PolarHBondContact O-OG 3.44Å; T17-A21 PolarHBondContact O-N 2.92Å
18	C	59.3	Low	56.7	Low	68 Å²	68	116 Å²	116	46%	0.459	64%	0.642	S	S	.	*	H	α-helix	trans	-65.6	-35.1	177.4	-65.4	0	0	0	0	113.2	F14 V15 A21	F14-C18 PolarHBondContact O-N 3Å; F14-C18 PolarHBondContact O-SG 3.43Å; V15-C18 PolarHBondContact O-N 3.07Å; C18-A21 PolarHBondContact O-N 3.32Å
19	M	55.2	Low	56	Low	141 Å²	141	116.9 Å²	116.9	70%	0.695	65%	0.647	S	S	*	*	H	α-helix	trans	-74.9	-29.2	176.9	-78.2	-67	179.4	0	0	113.1	V15 L16 T17 A21	V15-M19 PolarHBondContact O-N 3.37Å; L16-M19 PolarHBondContact O-N 3.36Å; T17-M19 PolarHBondContact O-N 3.01Å; M19-A21 PolarHBondContact O-N 3.45Å
20	S	55.6	Low	55.4	Low	97 Å²	97	118.1 Å²	118.1	68%	0.678	66%	0.656	S	S	*	*	H	α-helix	trans	-74.1	-13.1	170	68.1	0	0	0	0	113.9	L16 T17	L16-S20 PolarHBondContact O-N 3.48Å; L16-S20 VanDerWaalsContact O-N 3.07Å; L16-S20 PolarHBondContact O-OG 2.88Å; T17-S20 PolarHBondContact O-N 3.3Å; T17-S20 PolarHBondContact O-OG 3.44Å
21	A	52	Low	54.6	Low	68 Å²	68	121.4 Å²	121.4	56%	0.562	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	6.9	178.2	0	0	0	0	0	113.5	T17 C18 M19 P23	T17-A21 PolarHBondContact O-N 2.92Å; C18-A21 PolarHBondContact O-N 3.32Å; M19-A21 PolarHBondContact O-N 3.45Å; A21-P23 WeakPolarHBondContact O-CD 3.39Å
22	V	50.6	Low	54	Low	96 Å²	96	124 Å²	124	58%	0.582	68%	0.678	S	S	*	*			trans	-71.5	105.4	166.6	178	0	0	0	0	107.2	L24	V22-L24 PolarHBondContact O-N 3.28Å; V22-L24 VanDerWaalsContact O-N 3.14Å
23	P	48.7	Very low	53.1	Low	110 Å²	110	124.6 Å²	124.6	71%	0.714	68%	0.679	S	S	*	*			trans	-70.6	119.9	178.3	-8.3	27.5	0	0	0	106.1	A21 R25	A21-P23 WeakPolarHBondContact O-CD 3.39Å; P23-R25 VanDerWaalsContact C-N 3.25Å; P23-R25 PolarHBondContact O-N 3.04Å
24	L	47.8	Very low	52.3	Low	170 Å²	170	125.7 Å²	125.7	89%	0.89	69%	0.688	S	S	*	*			trans	-50.7	99.6	158.7	-96.5	120.1	0	0	0	107.3	V22 G26	V22-L24 PolarHBondContact O-N 3.28Å; V22-L24 VanDerWaalsContact O-N 3.14Å; L24-G26 PolarHBondContact O-N 3.43Å
25	R	52.1	Low	51.5	Low	249 Å²	249	124.3 Å²	124.3	94%	0.94	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	108.4	165.4	-90.4	-176.5	164	-168.2	-2.7	106.7	P23	P23-R25 VanDerWaalsContact C-N 3.25Å; P23-R25 PolarHBondContact O-N 3.04Å
26	G	45.4	Very low	50.6	Low	66 Å²	66	122.9 Å²	122.9	68%	0.68	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	172.2	-13.5	175.9	0	0	0	0	0	119.1	L24	L24-G26 PolarHBondContact O-N 3.43Å
27	H	44.5	Very low	50	Low	170 Å²	170	121 Å²	121	79%	0.787	68%	0.681	S	S	*	*			trans	-118.1	116.4	173.9	-77.9	-89.1	0	0	0	110.8	L29	H27-L29 HydrophobicContact CB-CD1 4.3Å; H27-L29 PolarHBondContact O-N 3.12Å
28	K	47	Very low	49.5	Very low	216 Å²	216	125.9 Å²	125.9	94%	0.939	70%	0.697	S	S	*	*			trans	-65.5	75.8	164.7	-164.3	-178.3	-169.6	-174.3	0	107.7
29	L	44.9	Very low	49.6	Very low	140 Å²	140	130.4 Å²	130.4	73%	0.733	71%	0.705	S	S	*	*			trans	-66	131.9	169.2	-84.4	130.8	0	0	0	107.4	H27 Q31	H27-L29 HydrophobicContact CB-CD1 4.3Å; H27-L29 PolarHBondContact O-N 3.12Å; L29-Q31 PolarHBondContact O-N 3.47Å; L29-Q31 VanDerWaalsContact O-N 3.11Å
30	P	46.4	Very low	50.1	Low	108 Å²	108	125.9 Å²	125.9	70%	0.701	69%	0.69	S	S	*	*			trans	-54.8	123.4	168.4	-13.3	25.5	0	0	0	106.8	V32	P30-V32 VanDerWaalsContact C-N 3.29Å; P30-V32 PolarHBondContact O-N 2.94Å
31	Q	44.8	Very low	51	Low	186 Å²	186	123 Å²	123	87%	0.869	67%	0.667	S	S	*	*			trans	-58.5	93.1	175.6	-179.3	176.1	-24.3	0	0	108.5	L29 D33	L29-Q31 PolarHBondContact O-N 3.47Å; L29-Q31 VanDerWaalsContact O-N 3.11Å; Q31-D33 PolarHBondContact O-N 3.47Å
32	V	53.1	Low	52.2	Low	109 Å²	109	124.3 Å²	124.3	66%	0.661	67%	0.67	S	S	*	*			trans	-85	108.2	168.8	-178.3	0	0	0	0	105.7	P30	P30-V32 VanDerWaalsContact C-N 3.29Å; P30-V32 PolarHBondContact O-N 2.94Å
33	D	47.6	Very low	53.3	Low	89 Å²	89	124.5 Å²	124.5	48%	0.476	66%	0.664	S	S	.	*			trans	-57.6	129.5	179.2	-156.1	16.3	0	0	0	109.6	Q31 L35 T36	Q31-D33 PolarHBondContact O-N 3.47Å; D33-L35 PolarHBondContact O-N 3.37Å; D33-T36 PolarHBondContact O-N 3.07Å; D33-T36 PolarHBondContact O-OG1 3.29Å
34	P	49.3	Very low	54.5	Low	113 Å²	113	119.3 Å²	119.3	73%	0.734	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-17	-179.2	-25	33.9	0	0	0	113.8
35	L	49.2	Very low	56	Low	119 Å²	119	115 Å²	115	62%	0.623	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-13.3	175.8	-130.6	73.6	0	0	0	114.4	D33 R39	D33-L35 PolarHBondContact O-N 3.37Å; L35-R39 PolarHBondContact O-NH1 2.57Å
36	T	47.6	Very low	57.3	Low	60 Å²	60	107.3 Å²	107.3	37%	0.368	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	-14.7	173.3	41.4	0	0	0	0	113	D33 H38 R39	D33-T36 PolarHBondContact O-N 3.07Å; D33-T36 PolarHBondContact O-OG1 3.29Å; T36-H38 PolarHBondContact O-N 3.02Å; T36-R39 PolarHBondContact O-N 3.44Å
37	A	48.3	Very low	58.8	Low	86 Å²	86	107 Å²	107	71%	0.711	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-24.7	171.7	0	0	0	0	0	113.2
38	H	50.8	Low	60.1	Low	182 Å²	182	99 Å²	99	84%	0.843	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-8.2	174.5	-163.5	66.2	0	0	0	113.6	T36	T36-H38 PolarHBondContact O-N 3.02Å
39	R	59.9	Low	61.4	Low	163 Å²	163	88.7 Å²	88.7	62%	0.615	49%	0.486	S	S	*	.	S	Bend	trans	-101	125.2	177.6	-68.2	-170.9	175.4	102.1	-6.5	108.2	L35 T36 D41	L35-R39 PolarHBondContact O-NH1 2.57Å; T36-R39 PolarHBondContact O-N 3.44Å; R39-D41 PolarHBondContact O-N 3.31Å
40	A	66.2	Low	63	Low	47 Å²	47	84.3 Å²	84.3	39%	0.388	47%	0.47	S	S	.	.			trans	-52.6	130.6	172.2	0	0	0	0	0	109.4	P42 W45 Y97	A40-P42 WeakPolarHBondContact O-CD 3.37Å; A40-W45 HydrophobicContact CB-CE3 4.06Å; A40-Y97 WeakPolarHBondContact CA-OH 3.46Å; A40-Y97 HydrophobicContact CB-CE2 4.43Å; A40-Y97 WeakPolarHBondContact CB-OH 3.42Å
41	D	75.4	Confident	64.2	Low	37 Å²	37	80.1 Å²	80.1	20%	0.198	44%	0.442	C	S	.	.			trans	-55.6	113.6	176.2	-179.1	-73.9	0	0	0	109.2	R39 Q43 C44 W45 Y97 R104	R39-D41 PolarHBondContact O-N 3.31Å; D41-Q43 PolarHBondContact O-N 3.01Å; D41-Q43 WeakPolarHBondContact OD1-CB 3.47Å; D41-Q43 PolarHBondContact OD1-N 3.39Å; D41-Q43 VanDerWaalsContact OD1-N 3.08Å; D41-C44 HydrophobicContact CB-CB 4.11Å; D41-C44 PolarHBondContact O-N 3.3Å; D41-C44 PolarHBondContact OD1-N 3.14Å; D41-W45 WeakPolarHBondContact O-CB 3.43Å; D41-W45 PolarHBondContact O-N 2.91Å; D41-Y97 PolarHBondContact N-OH 2.97Å; D41-Y97 VanDerWaalsContact N-OH 3.17Å; D41-R104 WeakPolarHBondContact OD2-CD 3.22Å; D41-R104 IonicContact OD2-CZ 3.46Å; D41-R104 IonicContact OD2-NE 3.16Å; D41-R104 PolarHBondContact OD2-NE 3.16Å; D41-R104 VanDerWaalsContact OD2-NE 3.16Å; D41-R104 IonicContact OD2-NH2 3.88Å
42	P	75.8	Confident	65.3	Low	94 Å²	94	71.7 Å²	71.7	61%	0.61	40%	0.402	S	S	*	.	H	α-helix	trans	-62.7	-33.3	-171.2	-23.6	33.3	0	0	0	112.5	A40 W45 D46	A40-P42 WeakPolarHBondContact O-CD 3.37Å; P42-W45 WeakPolarHBondContact O-CB 3.5Å; P42-W45 PolarHBondContact O-N 3.47Å; P42-D46 PolarHBondContact O-N 3.06Å
43	Q	73.9	Confident	66	Low	100 Å²	100	67.9 Å²	67.9	47%	0.467	38%	0.378	S	S	.	.	H	α-helix	trans	-74.8	-38.1	-177.3	-171	179.2	-9.7	0	0	111.5	D41 S47	D41-Q43 PolarHBondContact O-N 3.01Å; D41-Q43 WeakPolarHBondContact OD1-CB 3.47Å; D41-Q43 PolarHBondContact OD1-N 3.39Å; D41-Q43 VanDerWaalsContact OD1-N 3.08Å; Q43-S47 VanDerWaalsContact O-CB 3.22Å; Q43-S47 WeakPolarHBondContact O-CB 3.39Å; Q43-S47 PolarHBondContact O-N 3.27Å
44	C	75.4	Confident	66.8	Low	2 Å²	2	71.6 Å²	71.6	1%	0.014	39%	0.393	C	S	.	.	H	α-helix	trans	-70.5	-35.6	172.2	-84.2	0	0	0	0	112.2	D41 S48 Y97 C100 V101	D41-C44 HydrophobicContact CB-CB 4.11Å; D41-C44 PolarHBondContact O-N 3.3Å; D41-C44 PolarHBondContact OD1-N 3.14Å; C44-S48 WeakPolarHBondContact O-CB 3.35Å; C44-S48 PolarHBondContact O-N 2.96Å; C44-S48 PolarHBondContact O-OG 2.93Å; C44-Y97 HydrophobicContact CB-CD2 4.33Å; C44-Y97 HydrophobicContact CB-CE2 4.14Å; C44-C100 WeakPolarHBondContact CA-SG 3.41Å; C44-C100 HydrophobicContact CB-CB 3.75Å; C44-C100 WeakPolarHBondContact CB-SG 3.42Å; C44-C100 WeakPolarHBondContact SG-CB 2.93Å; C44-C100 CovalentContact SG-SG 2.05Å; C44-C100 PolarHBondContact SG-SG 3.42Å; C44-V101 HydrophobicContact CB-CG2 4.23Å
