A0A087XZM3_POEFO Loading...

DNA polymerase delta 4, accessory subunit

AlphaFold DB , UniProt , Accession A0A087XZM3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 108 aa.

						>A0A087XZM3_POEFO|A0A087XZM3
MTTKRGLITDSFKVLKKTRRGGKRKKTPTPPPAQQEDVTTTVKEEEMQQLKQFDLDWRFGPCTGISRMQRWERAKLHGLNPPEEIKELLLQTLDDPEYSMSLWREYPF
					

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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	49.8	Very low	67.4	Low	238 Å²	238	144.1 Å²	144.1	100%	1.172	78%	0.776	S	S	*	*				0	95.6	0	-64.7	-82.8	-166.1	0	0	108.2
2	T	53.1	Low	68.1	Low	131 Å²	131	145.5 Å²	145.5	80%	0.804	77%	0.771	S	S	*	*			trans	-93.1	112.4	-179.9	57.1	0	0	0	0	109.7	K4	T2-K4 PolarHBondContact O-N 3.27Å
3	T	62.7	Low	68.5	Low	115 Å²	115	150.2 Å²	150.2	71%	0.706	78%	0.781	S	S	*	*			trans	-78.7	107	178.4	46.1	0	0	0	0	109.6	R5	T3-R5 PolarHBondContact O-N 3.23Å; T3-R5 VanDerWaalsContact O-N 3.15Å
4	K	65.9	Low	68.6	Low	201 Å²	201	149.2 Å²	149.2	87%	0.874	78%	0.784	S	S	*	*			trans	-73.1	103.7	172.5	-65.9	-179.8	-179	179.4	0	108	T2	T2-K4 PolarHBondContact O-N 3.27Å
5	R	72.4	Confident	68.8	Low	227 Å²	227	150.3 Å²	150.3	86%	0.857	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-77.8	124.1	173.4	-65.3	179.8	177.2	156.4	-1.3	108	T3	T3-R5 PolarHBondContact O-N 3.23Å; T3-R5 VanDerWaalsContact O-N 3.15Å
6	G	71.8	Confident	68.6	Low	66 Å²	66	152.9 Å²	152.9	68%	0.68	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-59.4	150.9	178.6	0	0	0	0	0	111.9
7	L	78.4	Confident	68.1	Low	126 Å²	126	155.6 Å²	155.6	66%	0.66	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-69.8	148.3	177.1	-80.3	133.6	0	0	0	110	T9 D10	L7-T9 PolarHBondContact O-N 3.09Å; L7-D10 PolarHBondContact O-N 3.31Å
8	I	71.5	Confident	67.7	Low	145 Å²	145	153.3 Å²	153.3	74%	0.744	79%	0.791	S	S	*	*	G	3₁₀ helix	trans	-55.3	-27.4	179.6	-61.3	163.8	0	0	0	111.3	D10 S11	I8-D10 VanDerWaalsContact C-N 3.31Å; I8-D10 PolarHBondContact O-N 3.42Å; I8-S11 PolarHBondContact O-N 3.46Å
9	T	71.8	Confident	67.2	Low	106 Å²	106	158.5 Å²	158.5	65%	0.65	80%	0.8	S	S	*	*	G	3₁₀ helix	trans	-70.9	-17.8	179.7	55	0	0	0	0	114.7	L7 S11	L7-T9 PolarHBondContact O-N 3.09Å; T9-S11 PolarHBondContact O-N 3.08Å
10	D	69.6	Low	66.6	Low	130 Å²	130	162.5 Å²	162.5	70%	0.695	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-77.9	-8.8	178.7	-84.5	-38	0	0	0	113.2	L7 I8	L7-D10 PolarHBondContact O-N 