45	W	78.8	Confident	67.3	Low	79 Å²	79	68.4 Å²	68.4	30%	0.299	37%	0.368	S	S	.	.	H	α-helix	trans	-57.4	-55	173.2	-175.1	-90.1	0	0	0	111	A40 D41 P42 S47 S48 S49 W68 F93 Y97	A40-W45 HydrophobicContact CB-CE3 4.06Å; D41-W45 WeakPolarHBondContact O-CB 3.43Å; D41-W45 PolarHBondContact O-N 2.91Å; P42-W45 WeakPolarHBondContact O-CB 3.5Å; P42-W45 PolarHBondContact O-N 3.47Å; W45-S47 PolarHBondContact O-N 3.32Å; W45-S48 PolarHBondContact O-N 2.94Å; W45-S49 WeakPolarHBondContact O-CB 3.39Å; W45-S49 PolarHBondContact O-N 3.37Å; W45-S49 PolarHBondContact O-OG 3.33Å; W45-W68 HydrophobicContact CD2-CZ2 4.25Å; W45-W68 AromaticContact CE2-CE2 3.62Å; W45-W68 AromaticContact CE2-CZ2 3.45Å; W45-W68 VanDerWaalsContact CE2-CZ2 3.45Å; W45-W68 AromaticContact CE2-NE1 3.69Å; W45-W68 AromaticContact CH2-CH2 3.36Å; W45-W68 HydrophobicContact CH2-CH2 3.36Å; W45-W68 AromaticContact CH2-CZ2 3.41Å; W45-W68 HydrophobicContact CH2-CZ2 3.41Å; W45-W68 VanDerWaalsContact CH2-CZ2 3.41Å; W45-W68 HydrophobicContact CH2-CZ3 4.05Å; W45-W68 AromaticContact CZ2-CD2 3.94Å; W45-W68 HydrophobicContact CZ2-CD2 3.94Å; W45-W68 AromaticContact CZ2-CE2 3.27Å; W45-W68 HydrophobicContact CZ2-CE3 4.26Å; W45-W68 AromaticContact CZ2-CH2 3.42Å; W45-W68 HydrophobicContact CZ2-CH2 3.42Å; W45-W68 VanDerWaalsContact CZ2-CH2 3.42Å; W45-W68 AromaticContact CZ2-CZ2 2.99Å; W45-W68 HydrophobicContact CZ2-CZ2 2.99Å; W45-W68 HydrophobicContact CZ2-CZ3 4.03Å; W45-W68 AromaticContact CZ2-NE1 3.79Å; W45-W68 HydrophobicContact CZ3-CH2 4.22Å; W45-W68 HydrophobicContact CZ3-CZ2 4.19Å; W45-W68 AromaticContact NE1-CE2 3.75Å; W45-W68 AromaticContact NE1-CZ2 3.98Å; W45-W68 AromaticContact NE1-NE1 3.3Å; W45-F93 AromaticContact CD2-CZ 3.91Å; W45-F93 HydrophobicContact CD2-CZ 3.91Å; W45-F93 AromaticContact CE3-CE1 3.99Å; W45-F93 HydrophobicContact CE3-CE1 3.99Å; W45-F93 AromaticContact CE3-CZ 3.51Å; W45-F93 HydrophobicContact CE3-CZ 3.51Å; W45-F93 HydrophobicContact CH2-CE1 4.12Å; W45-F93 HydrophobicContact CH2-CZ 4.11Å; W45-F93 HydrophobicContact CZ2-CZ 4.48Å; W45-F93 AromaticContact CZ3-CE1 3.63Å; W45-F93 HydrophobicContact CZ3-CE1 3.63Å; W45-F93 AromaticContact CZ3-CZ 3.6Å; W45-F93 HydrophobicContact CZ3-CZ 3.6Å; W45-Y97 HydrophobicContact CE3-CE2 4.41Å
46	D	78.4	Confident	67.7	Low	87 Å²	87	64.5 Å²	64.5	47%	0.465	35%	0.345	S	S	.	.	H	α-helix	trans	-64.4	-42.9	-179.3	-69.3	-26	0	0	0	112.4	P42 S48 S49 A50	P42-D46 PolarHBondContact O-N 3.06Å; D46-S48 VanDerWaalsContact C-N 3.35Å; D46-S48 PolarHBondContact O-N 3.31Å; D46-S49 PolarHBondContact O-N 3.42Å; D46-A50 WeakPolarHBondContact O-CB 3.34Å; D46-A50 PolarHBondContact O-N 3.45Å
47	S	77.4	Confident	67.5	Low	60 Å²	60	66.4 Å²	66.4	42%	0.42	36%	0.362	S	S	.	.	H	α-helix	trans	-64.5	-39	178.6	-173.9	0	0	0	0	112.2	Q43 W45 L51	Q43-S47 VanDerWaalsContact O-CB 3.22Å; Q43-S47 WeakPolarHBondContact O-CB 3.39Å; Q43-S47 PolarHBondContact O-N 3.27Å; W45-S47 PolarHBondContact O-N 3.32Å; S47-L51 WeakPolarHBondContact O-CB 3.47Å; S47-L51 PolarHBondContact O-N 3.5Å; S47-L51 VanDerWaalsContact O-N 3.08Å
48	S	71.8	Confident	67.6	Low	1 Å²	1	67.4 Å²	67.4	1%	0.007	36%	0.361	C	S	.	.	H	α-helix	trans	-72.1	-41.1	-179.7	-56	0	0	0	0	110.8	C44 W45 D46 L52	C44-S48 WeakPolarHBondContact O-CB 3.35Å; C44-S48 PolarHBondContact O-N 2.96Å; C44-S48 PolarHBondContact O-OG 2.93Å; W45-S48 PolarHBondContact O-N 2.94Å; D46-S48 VanDerWaalsContact C-N 3.35Å; D46-S48 PolarHBondContact O-N 3.31Å; S48-L52 WeakPolarHBondContact O-CB 3.26Å; S48-L52 PolarHBondContact O-N 3.27Å
49	S	75.1	Confident	67.7	Low	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-63.5	-45.4	174.3	-64.8	0	0	0	0	111.9	W45 D46 L51 L52 L53 V64 W68	W45-S49 WeakPolarHBondContact O-CB 3.39Å; W45-S49 PolarHBondContact O-N 3.37Å; W45-S49 PolarHBondContact O-OG 3.33Å; D46-S49 PolarHBondContact O-N 3.42Å; S49-L51 PolarHBondContact O-N 3.04Å; S49-L52 PolarHBondContact O-N 3.15Å; S49-L53 WeakPolarHBondContact O-CG 3.3Å; S49-L53 PolarHBondContact O-N 2.78Å; S49-L53 VanDerWaalsContact O-N 3.16Å; S49-V64 VanDerWaalsContact CB-CG1 3.46Å; S49-W68 PolarHBondContact OG-NE1 2.98Å
50	A	77.5	Confident	67.3	Low	49 Å²	49	63 Å²	63	41%	0.405	34%	0.34	S	S	.	.	H	α-helix	trans	-62.2	-42.7	178.3	0	0	0	0	0	112.3	D46 L53 E54 V64	D46-A50 WeakPolarHBondContact O-CB 3.34Å; D46-A50 PolarHBondContact O-N 3.45Å; A50-L53 PolarHBondContact O-N 2.83Å; A50-E54 PolarHBondContact O-N 3.23Å; A50-E54 VanDerWaalsContact O-N 3.09Å; A50-V64 HydrophobicContact CB-CG2 4.39Å
51	L	71.9	Confident	66.5	Low	20 Å²	20	61.5 Å²	61.5	11%	0.105	33%	0.328	C	S	.	.	H	α-helix	trans	-63.1	-42.8	177	-178.2	62	0	0	0	111.8	S47 S49 L53 E54 M55 I96 V113 V116	S47-L51 WeakPolarHBondContact O-CB 3.47Å; S47-L51 PolarHBondContact O-N 3.5Å; S47-L51 VanDerWaalsContact O-N 3.08Å; S49-L51 PolarHBondContact O-N 3.04Å; L51-L53 PolarHBondContact O-N 3.36Å; L51-E54 PolarHBondContact O-N 3.06Å; L51-M55 HydrophobicContact CD1-CE 4.21Å; L51-M55 HydrophobicContact CD1-CG 4.18Å; L51-M55 HydrophobicContact CD1-SD 3.85Å; L51-M55 HydrophobicContact CD2-CE 4.21Å; L51-M55 HydrophobicContact CG-CE 3.65Å; L51-M55 HydrophobicContact CG-SD 3.95Å; L51-M55 WeakPolarHBondContact O-CE 3.24Å; L51-M55 WeakPolarHBondContact O-CG 3.29Å; L51-M55 PolarHBondContact O-N 2.86Å; L51-I96 HydrophobicContact CD2-CD1 4.45Å; L51-I96 HydrophobicContact CD2-CG2 3.87Å; L51-V113 HydrophobicContact CD1-CG1 3.34Å; L51-V113 HydrophobicContact CD2-CG1 3.53Å; L51-V113 HydrophobicContact CG-CG1 4.03Å; L51-V116 HydrophobicContact CD2-CB 4.36Å; L51-V116 HydrophobicContact CD2-CG1 4Å
52	L	68.7	Low	65.6	Low	8 Å²	8	65 Å²	65	4%	0.042	35%	0.347	C	S	.	.	H	α-helix	trans	-60.3	-34.6	177.5	-171.5	64.7	0	0	0	112.3	S48 S49 F67 V92 F93 I96	S48-L52 WeakPolarHBondContact O-CB 3.26Å; S48-L52 PolarHBondContact O-N 3.27Å; S49-L52 PolarHBondContact O-N 3.15Å; L52-F67 HydrophobicContact CD2-CD2 4.28Å; L52-F67 HydrophobicContact CD2-CE1 4.27Å; L52-F67 HydrophobicContact CD2-CE2 3.39Å; L52-F67 HydrophobicContact CD2-CZ 3.39Å; L52-F67 HydrophobicContact CG-CE2 4.36Å; L52-V92 HydrophobicContact CD1-CB 4.25Å; L52-V92 HydrophobicContact CD1-CG1 3.57Å; L52-F93 HydrophobicContact CD2-CB 4.15Å; L52-F93 HydrophobicContact CD2-CD2 4.49Å; L52-I96 HydrophobicContact CD1-CD1 4.28Å
53	L	66.8	Low	65.1	Low	29 Å²	29	64 Å²	64	15%	0.152	34%	0.339	C	S	.	.	H	α-helix	trans	-72.4	-39.8	176	-67.4	173.7	0	0	0	112.8	S49 A50 L51 M55 A61 T63 V64 F67	S49-L53 WeakPolarHBondContact O-CG 3.3Å; S49-L53 PolarHBondContact O-N 2.78Å; S49-L53 VanDerWaalsContact O-N 3.16Å; A50-L53 PolarHBondContact O-N 2.83Å; L51-L53 PolarHBondContact O-N 3.36Å; L53-M55 VanDerWaalsContact C-N 3.29Å; L53-M55 PolarHBondContact O-N 3.42Å; L53-A61 HydrophobicContact CD2-CB 4Å; L53-A61 WeakPolarHBondContact CD2-O 3.25Å; L53-T63 WeakPolarHBondContact CD1-O 3.39Å; L53-V64 HydrophobicContact CD1-CG2 4.19Å; L53-F67 HydrophobicContact CD2-CB 3.86Å; L53-F67 HydrophobicContact CD2-CD2 4.31Å; L53-F67 HydrophobicContact CD2-CG 4.41Å; L53-F67 HydrophobicContact CG-CB 4.49Å
54	E	65.4	Low	64.8	Low	167 Å²	167	60.7 Å²	60.7	78%	0.78	33%	0.325	S	S	*	.	H	α-helix	trans	-65.7	-33.1	179.8	-169.8	174.7	175.8	0	0	112.2	A50 L51	A50-E54 PolarHBondContact O-N 3.23Å; A50-E54 VanDerWaalsContact O-N 3.09Å; L51-E54 PolarHBondContact O-N 3.06Å
55	M	58.3	Low	64.7	Low	46 Å²	46	64.6 Å²	64.6	23%	0.227	35%	0.351	C	S	.	.	H	α-helix	trans	-88.3	-11.3	-173.4	-64	-176.5	-52.7	0	0	114.7	L51 L53 I96 V116 I120	L51-M55 HydrophobicContact CD1-CE 4.21Å; L51-M55 HydrophobicContact CD1-CG 4.18Å; L51-M55 HydrophobicContact CD1-SD 3.85Å; L51-M55 HydrophobicContact CD2-CE 4.21Å; L51-M55 HydrophobicContact CG-CE 3.65Å; L51-M55 HydrophobicContact CG-SD 3.95Å; L51-M55 WeakPolarHBondContact O-CE 3.24Å; L51-M55 WeakPolarHBondContact O-CG 3.29Å; L51-M55 PolarHBondContact O-N 2.86Å; L53-M55 VanDerWaalsContact C-N 3.29Å; L53-M55 PolarHBondContact O-N 3.42Å; M55-I96 HydrophobicContact CE-CD1 3.84Å; M55-V116 HydrophobicContact CE-CG1 3.7Å; M55-V116 HydrophobicContact SD-CG1 3.96Å; M55-I120 HydrophobicContact CE-CD1 3.44Å; M55-I120 VanDerWaalsContact CE-CD1 3.44Å; M55-I120 HydrophobicContact SD-CD1 4.17Å
56	R	58.3	Low	64.2	Low	37 Å²	37	62.5 Å²	62.5	14%	0.14	35%	0.35	C	S	.	.			trans	-108	92	-173	-151.3	162.6	-178.6	153.6	-11.9	111.4	P58 I60 L89	R56-P58 CarbonylContact O-C 3.21Å; R56-P58 VanDerWaalsContact O-C 3.29Å; R56-I60 VanDerWaalsContact CD-CD1 3.43Å; R56-I60 HydrophobicContact CG-CD1 3.92Å; R56-I60 HydrophobicContact CG-CG1 4.12Å; R56-L89 VanDerWaalsContact CZ-CD2 3.4Å
57	S	43.6	Very low	64.2	Low	101 Å²	101	58.4 Å²	58.4	71%	0.706	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	126	163.7	-173.6	0	0	0	0	108.9
58	P	50.7	Low	64.5	Low	107 Å²	107	58.8 Å²	58.8	70%	0.695	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	cis	-83.8	148.6	5.2	34.7	-31.3	0	0	0	111.4	R56 I60	R56-P58 CarbonylContact O-C 3.21Å; R56-P58 VanDerWaalsContact O-C 3.29Å; P58-I60 VanDerWaalsContact O-CG1 3.32Å; P58-I60 WeakPolarHBondContact O-CG1 3.38Å; P58-I60 PolarHBondContact O-N 3.31Å
59	R	51.9	Low	64.8	Low	197 Å²	197	64 Å²	64	74%	0.743	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	103	-172	-59.5	-167.1	-176.3	-170.6	-2.6	111	A61 D62	R59-A61 PolarHBondContact O-N 3.24Å; R59-D62 WeakPolarHBondContact CD-OD1 3.32Å; R59-D62 IonicContact CZ-OD1 3.64Å; R59-D62 IonicContact NE-OD1 3.73Å; R59-D62 IonicContact NH1-OD1 2.75Å; R59-D62 PolarHBondContact NH1-OD1 2.89Å
60	I	53	Low	65.1	Low	56 Å²	56	66 Å²	66	29%	0.287	36%	0.359	S	S	.	.	S	Bend	trans	-69.9	-27.2	178.7	-66.2	-157.5	0	0	0	110.5	R56 P58 L70	R56-I60 VanDerWaalsContact CD-CD1 3.43Å; R56-I60 HydrophobicContact CG-CD1 3.92Å; R56-I60 HydrophobicContact CG-CG1 4.12Å; P58-I60 VanDerWaalsContact O-CG1 3.32Å; P58-I60 WeakPolarHBondContact O-CG1 3.38Å; P58-I60 PolarHBondContact O-N 3.31Å; I60-L70 HydrophobicContact CB-CD2 4.39Å; I60-L70 HydrophobicContact CG2-CD2 2.93Å; I60-L70 HydrophobicContact CG2-CG 4.42Å
61	A	48.9	Very low	65.3	Low	15 Å²	15	64.1 Å²	64.1	12%	0.124	34%	0.341	C	S	.	.			trans	-163.7	148.5	167.1	0	0	0	0	0	109.7	L53 R59 A66 F67	L53-A61 HydrophobicContact CD2-CB 4Å; L53-A61 WeakPolarHBondContact CD2-O 3.25Å; R59-A61 PolarHBondContact O-N 3.24Å; A61-A66 VanDerWaalsContact CB-C 3.46Å; A61-A66 HydrophobicContact CB-CB 3.68Å; A61-F67 HydrophobicContact CB-CB 4.2Å
62	D	55.3	Low	65.9	Low	111 Å²	111	65 Å²	65	59%	0.594	36%	0.356	S	S	*	.	S	Bend	trans	-84.6	-13.4	-178.6	-71.4	-58.1	0	0	0	113.6	R59	R59-D62 WeakPolarHBondContact CD-OD1 3.32Å; R59-D62 IonicContact CZ-OD1 3.64Å; R59-D62 IonicContact NE-OD1 3.73Å; R59-D62 IonicContact NH1-OD1 2.75Å; R59-D62 PolarHBondContact NH1-OD1 2.89Å
63	T	65.5	Low	66.5	Low	73 Å²	73	68.4 Å²	68.4	45%	0.448	38%	0.377	S	S	.	.	S	Bend	trans	-141.1	155.5	-175.4	67.4	0	0	0	0	111.8	L53 A66 F67	L53-T63 WeakPolarHBondContact CD1-O 3.39Å; T63-A66 PolarHBondContact O-N 3.49Å; T63-A66 WeakPolarHBondContact OG1-CB 3.49Å; T63-A66 PolarHBondContact OG1-N 2.79Å; T63-F67 PolarHBondContact O-N 3.06Å
64	V	68	Low	67.3	Low	30 Å²	30	67.4 Å²	67.4	18%	0.182	37%	0.372	C	S	.	.	H	α-helix	trans	-55.3	-44	177.6	172.6	0	0	0	0	112.4	S49 A50 L53 F67 W68	S49-V64 VanDerWaalsContact CB-CG1 3.46Å; A50-V64 HydrophobicContact CB-CG2 4.39Å; L53-V64 HydrophobicContact CD1-CG2 4.19Å; V64-F67 WeakPolarHBondContact O-CB 3.45Å; V64-F67 PolarHBondContact O-N 3.12Å; V64-W68 PolarHBondContact O-N 2.69Å
65	P	73.9	Confident	68.2	Low	84 Å²	84	68.8 Å²	68.8	55%	0.545	37%	0.37	S	S	.	.	H	α-helix	trans	-60.5	-46.2	175	-25.1	35.8	0	0	0	112.8	F67 W68 D69	P65-F67 PolarHBondContact O-N 3.16Å; P65-W68 PolarHBondContact O-N 3.46Å; P65-D69 PolarHBondContact O-N 3.46Å
66	A	68.4	Low	69.5	Low	34 Å²	34	71.1 Å²	71.1	28%	0.281	39%	0.391	S	S	.	.	H	α-helix	trans	-63.8	-29.1	179.9	0	0	0	0	0	112.8	A61 T63 L70	A61-A66 VanDerWaalsContact CB-C 3.46Å; A61-A66 HydrophobicContact CB-CB 3.68Å; T63-A66 PolarHBondContact O-N 3.49Å; T63-A66 WeakPolarHBondContact OG1-CB 3.49Å; T63-A66 PolarHBondContact OG1-N 2.79Å; A66-L70 PolarHBondContact O-N 3.08Å; A66-L70 VanDerWaalsContact O-N 3.07Å
67	F	78	Confident	70.8	Confident	2 Å²	2	71.4 Å²	71.4	1%	0.009	40%	0.398	C	S	.	.	H	α-helix	trans	-64.4	-45.6	170.7	166.3	-96.3	0	0	0	112	L52 L53 A61 T63 V64 P65 L70 M71 L89	L52-F67 HydrophobicContact CD2-CD2 4.28Å; L52-F67 HydrophobicContact CD2-CE1 4.27Å; L52-F67 HydrophobicContact CD2-CE2 3.39Å; L52-F67 HydrophobicContact CD2-CZ 3.39Å; L52-F67 HydrophobicContact CG-CE2 4.36Å; L53-F67 HydrophobicContact CD2-CB 3.86Å; L53-F67 HydrophobicContact CD2-CD2 4.31Å; L53-F67 HydrophobicContact CD2-CG 4.41Å; L53-F67 HydrophobicContact CG-CB 4.49Å; A61-F67 HydrophobicContact CB-CB 4.2Å; T63-F67 PolarHBondContact O-N 3.06Å; V64-F67 WeakPolarHBondContact O-CB 3.45Å; V64-F67 PolarHBondContact O-N 3.12Å; P65-F67 PolarHBondContact O-N 3.16Å; F67-L70 WeakPolarHBondContact O-CB 3.36Å; F67-L70 PolarHBondContact O-N 3.08Å; F67-M71 HydrophobicContact CD1-CG 4.37Å; F67-M71 HydrophobicContact CE1-CG 3.82Å; F67-M71 HydrophobicContact CE2-CG 4.07Å; F67-M71 HydrophobicContact CE2-SD 4.4Å; F67-M71 HydrophobicContact CZ-CG 3.65Å; F67-M71 HydrophobicContact CZ-SD 4.11Å; F67-M71 WeakPolarHBondContact O-CG 3.32Å; F67-M71 PolarHBondContact O-N 3.46Å; F67-L89 HydrophobicContact CE2-CD2 3.94Å
68	W	82.5	Confident	72.7	Confident	67 Å²	67	76.2 Å²	76.2	25%	0.254	41%	0.409	S	S	.	.	H	α-helix	trans	-71.6	-32.7	179.8	-71.8	112.9	0	0	0	112.4	W45 S49 V64 P65 L70 M71 G72 F93	W45-W68 HydrophobicContact CD2-CZ2 4.25Å; W45-W68 AromaticContact CE2-CE2 3.62Å; W45-W68 AromaticContact CE2-CZ2 3.45Å; W45-W68 VanDerWaalsContact CE2-CZ2 3.45Å; W45-W68 AromaticContact CE2-NE1 3.69Å; W45-W68 AromaticContact CH2-CH2 3.36Å; W45-W68 HydrophobicContact CH2-CH2 3.36Å; W45-W68 AromaticContact CH2-CZ2 3.41Å; W45-W68 HydrophobicContact CH2-CZ2 3.41Å; W45-W68 VanDerWaalsContact CH2-CZ2 3.41Å; W45-W68 HydrophobicContact CH2-CZ3 4.05Å; W45-W68 AromaticContact CZ2-CD2 3.94Å; W45-W68 HydrophobicContact CZ2-CD2 3.94Å; W45-W68 AromaticContact CZ2-CE2 3.27Å; W45-W68 HydrophobicContact CZ2-CE3 4.26Å; W45-W68 AromaticContact CZ2-CH2 3.42Å; W45-W68 HydrophobicContact CZ2-CH2 3.42Å; W45-W68 VanDerWaalsContact CZ2-CH2 3.42Å; W45-W68 AromaticContact CZ2-CZ2 2.99Å; W45-W68 HydrophobicContact CZ2-CZ2 2.99Å; W45-W68 HydrophobicContact CZ2-CZ3 4.03Å; W45-W68 AromaticContact CZ2-NE1 3.79Å; W45-W68 HydrophobicContact CZ3-CH2 4.22Å; W45-W68 HydrophobicContact CZ3-CZ2 4.19Å; W45-W68 AromaticContact NE1-CE2 3.75Å; W45-W68 AromaticContact NE1-CZ2 3.98Å; W45-W68 AromaticContact NE1-NE1 3.3Å; S49-W68 PolarHBondContact OG-NE1 2.98Å; V64-W68 PolarHBondContact O-N 2.69Å; P65-W68 PolarHBondContact O-N 3.46Å; W68-L70 VanDerWaalsContact C-N 3.33Å; W68-M71 HydrophobicContact CE3-CB 4.03Å; W68-M71 HydrophobicContact CE3-CG 4.15Å; W68-M71 HydrophobicContact CZ3-CB 4.46Å; W68-M71 HydrophobicContact CZ3-CG 4.35Å; W68-M71 PolarHBondContact O-N 3.04Å; W68-G72 PolarHBondContact O-N 3.47Å; W68-F93 AromaticContact CH2-CD1 3.93Å; W68-F93 HydrophobicContact CH2-CD1 3.93Å; W68-F93 HydrophobicContact CH2-CD2 4.31Å; W68-F93 AromaticContact CH2-CE1 3.74Å; W68-F93 HydrophobicContact CH2-CE1 3.74Å; W68-F93 HydrophobicContact CH2-CE2 4.13Å; W68-F93 HydrophobicContact CH2-CG 4.21Å; W68-F93 AromaticContact CH2-CZ 3.86Å; W68-F93 HydrophobicContact CH2-CZ 3.86Å; W68-F93 HydrophobicContact CZ2-CD1 4.38Å; W68-F93 HydrophobicContact CZ2-CD2 4.06Å; W68-F93 AromaticContact CZ2-CE1 3.96Å; W68-F93 HydrophobicContact CZ2-CE1 3.96Å; W68-F93 AromaticContact CZ2-CE2 3.6Å; W68-F93 HydrophobicContact CZ2-CE2 3.6Å; W68-F93 HydrophobicContact CZ2-CG 4.43Å; W68-F93 AromaticContact CZ2-CZ 3.55Å; W68-F93 HydrophobicContact CZ2-CZ 3.55Å
69	D	79.6	Confident	74.2	Confident	111 Å²	111	74.5 Å²	74.5	59%	0.594	39%	0.394	S	S	*	.	H	α-helix	trans	-60.5	-44.2	170.2	-66.5	-25.8	0	0	0	110.7	P65 G72 T73	P65-D69 PolarHBondContact O-N 3.46Å; D69-G72 WeakPolarHBondContact O-CA 3.36Å; D69-G72 PolarHBondContact O-N 2.97Å; D69-T73 WeakPolarHBondContact O-CG2 3.47Å; D69-T73 PolarHBondContact O-N 3.45Å
70	L	80.3	Confident	75.5	Confident	43 Å²	43	67.7 Å²	67.7	23%	0.225	39%	0.386	C	S	.	.	H	α-helix	trans	-63.2	-44.2	172.8	177.2	74.6	0	0	0	112.3	I60 A66 F67 W68 G72 T73 L74	I60-L70 HydrophobicContact CB-CD2 4.39Å; I60-L70 HydrophobicContact CG2-CD2 2.93Å; I60-L70 HydrophobicContact CG2-CG 4.42Å; A66-L70 PolarHBondContact O-N 3.08Å; A66-L70 VanDerWaalsContact O-N 3.07Å; F67-L70 WeakPolarHBondContact O-CB 3.36Å; F67-L70 PolarHBondContact O-N 3.08Å; W68-L70 VanDerWaalsContact C-N 3.33Å; L70-G72 PolarHBondContact O-N 2.74Å; L70-T73 WeakPolarHBondContact CA-OG1 3.25Å; L70-T73 PolarHBondContact O-N 3.39Å; L70-T73 VanDerWaalsContact O-N 3.15Å; L70-T73 PolarHBondContact O-OG1 2.98Å; L70-L74 HydrophobicContact CD1-CD1 4.24Å; L70-L74 HydrophobicContact CD1-CG 4.08Å; L70-L74 HydrophobicContact CD2-CD1 4.22Å; L70-L74 HydrophobicContact CG-CD1 3.82Å; L70-L74 HydrophobicContact CG-CG 4.11Å; L70-L74 WeakPolarHBondContact O-CB 3.48Å; L70-L74 VanDerWaalsContact O-CG 3.25Å; L70-L74 WeakPolarHBondContact O-CG 3.4Å; L70-L74 PolarHBondContact O-N 3.11Å
71	M	82.6	Confident	76.7	Confident	8 Å²	8	72.2 Å²	72.2	4%	0.039	40%	0.404	C	S	.	.	H	α-helix	trans	-58.7	-35.9	175.5	-73.2	-65.5	-76.4	0	0	111.3	F67 W68 L74 R75 F86 L89 A90	F67-M71 HydrophobicContact CD1-CG 4.37Å; F67-M71 HydrophobicContact CE1-CG 3.82Å; F67-M71 HydrophobicContact CE2-CG 4.07Å; F67-M71 HydrophobicContact CE2-SD 4.4Å; F67-M71 HydrophobicContact CZ-CG 3.65Å; F67-M71 HydrophobicContact CZ-SD 4.11Å; F67-M71 WeakPolarHBondContact O-CG 3.32Å; F67-M71 PolarHBondContact O-N 3.46Å; W68-M71 HydrophobicContact CE3-CB 4.03Å; W68-M71 HydrophobicContact CE3-CG 4.15Å; W68-M71 HydrophobicContact CZ3-CB 4.46Å; W68-M71 HydrophobicContact CZ3-CG 4.35Å; W68-M71 PolarHBondContact O-N 3.04Å; M71-L74 HydrophobicContact SD-CD1 4.5Å; M71-R75 VanDerWaalsContact O-CB 3.24Å; M71-R75 WeakPolarHBondContact O-CB 3.28Å; M71-R75 PolarHBondContact O-N 3.1Å; M71-F86 HydrophobicContact CB-CE2 4.46Å; M71-F86 HydrophobicContact CE-CD2 3.48Å; M71-F86 VanDerWaalsContact CE-CD2 3.48Å; M71-F86 HydrophobicContact CE-CE2 3.44Å; M71-F86 VanDerWaalsContact CE-CE2 3.44Å; M71-F86 HydrophobicContact CE-CG 4.24Å; M71-F86 HydrophobicContact CE-CZ 4.16Å; M71-F86 WeakPolarHBondContact O-CD2 3.25Å; M71-F86 HydrophobicContact SD-CD2 4Å; M71-F86 HydrophobicContact SD-CE2 4.4Å; M71-L89 HydrophobicContact CE-CB 4.05Å; M71-L89 HydrophobicContact SD-CB 3.52Å; M71-L89 VanDerWaalsContact SD-CB 3.52Å; M71-L89 HydrophobicContact SD-CD1 3.79Å; M71-L89 HydrophobicContact SD-CG 4.22Å; M71-A90 HydrophobicContact CE-CB 4.01Å
72	G	83.8	Confident	78.1	Confident	39 Å²	39	75 Å²	75	40%	0.402	41%	0.414	S	S	.	.	H	α-helix	trans	-62.9	-47.9	172.2	0	0	0	0	0	112.8	W68 D69 L70 R75 S76	W68-G72 PolarHBondContact O-N 3.47Å; D69-G72 WeakPolarHBondContact O-CA 3.36Å; D69-G72 PolarHBondContact O-N 2.97Å; L70-G72 PolarHBondContact O-N 2.74Å; G72-R75 PolarHBondContact O-N 2.87Å; G72-S76 PolarHBondContact O-N 3.26Å; G72-S76 PolarHBondContact O-OG 2.87Å
73	T	81.8	Confident	79.3	Confident	80 Å²	80	71.6 Å²	71.6	49%	0.491	40%	0.401	S	S	.	.	H	α-helix	trans	-68.5	-36.6	179.7	60.1	0	0	0	0	112.9	D69 L70 R75 S76 S77	D69-T73 WeakPolarHBondContact O-CG2 3.47Å; D69-T73 PolarHBondContact O-N 3.45Å; L70-T73 WeakPolarHBondContact CA-OG1 3.25Å; L70-T73 PolarHBondContact O-N 3.39Å; L70-T73 VanDerWaalsContact O-N 3.15Å; L70-T73 PolarHBondContact O-OG1 2.98Å; T73-R75 VanDerWaalsContact C-N 3.35Å; T73-S76 PolarHBondContact O-N 3.3Å; T73-S76 PolarHBondContact O-OG 2.97Å; T73-S77 PolarHBondContact O-N 3.24Å
74	L	82.6	Confident	80	Confident	8 Å²	8	70.6 Å²	70.6	4%	0.042	40%	0.4	C	S	.	.	H	α-helix	trans	-66.9	-38.5	175.1	-68.5	169.9	0	0	0	111.7	L70 M71 H82 L85 F86 L89	L70-L74 HydrophobicContact CD1-CD1 4.24Å; L70-L74 HydrophobicContact CD1-CG 4.08Å; L70-L74 HydrophobicContact CD2-CD1 4.22Å; L70-L74 HydrophobicContact CG-CD1 3.82Å; L70-L74 HydrophobicContact CG-CG 4.11Å; L70-L74 WeakPolarHBondContact O-CB 3.48Å; L70-L74 VanDerWaalsContact O-CG 3.25Å; L70-L74 WeakPolarHBondContact O-CG 3.4Å; L70-L74 PolarHBondContact O-N 3.11Å; M71-L74 HydrophobicContact SD-CD1 4.5Å; L74-H82 HydrophobicContact CD2-CB 3.85Å; L74-L85 HydrophobicContact CD1-CB 4.47Å; L74-L85 HydrophobicContact CD1-CD2 3.73Å; L74-L85 HydrophobicContact CD1-CG 4.36Å; L74-L85 HydrophobicContact CD2-CB 4.36Å; L74-L85 HydrophobicContact CD2-CD2 3.75Å; L74-L85 HydrophobicContact CG-CD2 4.4Å; L74-F86 HydrophobicContact CB-CB 4.06Å; L74-F86 HydrophobicContact CB-CD2 4.47Å; L74-L89 HydrophobicContact CD1-CD1 3.51Å
75	R	86.1	Confident	80.5	Confident	195 Å²	195	70.8 Å²	70.8	74%	0.736	40%	0.4	S	S	*	.	H	α-helix	trans	-69.9	-35.5	178.5	-176.4	177.2	180	-175.6	0.9	112.6	M71 G72 T73 S77 F86	M71-R75 VanDerWaalsContact O-CB 3.24Å; M71-R75 WeakPolarHBondContact O-CB 3.28Å; M71-R75 PolarHBondContact O-N 3.1Å; G72-R75 PolarHBondContact O-N 2.87Å; T73-R75 VanDerWaalsContact C-N 3.35Å; R75-S77 VanDerWaalsContact C-N 3.31Å; R75-F86 HydrophobicContact CB-CD2 3.96Å; R75-F86 HydrophobicContact CB-CE2 3.85Å; R75-F86 HydrophobicContact CB-CZ 4.45Å; R75-F86 HydrophobicContact CG-CE2 4.31Å; R75-F86 HydrophobicContact CG-CZ 4.44Å
76	S	85.4	Confident	80.8	Confident	96 Å²	96	68.5 Å²	68.5	67%	0.671	38%	0.382	S	S	*	.	H	α-helix	trans	-81.7	-10.3	179.9	63.9	0	0	0	0	113.6	G72 T73	G72-S76 PolarHBondContact O-N 3.26Å; G72-S76 PolarHBondContact O-OG 2.87Å; T73-S76 PolarHBondContact O-N 3.3Å; T73-S76 PolarHBondContact O-OG 2.97Å
77	S	84.2	Confident	81.5	Confident	42 Å²	42	75 Å²	75	29%	0.294	40%	0.399	S	S	.	.			trans	-80.8	136.3	178.9	-169.3	0	0	0	0	112.3	T73 R75 D79 H82	T73-S77 PolarHBondContact O-N 3.24Å; R75-S77 VanDerWaalsContact C-N 3.31Å; S77-D79 VanDerWaalsContact C-N 3.28Å; S77-D79 PolarHBondContact O-N 2.89Å; S77-D79 PolarHBondContact OG-N 3.36Å; S77-H82 WeakPolarHBondContact CB-ND1 3.43Å; S77-H82 PolarHBondContact OG-ND1 3.39Å
78	E	83.6	Confident	81.5	Confident	202 Å²	202	77.9 Å²	77.9	94%	0.944	41%	0.414	S	S	*	.			trans	-80.1	-3.7	174.9	-71.2	-177.5	147.3	0	0	113.8	G80	E78-G80 PolarHBondContact O-N 2.84Å
79	D	83.8	Confident	81.3	Confident	71 Å²	71	74.8 Å²	74.8	38%	0.38	40%	0.403	S	S	.	.			trans	-72.9	122.2	175.9	-170.4	-20.4	0	0	0	110.4	S77 K81 H82 A83	S77-D79 VanDerWaalsContact C-N 3.28Å; S77-D79 PolarHBondContact O-N 2.89Å; S77-D79 PolarHBondContact OG-N 3.36Å; D79-K81 PolarHBondContact O-N 2.98Å; D79-K81 VanDerWaalsContact O-N 3.08Å; D79-K81 WeakPolarHBondContact OD1-CB 3.47Å; D79-K81 WeakPolarHBondContact OD1-CG 3.39Å; D79-K81 PolarHBondContact OD1-N 3.18Å; D79-H82 HydrophobicContact CB-CB 4.41Å; D79-H82 WeakPolarHBondContact O-CB 3.4Å; D79-H82 PolarHBondContact O-N 3.47Å; D79-A83 PolarHBondContact O-N 3.48Å; D79-A83 VanDerWaalsContact O-N 3.12Å
80	G	77.7	Confident	81.5	Confident	55 Å²	55	70.7 Å²	70.7	57%	0.567	39%	0.385	S	S	*	.	H	α-helix	trans	-56.3	-25.1	175.7	0	0	0	0	0	113.8	E78 A84	E78-G80 PolarHBondContact O-N 2.84Å; G80-A84 PolarHBondContact O-N 2.99Å
81	K	78.7	Confident	81.6	Confident	151 Å²	151	75.5 Å²	75.5	66%	0.657	40%	0.4	S	S	*	.	H	α-helix	trans	-70.9	-38.3	173.8	-63.8	174.5	-176.8	170.4	0	112.3	D79 A84 L85	D79-K81 PolarHBondContact O-N 2.98Å; D79-K81 VanDerWaalsContact O-N 3.08Å; D79-K81 WeakPolarHBondContact OD1-CB 3.47Å; D79-K81 WeakPolarHBondContact OD1-CG 3.39Å; D79-K81 PolarHBondContact OD1-N 3.18Å; K81-A84 PolarHBondContact O-N 2.86Å; K81-L85 PolarHBondContact O-N 3.03Å
82	H	79.3	Confident	81.3	Confident	74 Å²	74	75.6 Å²	75.6	34%	0.343	40%	0.401	S	S	.	.	H	α-helix	trans	-69.2	-38.3	175.3	-66.3	146	0	0	0	111.2	L74 S77 D79 L85 F86	L74-H82 HydrophobicContact CD2-CB 3.85Å; S77-H82 WeakPolarHBondContact CB-ND1 3.43Å; S77-H82 PolarHBondContact OG-ND1 3.39Å; D79-H82 HydrophobicContact CB-CB 4.41Å; D79-H82 WeakPolarHBondContact O-CB 3.4Å; D79-H82 PolarHBondContact O-N 3.47Å; H82-L85 PolarHBondContact O-N 2.86Å; H82-F86 WeakPolarHBondContact O-CB 3.23Å; H82-F86 PolarHBondContact O-N 3.21Å
83	A	80	Confident	81.2	Confident	38 Å²	38	74.2 Å²	74.2	31%	0.314	38%	0.384	S	S	.	.	H	α-helix	trans	-60.5	-45.6	172.2	0	0	0	0	0	111.9	D79 L85 F86 W87	D79-A83 PolarHBondContact O-N 3.48Å; D79-A83 VanDerWaalsContact O-N 3.12Å; A83-L85 VanDerWaalsContact C-N 3.33Å; A83-L85 PolarHBondContact O-N 3.28Å; A83-F86 WeakPolarHBondContact O-CB 3.35Å; A83-F86 PolarHBondContact O-N 3.24Å; A83-W87 PolarHBondContact O-N 2.9Å
84	A	80.1	Confident	81.2	Confident	52 Å²	52	77.6 Å²	77.6	43%	0.43	39%	0.388	S	S	.	.	H	α-helix	trans	-59.2	-44.5	175.6	0	0	0	0	0	111.8	G80 K81 F86 W87 D88	G80-A84 PolarHBondContact O-N 2.99Å; K81-A84 PolarHBondContact O-N 2.86Å; A84-F86 PolarHBondContact O-N 2.63Å; A84-W87 PolarHBondContact O-N 3.23Å; A84-D88 PolarHBondContact O-N 3.32Å
85	L	77.9	Confident	80.8	Confident	35 Å²	35	81 Å²	81	18%	0.183	40%	0.403	C	S	.	.	H	α-helix	trans	-61.8	-44	177.3	-158.8	82.4	0	0	0	112.2	L74 K81 H82 A83 D88 L89 F127	L74-L85 HydrophobicContact CD1-CB 4.47Å; L74-L85 HydrophobicContact CD1-CD2 3.73Å; L74-L85 HydrophobicContact CD1-CG 4.36Å; L74-L85 HydrophobicContact CD2-CB 4.36Å; L74-L85 HydrophobicContact CD2-CD2 3.75Å; L74-L85 HydrophobicContact CG-CD2 4.4Å; K81-L85 PolarHBondContact O-N 3.03Å; H82-L85 PolarHBondContact O-N 2.86Å; A83-L85 VanDerWaalsContact C-N 3.33Å; A83-L85 PolarHBondContact O-N 3.28Å; L85-D88 PolarHBondContact O-N 3.23Å; L85-L89 HydrophobicContact CD2-CD1 4.05Å; L85-L89 HydrophobicContact CG-CD1 3.94Å; L85-L89 WeakPolarHBondContact O-CB 3.14Å; L85-L89 WeakPolarHBondContact O-CD1 3.44Å; L85-L89 VanDerWaalsContact O-CG 3.29Å; L85-L89 WeakPolarHBondContact O-CG 3.11Å; L85-L89 PolarHBondContact O-N 3.08Å; L85-F127 HydrophobicContact CD1-CD2 3.91Å; L85-F127 HydrophobicContact CD1-CE2 3.54Å
86	F	80.8	Confident	80.3	Confident	36 Å²	36	72.2 Å²	72.2	16%	0.158	37%	0.371	C	S	.	.	H	α-helix	trans	-57.4	-49.1	176.2	172.7	-92.1	0	0	0	111	M71 L74 R75 H82 A83 A84 D88 L89 A90	M71-F86 HydrophobicContact CB-CE2 4.46Å; M71-F86 HydrophobicContact CE-CD2 3.48Å; M71-F86 VanDerWaalsContact CE-CD2 3.48Å; M71-F86 HydrophobicContact CE-CE2 3.44Å; M71-F86 VanDerWaalsContact CE-CE2 3.44Å; M71-F86 HydrophobicContact CE-CG 4.24Å; M71-F86 HydrophobicContact CE-CZ 4.16Å; M71-F86 WeakPolarHBondContact O-CD2 3.25Å; M71-F86 HydrophobicContact SD-CD2 4Å; M71-F86 HydrophobicContact SD-CE2 4.4Å; L74-F86 HydrophobicContact CB-CB 4.06Å; L74-F86 HydrophobicContact CB-CD2 4.47Å; R75-F86 HydrophobicContact CB-CD2 3.96Å; R75-F86 HydrophobicContact CB-CE2 3.85Å; R75-F86 HydrophobicContact CB-CZ 4.45Å; R75-F86 HydrophobicContact CG-CE2 4.31Å; R75-F86 HydrophobicContact CG-CZ 4.44Å; H82-F86 WeakPolarHBondContact O-CB 3.23Å; H82-F86 PolarHBondContact O-N 3.21Å; A83-F86 WeakPolarHBondContact O-CB 3.35Å; A83-F86 PolarHBondContact O-N 3.24Å; A84-F86 PolarHBondContact O-N 2.63Å; F86-D88 VanDerWaalsContact C-N 3.34Å; F86-D88 PolarHBondContact O-N 3.19Å; F86-L89 PolarHBondContact O-N 3.47Å; F86-A90 VanDerWaalsContact O-CB 3.25Å; F86-A90 WeakPolarHBondContact O-CB 3.17Å; F86-A90 PolarHBondContact O-N 3.09Å
87	W	82	Confident	80	Confident	170 Å²	170	68.8 Å²	68.8	64%	0.644	34%	0.343	S	S	*	.	H	α-helix	trans	-64.4	-38.6	-179.6	-77.3	115.4	0	0	0	112.7	A83 A84 A90 R91	A83-W87 PolarHBondContact O-N 2.9Å; A84-W87 PolarHBondContact O-N 3.23Å; W87-A90 PolarHBondContact O-N 3.15Å; W87-R91 WeakPolarHBondContact O-CB 3.43Å; W87-R91 PolarHBondContact O-N 2.93Å
88	D	79.3	Confident	79.7	Confident	63 Å²	63	69.2 Å²	69.2	34%	0.337	34%	0.344	S	S	.	.	H	α-helix	trans	-69.6	-39	177.1	-72.2	-24.5	0	0	0	112.2	A84 L85 F86 R91 V92 F125	A84-D88 PolarHBondContact O-N 3.32Å; L85-D88 PolarHBondContact O-N 3.23Å; F86-D88 VanDerWaalsContact C-N 3.34Å; F86-D88 PolarHBondContact O-N 3.19Å; D88-R91 IonicContact OD1-NH1 3.17Å; D88-R91 PolarHBondContact OD1-NH1 3.16Å; D88-V92 WeakPolarHBondContact O-CG2 3.49Å; D88-V92 PolarHBondContact O-N 3.32Å; D88-F125 HydrophobicContact CB-CE1 3.83Å; D88-F125 HydrophobicContact CB-CZ 4.27Å
89	L	78.5	Confident	79	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-63.8	-45.9	172.9	-76.1	158.6	0	0	0	111.4	R56 F67 M71 L74 L85 F86 V92 F93	R56-L89 VanDerWaalsContact CZ-CD2 3.4Å; F67-L89 HydrophobicContact CE2-CD2 3.94Å; M71-L89 HydrophobicContact CE-CB 4.05Å; M71-L89 HydrophobicContact SD-CB 3.52Å; M71-L89 VanDerWaalsContact SD-CB 3.52Å; M71-L89 HydrophobicContact SD-CD1 3.79Å; M71-L89 HydrophobicContact SD-CG 4.22Å; L74-L89 HydrophobicContact CD1-CD1 3.51Å; L85-L89 HydrophobicContact CD2-CD1 4.05Å; L85-L89 HydrophobicContact CG-CD1 3.94Å; L85-L89 WeakPolarHBondContact O-CB 3.14Å; L85-L89 WeakPolarHBondContact O-CD1 3.44Å; L85-L89 VanDerWaalsContact O-CG 3.29Å; L85-L89 WeakPolarHBondContact O-CG 3.11Å; L85-L89 PolarHBondContact O-N 3.08Å; F86-L89 PolarHBondContact O-N 3.47Å; L89-V92 PolarHBondContact O-N 3.3Å; L89-F93 WeakPolarHBondContact O-CB 3.38Å; L89-F93 PolarHBondContact O-N 2.9Å
90	A	83.4	Confident	78.5	Confident	26 Å²	26	63.3 Å²	63.3	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-42.2	-179.9	0	0	0	0	0	112.1	M71 F86 W87 F93 W94	M71-A90 HydrophobicContact CE-CB 4.01Å; F86-A90 VanDerWaalsContact O-CB 3.25Å; F86-A90 WeakPolarHBondContact O-CB 3.17Å; F86-A90 PolarHBondContact O-N 3.09Å; W87-A90 PolarHBondContact O-N 3.15Å; A90-F93 PolarHBondContact O-N 3.26Å; A90-W94 WeakPolarHBondContact O-CB 3.35Å; A90-W94 PolarHBondContact O-N 3.07Å
91	R	81.6	Confident	78.5	Confident	144 Å²	144	63.2 Å²	63.2	54%	0.543	31%	0.306	S	S	.	.	H	α-helix	trans	-58.7	-50.9	177.9	-176.2	-176.6	-66.8	124.5	-0	111.3	W87 D88 W94 E95	W87-R91 WeakPolarHBondContact O-CB 3.43Å; W87-R91 PolarHBondContact O-N 2.93Å; D88-R91 IonicContact OD1-NH1 3.17Å; D88-R91 PolarHBondContact OD1-NH1 3.16Å; R91-W94 PolarHBondContact O-N 3.46Å; R91-E95 WeakPolarHBondContact O-CG 3.34Å; R91-E95 PolarHBondContact O-N 2.8Å
92	V	77.2	Confident	78.1	Confident	10 Å²	10	60.8 Å²	60.8	6%	0.061	30%	0.298	C	S	.	.	H	α-helix	trans	-66	-42.7	-179.2	178.1	0	0	0	0	111.5	L52 D88 L89 W94 E95 I96 I120 F125	L52-V92 HydrophobicContact CD1-CB 4.25Å; L52-V92 HydrophobicContact CD1-CG1 3.57Å; D88-V92 WeakPolarHBondContact O-CG2 3.49Å; D88-V92 PolarHBondContact O-N 3.32Å; L89-V92 PolarHBondContact O-N 3.3Å; V92-W94 VanDerWaalsContact C-N 3.27Å; V92-W94 PolarHBondContact O-N 2.75Å; V92-E95 PolarHBondContact O-N 2.98Å; V92-I96 HydrophobicContact CG1-CD1 3.84Å; V92-I96 HydrophobicContact CG1-CG1 4.43Å; V92-I96 VanDerWaalsContact O-CG1 3.32Å; V92-I96 WeakPolarHBondContact O-CG1 3.09Å; V92-I96 PolarHBondContact O-N 2.97Å; V92-I120 HydrophobicContact CG1-CD1 3.85Å; V92-F125 HydrophobicContact CB-CZ 4.49Å; V92-F125 HydrophobicContact CG2-CE2 3.35Å; V92-F125 HydrophobicContact CG2-CZ 3.28Å
93	F	82.2	Confident	77.4	Confident	10 Å²	10	58.7 Å²	58.7	4%	0.044	29%	0.291	C	S	.	.	H	α-helix	trans	-55.6	-46.6	175.3	173.2	-98.2	0	0	0	111	W45 L52 W68 L89 A90 I96 Y97	W45-F93 AromaticContact CD2-CZ 3.91Å; W45-F93 HydrophobicContact CD2-CZ 3.91Å; W45-F93 AromaticContact CE3-CE1 3.99Å; W45-F93 HydrophobicContact CE3-CE1 3.99Å; W45-F93 AromaticContact CE3-CZ 3.51Å; W45-F93 HydrophobicContact CE3-CZ 3.51Å; W45-F93 HydrophobicContact CH2-CE1 4.12Å; W45-F93 HydrophobicContact CH2-CZ 4.11Å; W45-F93 HydrophobicContact CZ2-CZ 4.48Å; W45-F93 AromaticContact CZ3-CE1 3.63Å; W45-F93 HydrophobicContact CZ3-CE1 3.63Å; W45-F93 AromaticContact CZ3-CZ 3.6Å; W45-F93 HydrophobicContact CZ3-CZ 3.6Å; L52-F93 HydrophobicContact CD2-CB 4.15Å; L52-F93 HydrophobicContact CD2-CD2 4.49Å; W68-F93 AromaticContact CH2-CD1 3.93Å; W68-F93 HydrophobicContact CH2-CD1 3.93Å; W68-F93 HydrophobicContact CH2-CD2 4.31Å; W68-F93 AromaticContact CH2-CE1 3.74Å; W68-F93 HydrophobicContact CH2-CE1 3.74Å; W68-F93 HydrophobicContact CH2-CE2 4.13Å; W68-F93 HydrophobicContact CH2-CG 4.21Å; W68-F93 AromaticContact CH2-CZ 3.86Å; W68-F93 HydrophobicContact CH2-CZ 3.86Å; W68-F93 HydrophobicContact CZ2-CD1 4.38Å; W68-F93 HydrophobicContact CZ2-CD2 4.06Å; W68-F93 AromaticContact CZ2-CE1 3.96Å; W68-F93 HydrophobicContact CZ2-CE1 3.96Å; W68-F93 AromaticContact CZ2-CE2 3.6Å; W68-F93 HydrophobicContact CZ2-CE2 3.6Å; W68-F93 HydrophobicContact CZ2-CG 4.43Å; W68-F93 AromaticContact CZ2-CZ 3.55Å; W68-F93 HydrophobicContact CZ2-CZ 3.55Å; L89-F93 WeakPolarHBondContact O-CB 3.38Å; L89-F93 PolarHBondContact O-N 2.9Å; A90-F93 PolarHBondContact O-N 3.26Å; F93-I96 PolarHBondContact O-N 3.31Å; F93-Y97 HydrophobicContact CZ-CD2 4.35Å; F93-Y97 VanDerWaalsContact O-CB 3.25Å; F93-Y97 WeakPolarHBondContact O-CB 3.34Å; F93-Y97 PolarHBondContact O-N 3.21Å
94	W	80.7	Confident	76.7	Confident	151 Å²	151	62.9 Å²	62.9	57%	0.572	30%	0.299	S	S	*	.	H	α-helix	trans	-66.9	-39.5	-179.2	-164.2	-106.3	0	0	0	113	A90 R91 V92 I96 Y97 V98	A90-W94 WeakPolarHBondContact O-CB 3.35Å; A90-W94 PolarHBondContact O-N 3.07Å; R91-W94 PolarHBondContact O-N 3.46Å; V92-W94 VanDerWaalsContact C-N 3.27Å; V92-W94 PolarHBondContact O-N 2.75Å; W94-I96 VanDerWaalsContact C-N 3.34Å; W94-I96 PolarHBondContact O-N 3.49Å; W94-Y97 HydrophobicContact CD2-CD1 4.47Å; W94-Y97 AromaticContact CE3-CD1 3.9Å; W94-Y97 HydrophobicContact CE3-CD1 3.9Å; W94-Y97 HydrophobicContact CH2-CD1 4.09Å; W94-Y97 HydrophobicContact CH2-CE1 4.04Å; W94-Y97 AromaticContact CZ3-CD1 3.69Å; W94-Y97 HydrophobicContact CZ3-CD1 3.69Å; W94-Y97 AromaticContact CZ3-CE1 3.91Å; W94-Y97 HydrophobicContact CZ3-CE1 3.91Å; W94-Y97 PolarHBondContact O-N 3.19Å; W94-V98 HydrophobicContact CD2-CG2 4.32Å; W94-V98 HydrophobicContact CG-CG2 4.39Å; W94-V98 HydrophobicContact CZ2-CG2 4.31Å; W94-V98 WeakPolarHBondContact O-CG2 3.4Å; W94-V98 PolarHBondContact O-N 3.21Å
95	E	75	Confident	76.1	Confident	79 Å²	79	64.4 Å²	64.4	37%	0.369	31%	0.307	S	S	.	.	H	α-helix	trans	-57.1	-47.2	173.3	-74.3	179.2	-174	0	0	111	R91 V92 E99 K123	R91-E95 WeakPolarHBondContact O-CG 3.34Å; R91-E95 PolarHBondContact O-N 2.8Å; V92-E95 PolarHBondContact O-N 2.98Å; E95-E99 VanDerWaalsContact O-CG 3.3Å; E95-E99 WeakPolarHBondContact O-CG 3.42Å; E95-E99 PolarHBondContact O-N 3.34Å; E95-K123 IonicContact OE1-NZ 3.62Å; E95-K123 IonicContact OE2-NZ 3.7Å
96	I	74.3	Confident	75.6	Confident	11 Å²	11	69.4 Å²	69.4	6%	0.056	33%	0.329	C	S	.	.	H	α-helix	trans	-68.3	-40.2	178.5	-61	169.7	0	0	0	111.4	L51 L52 M55 V92 F93 W94 E99 C100 V116 I120	L51-I96 HydrophobicContact CD2-CD1 4.45Å; L51-I96 HydrophobicContact CD2-CG2 3.87Å; L52-I96 HydrophobicContact CD1-CD1 4.28Å; M55-I96 HydrophobicContact CE-CD1 3.84Å; V92-I96 HydrophobicContact CG1-CD1 3.84Å; V92-I96 HydrophobicContact CG1-CG1 4.43Å; V92-I96 VanDerWaalsContact O-CG1 3.32Å; V92-I96 WeakPolarHBondContact O-CG1 3.09Å; V92-I96 PolarHBondContact O-N 2.97Å; F93-I96 PolarHBondContact O-N 3.31Å; W94-I96 VanDerWaalsContact C-N 3.34Å; W94-I96 PolarHBondContact O-N 3.49Å; I96-E99 PolarHBondContact O-N 2.79Å; I96-C100 PolarHBondContact O-N 3.34Å; I96-V116 HydrophobicContact CD1-CG1 3.88Å; I96-V116 HydrophobicContact CG1-CG1 3.75Å; I96-V116 HydrophobicContact CG1-CG2 4.48Å; I96-I120 HydrophobicContact CD1-CD1 4.26Å
97	Y	79	Confident	74.7	Confident	23 Å²	23	70.9 Å²	70.9	9%	0.09	35%	0.354	C	S	.	.	H	α-helix	trans	-63.3	-48.4	-178.8	176.8	-100.8	0	0	0	112.1	A40 D41 C44 W45 F93 W94 E99 C100 V101	A40-Y97 WeakPolarHBondContact CA-OH 3.46Å; A40-Y97 HydrophobicContact CB-CE2 4.43Å; A40-Y97 WeakPolarHBondContact CB-OH 3.42Å; D41-Y97 PolarHBondContact N-OH 2.97Å; D41-Y97 VanDerWaalsContact N-OH 3.17Å; C44-Y97 HydrophobicContact CB-CD2 4.33Å; C44-Y97 HydrophobicContact CB-CE2 4.14Å; W45-Y97 HydrophobicContact CE3-CE2 4.41Å; F93-Y97 HydrophobicContact CZ-CD2 4.35Å; F93-Y97 VanDerWaalsContact O-CB 3.25Å; F93-Y97 WeakPolarHBondContact O-CB 3.34Å; F93-Y97 PolarHBondContact O-N 3.21Å; W94-Y97 HydrophobicContact CD2-CD1 4.47Å; W94-Y97 AromaticContact CE3-CD1 3.9Å; W94-Y97 HydrophobicContact CE3-CD1 3.9Å; W94-Y97 HydrophobicContact CH2-CD1 4.09Å; W94-Y97 HydrophobicContact CH2-CE1 4.04Å; W94-Y97 AromaticContact CZ3-CD1 3.69Å; W94-Y97 HydrophobicContact CZ3-CD1 3.69Å; W94-Y97 AromaticContact CZ3-CE1 3.91Å; W94-Y97 HydrophobicContact CZ3-CE1 3.91Å; W94-Y97 PolarHBondContact O-N 3.19Å; Y97-E99 VanDerWaalsContact C-N 3.35Å; Y97-E99 PolarHBondContact O-N 3.07Å; Y97-C100 WeakPolarHBondContact O-CB 3.31Å; Y97-C100 PolarHBondContact O-N 3.44Å; Y97-V101 HydrophobicContact CD1-CG2 4.4Å; Y97-V101 HydrophobicContact CE1-CG2 3.92Å; Y97-V101 HydrophobicContact CE2-CG2 4.08Å; Y97-V101 WeakPolarHBondContact O-CG2 3.21Å; Y97-V101 PolarHBondContact O-N 3.45Å
98	V	78.1	Confident	73.7	Confident	51 Å²	51	67.7 Å²	67.7	31%	0.309	35%	0.348	S	S	.	.	H	α-helix	trans	-62.6	-43.3	178.8	171.9	0	0	0	0	110.6	W94 C100 V101 M102	W94-V98 HydrophobicContact CD2-CG2 4.32Å; W94-V98 HydrophobicContact CG-CG2 4.39Å; W94-V98 HydrophobicContact CZ2-CG2 4.31Å; W94-V98 WeakPolarHBondContact O-CG2 3.4Å; W94-V98 PolarHBondContact O-N 3.21Å; V98-C100 VanDerWaalsContact C-N 3.31Å; V98-C100 PolarHBondContact O-N 3.27Å; V98-V101 PolarHBondContact O-N 3.42Å; V98-M102 HydrophobicContact CG1-CG 4.14Å; V98-M102 WeakPolarHBondContact O-CB 3.01Å; V98-M102 VanDerWaalsContact O-CG 3.23Å; V98-M102 WeakPolarHBondContact O-CG 3.35Å; V98-M102 PolarHBondContact O-N 3.45Å
99	E	69.6	Low	72.6	Confident	116 Å²	116	67.1 Å²	67.1	54%	0.542	36%	0.357	S	S	.	.	H	α-helix	trans	-59.5	-40.2	174.8	-74.5	-67.9	155.6	0	0	112.2	E95 I96 Y97 S103	E95-E99 VanDerWaalsContact O-CG 3.3Å; E95-E99 WeakPolarHBondContact O-CG 3.42Å; E95-E99 PolarHBondContact O-N 3.34Å; I96-E99 PolarHBondContact O-N 2.79Å; Y97-E99 VanDerWaalsContact C-N 3.35Å; Y97-E99 PolarHBondContact O-N 3.07Å; E99-S103 WeakPolarHBondContact O-CB 3.43Å; E99-S103 PolarHBondContact O-N 3.03Å
100	C	73.8	Confident	71.5	Confident	34 Å²	34	77.8 Å²	77.8	23%	0.23	40%	0.397	C	S	.	.	H	α-helix	trans	-63.1	-47	175	-176	0	0	0	0	112.2	C44 I96 Y97 V98 S103 R104	C44-C100 WeakPolarHBondContact CA-SG 3.41Å; C44-C100 HydrophobicContact CB-CB 3.75Å; C44-C100 WeakPolarHBondContact CB-SG 3.42Å; C44-C100 WeakPolarHBondContact SG-CB 2.93Å; C44-C100 CovalentContact SG-SG 2.05Å; C44-C100 PolarHBondContact SG-SG 3.42Å; I96-C100 PolarHBondContact O-N 3.34Å; Y97-C100 WeakPolarHBondContact O-CB 3.31Å; Y97-C100 PolarHBondContact O-N 3.44Å; V98-C100 VanDerWaalsContact C-N 3.31Å; V98-C100 PolarHBondContact O-N 3.27Å; C100-S103 PolarHBondContact O-N 3.45Å; C100-R104 WeakPolarHBondContact O-CB 3.45Å; C100-R104 PolarHBondContact O-N 2.96Å
101	V	76.3	Confident	70.1	Confident	53 Å²	53	86.4 Å²	86.4	32%	0.321	42%	0.424	S	S	.	.	H	α-helix	trans	-64.3	-42.5	-179.7	172.6	0	0	0	0	111	C44 Y97 V98 R104 S105	C44-V101 HydrophobicContact CB-CG2 4.23Å; Y97-V101 HydrophobicContact CD1-CG2 4.4Å; Y97-V101 HydrophobicContact CE1-CG2 3.92Å; Y97-V101 HydrophobicContact CE2-CG2 4.08Å; Y97-V101 WeakPolarHBondContact O-CG2 3.21Å; Y97-V101 PolarHBondContact O-N 3.45Å; V98-V101 PolarHBondContact O-N 3.42Å; V101-R104 PolarHBondContact O-N 3.22Å; V101-S105 PolarHBondContact O-N 3.1Å; V101-S105 PolarHBondContact O-OG 2.94Å
102	M	70.9	Confident	68.5	Low	99 Å²	99	84.3 Å²	84.3	49%	0.488	42%	0.42	S	S	.	.	H	α-helix	trans	-64.5	-46.6	175	-68.3	-61	-158.7	0	0	111.2	V98 R104 S105 H106	V98-M102 HydrophobicContact CG1-CG 4.14Å; V98-M102 WeakPolarHBondContact O-CB 3.01Å; V98-M102 VanDerWaalsContact O-CG 3.23Å; V98-M102 WeakPolarHBondContact O-CG 3.35Å; V98-M102 PolarHBondContact O-N 3.45Å; M102-R104 VanDerWaalsContact C-N 3.29Å; M102-R104 PolarHBondContact O-N 3.21Å; M102-S105 WeakPolarHBondContact CA-OG 3.36Å; M102-S105 PolarHBondContact O-N 3.17Å; M102-S105 PolarHBondContact O-OG 3.49Å; M102-H106 PolarHBondContact O-CD2 3.44Å; M102-H106 PolarHBondContact O-N 3.01Å; M102-H106 VanDerWaalsContact O-N 3.1Å
103	S	64.1	Low	67.2	Low	30 Å²	30	87.4 Å²	87.4	21%	0.21	44%	0.439	C	S	.	.	H	α-helix	trans	-59.4	-39.2	177.6	179.4	0	0	0	0	112.6	E99 C100 M108	E99-S103 WeakPolarHBondContact O-CB 3.43Å; E99-S103 PolarHBondContact O-N 3.03Å; C100-S103 PolarHBondContact O-N 3.45Å; S103-M108 PolarHBondContact O-N 3.42Å; S103-M108 VanDerWaalsContact O-N 3.1Å; S103-M108 PolarHBondContact OG-O 3.17Å
104	R	67.1	Low	65.5	Low	126 Å²	126	91.9 Å²	91.9	48%	0.475	47%	0.467	S	S	.	.	H	α-helix	trans	-69.1	-42.3	177.7	-172.2	-177.6	174.6	104.7	-2.1	112.3	D41 C100 V101 M102 H106 G107	D41-R104 WeakPolarHBondContact OD2-CD 3.22Å; D41-R104 IonicContact OD2-CZ 3.46Å; D41-R104 IonicContact OD2-NE 3.16Å; D41-R104 PolarHBondContact OD2-NE 3.16Å; D41-R104 VanDerWaalsContact OD2-NE 3.16Å; D41-R104 IonicContact OD2-NH2 3.88Å; C100-R104 WeakPolarHBondContact O-CB 3.45Å; C100-R104 PolarHBondContact O-N 2.96Å; V101-R104 PolarHBondContact O-N 3.22Å; M102-R104 VanDerWaalsContact C-N 3.29Å; M102-R104 PolarHBondContact O-N 3.21Å; R104-H106 VanDerWaalsContact C-N 3.33Å; R104-H106 PolarHBondContact O-N 2.05Å; R104-G107 PolarHBondContact O-N 2.82Å
105	S	66.4	Low	63.9	Low	84 Å²	84	87 Å²	87	59%	0.587	46%	0.456	S	S	*	.	H	α-helix	trans	-68.6	-30.4	-180	52.9	0	0	0	0	113.1	V101 M102 G107	V101-S105 PolarHBondContact O-N 3.1Å; V101-S105 PolarHBondContact O-OG 2.94Å; M102-S105 WeakPolarHBondContact CA-OG 3.36Å; M102-S105 PolarHBondContact O-N 3.17Å; M102-S105 PolarHBondContact O-OG 3.49Å; S105-G107 VanDerWaalsContact C-N 3.29Å; S105-G107 PolarHBondContact O-N 3.27Å
106	H	67.9	Low	62.6	Low	140 Å²	140	84 Å²	84	65%	0.648	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	3.4	174	-70	-68.5	0	0	0	114.4	M102 R104 M108	M102-H106 PolarHBondContact O-CD2 3.44Å; M102-H106 PolarHBondContact O-N 3.01Å; M102-H106 VanDerWaalsContact O-N 3.1Å; R104-H106 VanDerWaalsContact C-N 3.33Å; R104-H106 PolarHBondContact O-N 2.05Å; H106-M108 HydrophobicContact CB-CG 4.45Å; H106-M108 PolarHBondContact O-N 2.92Å; H106-M108 VanDerWaalsContact O-N 3.17Å
107	G	62.2	Low	61.3	Low	67 Å²	67	87.8 Å²	87.8	69%	0.691	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	8.2	-179.5	0	0	0	0	0	114.3	R104 S105 G109	R104-G107 PolarHBondContact O-N 2.82Å; S105-G107 VanDerWaalsContact C-N 3.29Å; S105-G107 PolarHBondContact O-N 3.27Å; G107-G109 PolarHBondContact O-N 3.46Å
108	M	60.7	Low	59.6	Low	104 Å²	104	90.1 Å²	90.1	51%	0.512	48%	0.48	S	S	.	.			trans	-82.6	53.7	177	-68.2	177.6	72.3	0	0	110.4	S103 H106 R110	S103-M108 PolarHBondContact O-N 3.42Å; S103-M108 VanDerWaalsContact O-N 3.1Å; S103-M108 PolarHBondContact OG-O 3.17Å; H106-M108 HydrophobicContact CB-CG 4.45Å; H106-M108 PolarHBondContact O-N 2.92Å; H106-M108 VanDerWaalsContact O-N 3.17Å; M108-R110 PolarHBondContact O-N 2.97Å; M108-R110 VanDerWaalsContact O-N 3.16Å
109	G	55.8	Low	58.1	Low	51 Å²	51	92.7 Å²	92.7	53%	0.526	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	121.4	179.5	0	0	0	0	0	112.5	G107 R111	G107-G109 PolarHBondContact O-N 3.46Å; G109-R111 PolarHBondContact O-N 3.33Å
110	R	54.9	Low	57.2	Low	224 Å²	224	88.8 Å²	88.8	85%	0.845	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	17.4	159.4	-58.6	-174.6	174.1	140.8	-2.8	119	M108	M108-R110 PolarHBondContact O-N 2.97Å; M108-R110 VanDerWaalsContact O-N 3.16Å
111	R	53.3	Low	55.8	Low	207 Å²	207	91.5 Å²	91.5	78%	0.781	49%	0.49	S	S	*	.			trans	-103.6	-3.8	179.7	-64.1	-167.5	-163.8	168.1	5.8	117.2	G109	G109-R111 PolarHBondContact O-N 3.33Å
112	H	48.5	Very low	54	Low	101 Å²	101	95.4 Å²	95.4	47%	0.468	51%	0.509	S	S	.	.			trans	-126.1	44.4	-170.5	-73.6	-87.3	0	0	0	115.7	T114	H112-T114 VanDerWaalsContact C-N 3.28Å
113	V	50.6	Low	52.5	Low	75 Å²	75	96 Å²	96	46%	0.455	51%	0.509	S	S	.	.	S	Bend	trans	-88.8	3.7	167.3	-179.5	0	0	0	0	111.9	L51	L51-V113 HydrophobicContact CD1-CG1 3.34Å; L51-V113 HydrophobicContact CD2-CG1 3.53Å; L51-V113 HydrophobicContact CG-CG1 4.03Å
114	T	45.3	Very low	51.4	Low	104 Å²	104	98.1 Å²	98.1	64%	0.638	52%	0.523	S	S	*	.	H	α-helix	trans	-93.7	-25.5	-176.2	-12.2	0	0	0	0	113.4	H112 S118	H112-T114 VanDerWaalsContact C-N 3.28Å; T114-S118 PolarHBondContact O-OG 2.9Å
115	S	47.4	Very low	50.2	Low	49 Å²	49	96 Å²	96	34%	0.343	52%	0.518	S	S	.	.	H	α-helix	trans	-72.4	-36.4	176.5	53.2	0	0	0	0	112.1	H117 S118 L119	S115-H117 VanDerWaalsContact C-N 3.31Å; S115-H117 PolarHBondContact O-N 2.91Å; S115-S118 PolarHBondContact O-N 3.47Å; S115-L119 PolarHBondContact O-N 3.48Å
116	V	48.7	Very low	48.8	Very low	15 Å²	15	102.2 Å²	102.2	9%	0.091	53%	0.528	C	S	.	.	H	α-helix	trans	-59.2	-42.7	175.7	177.2	0	0	0	0	111	L51 M55 I96 S118 L119 I120	L51-V116 HydrophobicContact CD2-CB 4.36Å; L51-V116 HydrophobicContact CD2-CG1 4Å; M55-V116 HydrophobicContact CE-CG1 3.7Å; M55-V116 HydrophobicContact SD-CG1 3.96Å; I96-V116 HydrophobicContact CD1-CG1 3.88Å; I96-V116 HydrophobicContact CG1-CG1 3.75Å; I96-V116 HydrophobicContact CG1-CG2 4.48Å; V116-S118 PolarHBondContact O-N 3.02Å; V116-L119 PolarHBondContact O-N 3.01Å; V116-I120 HydrophobicContact CG1-CD1 3.45Å; V116-I120 VanDerWaalsContact CG1-CD1 3.45Å; V116-I120 HydrophobicContact CG1-CG1 4.32Å; V116-I120 WeakPolarHBondContact O-CB 3.49Å; V116-I120 VanDerWaalsContact O-CG1 3.26Å; V116-I120 WeakPolarHBondContact O-CG1 3.32Å; V116-I120 PolarHBondContact O-N 3.24Å
117	H	47.6	Very low	47.2	Very low	91 Å²	91	102.5 Å²	102.5	42%	0.421	53%	0.528	S	S	.	.	H	α-helix	trans	-62	-33.2	176.9	-164.5	-84.4	0	0	0	112	S115 T121	S115-H117 VanDerWaalsContact C-N 3.31Å; S115-H117 PolarHBondContact O-N 2.91Å; H117-T121 WeakPolarHBondContact O-CB 3.45Å; H117-T121 WeakPolarHBondContact O-CG2 3.41Å; H117-T121 PolarHBondContact O-N 3.3Å; H117-T121 PolarHBondContact O-OG1 3Å
118	S	42.8	Very low	45.7	Very low	72 Å²	72	105.6 Å²	105.6	50%	0.503	53%	0.529	S	S	.	.	H	α-helix	trans	-80.2	-40.4	-179.4	-55	0	0	0	0	112.5	T114 S115 V116 I120 T121 D122	T114-S118 PolarHBondContact O-OG 2.9Å; S115-S118 PolarHBondContact O-N 3.47Å; V116-S118 PolarHBondContact O-N 3.02Å; S118-I120 VanDerWaalsContact C-N 3.34Å; S118-I120 PolarHBondContact O-N 3.16Å; S118-T121 WeakPolarHBondContact CA-OG1 3.05Å; S118-T121 PolarHBondContact O-OG1 3.2Å; S118-D122 WeakPolarHBondContact O-CB 3.42Å; S118-D122 PolarHBondContact O-N 3.04Å
119	L	47	Very low	44.3	Very low	104 Å²	104	104.8 Å²	104.8	55%	0.545	53%	0.533	S	S	.	.	H	α-helix	trans	-69.2	-31.2	176.3	-74.1	168.6	0	0	0	112.7	S115 V116 K123	S115-L119 PolarHBondContact O-N 3.48Å; V116-L119 PolarHBondContact O-N 3.01Å; L119-K123 VanDerWaalsContact O-CB 3.31Å; L119-K123 WeakPolarHBondContact O-CB 3.17Å; L119-K123 WeakPolarHBondContact O-CG 3.49Å; L119-K123 PolarHBondContact O-N 3.24Å
120	I	49.3	Very low	43.4	Very low	35 Å²	35	106.8 Å²	106.8	18%	0.179	54%	0.539	C	S	.	.	H	α-helix	trans	-85.1	-31	178.5	-63.5	173.9	0	0	0	111.9	M55 V92 I96 V116 S118 D122 K123	M55-I120 HydrophobicContact CE-CD1 3.44Å; M55-I120 VanDerWaalsContact CE-CD1 3.44Å; M55-I120 HydrophobicContact SD-CD1 4.17Å; V92-I120 HydrophobicContact CG1-CD1 3.85Å; I96-I120 HydrophobicContact CD1-CD1 4.26Å; V116-I120 HydrophobicContact CG1-CD1 3.45Å; V116-I120 VanDerWaalsContact CG1-CD1 3.45Å; V116-I120 HydrophobicContact CG1-CG1 4.32Å; V116-I120 WeakPolarHBondContact O-CB 3.49Å; V116-I120 VanDerWaalsContact O-CG1 3.26Å; V116-I120 WeakPolarHBondContact O-CG1 3.32Å; V116-I120 PolarHBondContact O-N 3.24Å; S118-I120 VanDerWaalsContact C-N 3.34Å; S118-I120 PolarHBondContact O-N 3.16Å; I120-D122 VanDerWaalsContact C-N 3.34Å; I120-K123 CarbonylContact O-C 3.29Å
121	T	44.7	Very low	42.5	Very low	90 Å²	90	107.7 Å²	107.7	55%	0.552	54%	0.543	S	S	*	.	H	α-helix	trans	-70.8	-32.2	169.1	41.4	0	0	0	0	112.1	H117 S118	H117-T121 WeakPolarHBondContact O-CB 3.45Å; H117-T121 WeakPolarHBondContact O-CG2 3.41Å; H117-T121 PolarHBondContact O-N 3.3Å; H117-T121 PolarHBondContact O-OG1 3Å; S118-T121 WeakPolarHBondContact CA-OG1 3.05Å; S118-T121 PolarHBondContact O-OG1 3.2Å
122	D	38.6	Very low	41.4	Very low	136 Å²	136	102 Å²	102	73%	0.727	54%	0.54	S	S	*	.	H	α-helix	trans	-71	-47.9	173	-171.1	-101.6	0	0	0	111.7	S118 I120 S124	S118-D122 WeakPolarHBondContact O-CB 3.42Å; S118-D122 PolarHBondContact O-N 3.04Å; I120-D122 VanDerWaalsContact C-N 3.34Å; D122-S124 PolarHBondContact O-N 3.41Å
123	K	40.4	Very low	40.8	Very low	112 Å²	112	104.7 Å²	104.7	49%	0.487	56%	0.558	S	S	.	*	S	Bend	trans	-80.4	66.2	167.8	-63.6	177.9	-175.7	173.4	0	110.1	E95 L119 I120 F125	E95-K123 IonicContact OE1-NZ 3.62Å; E95-K123 IonicContact OE2-NZ 3.7Å; L119-K123 VanDerWaalsContact O-CB 3.31Å; L119-K123 WeakPolarHBondContact O-CB 3.17Å; L119-K123 WeakPolarHBondContact O-CG 3.49Å; L119-K123 PolarHBondContact O-N 3.24Å; I120-K123 CarbonylContact O-C 3.29Å; K123-F125 PolarHBondContact O-N 3.19Å
124	S	40.9	Very low	40	Very low	74 Å²	74	105.3 Å²	105.3	52%	0.517	57%	0.565	S	S	.	*			trans	-44.1	115.1	172.3	63.7	0	0	0	0	109.3	D122 R126	D122-S124 PolarHBondContact O-N 3.41Å; S124-R126 PolarHBondContact O-N 3.48Å
125	F	42.3	Very low	39.5	Very low	82 Å²	82	112.6 Å²	112.6	36%	0.36	58%	0.581	S	S	.	*			trans	-65.3	86.4	172.3	-105.9	-100	0	0	0	106.9	D88 V92 K123 F127	D88-F125 HydrophobicContact CB-CE1 3.83Å; D88-F125 HydrophobicContact CB-CZ 4.27Å; V92-F125 HydrophobicContact CB-CZ 4.49Å; V92-F125 HydrophobicContact CG2-CE2 3.35Å; V92-F125 HydrophobicContact CG2-CZ 3.28Å; K123-F125 PolarHBondContact O-N 3.19Å; F125-F127 PolarHBondContact O-N 2.88Å
126	R	35.5	Very low	38.6	Very low	213 Å²	213	115.5 Å²	115.5	80%	0.804	60%	0.597	S	S	*	*			trans	-76.5	79	-179.6	-161.4	-174.1	-65.3	-131.8	4.2	107.1	S124 N128	S124-R126 PolarHBondContact O-N 3.48Å; R126-N128 VanDerWaalsContact C-N 3.29Å; R126-N128 PolarHBondContact O-N 3.29Å
127	F	34.9	Very low	37.9	Very low	146 Å²	146	123.3 Å²	123.3	64%	0.64	63%	0.63	S	S	*	*			trans	-64.3	93.5	168.3	-169.6	-95.7	0	0	0	107.5	L85 F125 S129	L85-F127 HydrophobicContact CD1-CD2 3.91Å; L85-F127 HydrophobicContact CD1-CE2 3.54Å; F125-F127 PolarHBondContact O-N 2.88Å; F127-S129 VanDerWaalsContact C-N 3.26Å; F127-S129 PolarHBondContact O-N 2.77Å
128	N	30.1	Very low	37.1	Very low	132 Å²	132	125.9 Å²	125.9	71%	0.706	65%	0.646	S	S	*	*			trans	-82.1	75.6	177	-165.8	-2.7	0	0	0	108.7	R126 S130	R126-N128 VanDerWaalsContact C-N 3.29Å; R126-N128 PolarHBondContact O-N 3.29Å; N128-S130 PolarHBondContact O-N 3.14Å; N128-S130 VanDerWaalsContact O-N 3.16Å
129	S	32.2	Very low	36.7	Very low	87 Å²	87	128.1 Å²	128.1	61%	0.608	65%	0.651	S	S	*	*			trans	-65.3	109.2	160.4	55.9	0	0	0	0	107.5	F127 R131	F127-S129 VanDerWaalsContact C-N 3.26Å; F127-S129 PolarHBondContact O-N 2.77Å; S129-R131 PolarHBondContact O-N 3.01Å
130	S	37	Very low	36.1	Very low	93 Å²	93	127.7 Å²	127.7	65%	0.65	65%	0.653	S	S	*	*			trans	-57.7	133.2	-168.4	-44.7	0	0	0	0	112.9	N128	N128-S130 PolarHBondContact O-N 3.14Å; N128-S130 VanDerWaalsContact O-N 3.16Å
131	R	36.2	Very low	35.1	Very low	243 Å²	243	136.9 Å²	136.9	92%	0.917	69%	0.685	S	S	*	*			trans	52.4	78.7	160	-164.1	-178.2	-69.1	-152.4	-0.5	115.6	S129	S129-R131 PolarHBondContact O-N 3.01Å
132	A	30.3	Very low	34.6	Very low	87 Å²	87	138.5 Å²	138.5	72%	0.719	69%	0.694	S	S	*	*			trans	-144.2	107.4	152.7	0	0	0	0	0	109.5	S134	A132-S134 VanDerWaalsContact C-N 3.33Å; A132-S134 PolarHBondContact O-N 2.97Å
133	N	36.1	Very low	34.4	Very low	158 Å²	158	143.4 Å²	143.4	85%	0.845	70%	0.703	S	S	*	*			trans	-58.3	80.7	171.9	41.2	-51.1	0	0	0	111.8
134	S	32	Very low	34.3	Very low	88 Å²	88	149.4 Å²	149.4	62%	0.615	72%	0.722	S	S	*	*			trans	-157.8	99.7	161	-177.2	0	0	0	0	109.4	A132 T136	A132-S134 VanDerWaalsContact C-N 3.33Å; A132-S134 PolarHBondContact O-N 2.97Å; S134-T136 VanDerWaalsContact C-N 3.27Å; S134-T136 PolarHBondContact O-N 3.2Å
135	W	36	Very low	34.5	Very low	257 Å²	257	158.3 Å²	158.3	97%	0.973	75%	0.745	S	S	*	*			trans	-78.6	75	178	-72.3	70.6	0	0	0	109.9	K137	W135-K137 PolarHBondContact O-N 3.25Å
136	T	29.3	Very low	34.4	Very low	111 Å²	111	157.7 Å²	157.7	68%	0.681	76%	0.761	S	S	*	*			trans	-83.4	93.1	162.4	20.2	0	0	0	0	108.5	S134 L138	S134-T136 VanDerWaalsContact C-N 3.27Å; S134-T136 PolarHBondContact O-N 3.2Å; T136-L138 VanDerWaalsContact C-N 3.29Å; T136-L138 PolarHBondContact O-N 3.16Å
137	K	33.3	Very low	34.3	Very low	179 Å²	179	155.4 Å²	155.4	78%	0.778	76%	0.76	S	S	*	*			trans	-63.4	87.8	171.6	-166.2	-179.4	-172.8	170.9	0	108.9	W135 I139	W135-K137 PolarHBondContact O-N 3.25Å; K137-I139 HydrophobicContact CD-CD1 4.13Å; K137-I139 HydrophobicContact CD-CG1 4.34Å; K137-I139 HydrophobicContact CG-CD1 4.33Å; K137-I139 HydrophobicContact CG-CG1 4Å; K137-I139 PolarHBondContact O-N 3.25Å
138	L	30.4	Very low	34.5	Very low	144 Å²	144	156.1 Å²	156.1	75%	0.754	77%	0.768	S	S	*	*			trans	-77.6	88	177.4	-137.4	104.6	0	0	0	108.9	T136 V140	T136-L138 VanDerWaalsContact C-N 3.29Å; T136-L138 PolarHBondContact O-N 3.16Å; L138-V140 HydrophobicContact CD2-CG2 3.94Å; L138-V140 PolarHBondContact O-N 3.08Å; L138-V140 VanDerWaalsContact O-N 3.16Å
139	I	35	Very low	34.9	Very low	120 Å²	120	154.9 Å²	154.9	62%	0.615	77%	0.766	S	S	*	*			trans	-78.3	96.4	172.2	-59.7	176.5	0	0	0	107.5	K137 R141	K137-I139 HydrophobicContact CD-CD1 4.13Å; K137-I139 HydrophobicContact CD-CG1 4.34Å; K137-I139 HydrophobicContact CG-CD1 4.33Å; K137-I139 HydrophobicContact CG-CG1 4Å; K137-I139 PolarHBondContact O-N 3.25Å; I139-R141 PolarHBondContact O-N 2.79Å
140	V	33	Very low	35.6	Very low	95 Å²	95	157.1 Å²	157.1	58%	0.576	78%	0.776	S	S	*	*			trans	-76.5	102.9	173	-178.2	0	0	0	0	108.4	L138 V142	L138-V140 HydrophobicContact CD2-CG2 3.94Å; L138-V140 PolarHBondContact O-N 3.08Å; L138-V140 VanDerWaalsContact O-N 3.16Å; V140-V142 PolarHBondContact O-N 2.93Å
141	R	28.3	Very low	35.6	Very low	227 Å²	227	160.7 Å²	160.7	86%	0.857	79%	0.787	S	S	*	*			trans	-75.5	108	167.6	-74.8	-176.8	174.4	164.6	-1.5	108.6	I139 R143	I139-R141 PolarHBondContact O-N 2.79Å; R141-R143 PolarHBondContact O-N 3.11Å
142	V	35.1	Very low	36	Very low	124 Å²	124	157.1 Å²	157.1	75%	0.752	78%	0.778	S	S	*	*			trans	-67.6	98.5	169.3	176.4	0	0	0	0	108.2	V140	V140-V142 PolarHBondContact O-N 2.93Å
143	R	34.5	Very low	36.5	Very low	239 Å²	239	159.4 Å²	159.4	90%	0.902	78%	0.783	S	S	*	*			trans	-89.6	118.4	175	-166.2	169.8	-173.5	152.2	0.9	108.4	R141 R145	R141-R143 PolarHBondContact O-N 3.11Å; R143-R145 PolarHBondContact O-N 2.79Å
144	R	37.2	Very low	36.6	Very low	239 Å²	239	158.7 Å²	158.7	90%	0.902	78%	0.775	S	S	*	*			trans	-48.3	128.6	172	-110.7	-174.6	-173.3	-175.8	3.3	109.7	G146	R144-G146 PolarHBondContact O-N 3.46Å
145	R	46	Very low	37.3	Very low	260 Å²	260	160.2 Å²	160.2	98%	0.981	78%	0.782	S	S	*	*			trans	-54.9	112.8	176.3	-152.4	178.6	-164.3	-167	4.4	109.9	R143	R143-R145 PolarHBondContact O-N 2.79Å
146	G	40.2	Very low	37.4	Very low	69 Å²	69	161.2 Å²	161.2	71%	0.711	79%	0.793	S	S	*	*			trans	-169.5	106.4	175	0	0	0	0	0	111	R144	R144-G146 PolarHBondContact O-N 3.46Å
147	H	33.1	Very low	37.8	Very low	166 Å²	166	163.7 Å²	163.7	77%	0.769	80%	0.799	S	S	*	*			trans	68.7	109.7	165.8	-147.8	-92.4	0	0	0	117.8
148	I	39.5	Very low	38	Very low	160 Å²	160	162.9 Å²	162.9	82%	0.821	80%	0.8	S	S	*	*			trans	-85.6	106.7	168.1	-59.6	172	0	0	0	107
149	T	38.6	Very low	38.5	Very low	106 Å²	106	163.9 Å²	163.9	65%	0.65	80%	0.803	S	S	*	*			trans	-104.2	118.4	156.1	25.4	0	0	0	0	108.1	L151	T149-L151 PolarHBondContact O-N 2.81Å
150	T	46	Very low	38.7	Very low	134 Å²	134	166.5 Å²	166.5	82%	0.822	81%	0.814	S	S	*	*			trans	-64.8	109.4	176.7	38.7	0	0	0	0	109.6	K152	T150-K152 PolarHBondContact O-N 2.89Å
151	L	38.5	Very low	39	Very low	168 Å²	168	171 Å²	171	88%	0.88	83%	0.829	S	S	*	*			trans	-88.4	106.4	167.7	-83.7	166.6	0	0	0	109	T149	T149-L151 PolarHBondContact O-N 2.81Å
152	K	44.7	Very low	39.7	Very low	169 Å²	169	167.3 Å²	167.3	74%	0.735	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-47.8	126.2	169.8	-171.3	-173.5	-176.3	-142.5	0	111.2	T150 E154	T150-K152 PolarHBondContact O-N 2.89Å; K152-E154 IonicContact NZ-OE1 2.8Å; K152-E154 PolarHBondContact NZ-OE1 3.3Å
153	T	40.6	Very low	40.1	Very low	134 Å²	134	170.4 Å²	170.4	82%	0.822	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-86.2	119.9	165.7	44.1	0	0	0	0	109.2
154	E	37.3	Very low	40.5	Very low	144 Å²	144	165.1 Å²	165.1	67%	0.673	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-76.1	142.6	167.3	-73.9	-82.8	123.7	0	0	109.9	K152	K152-E154 IonicContact NZ-OE1 2.8Å; K152-E154 PolarHBondContact NZ-OE1 3.3Å
155	P	45.8	Very low	40.8	Very low	119 Å²	119	158.9 Å²	158.9	77%	0.773	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-86.3	154.2	177.7	34.8	-31.6	0	0	0	111.6
156	K	39	Very low	40.3	Very low	278 Å²	278	149.7 Å²	149.7	100%	1.209	81%	0.806	S	S	*	*			trans	-101.4	0	162.9	-174.5	175	-176.4	176.8	0	109.2

Retrieved 156 of 156 residues in 1069.6 ms (Link to these results)

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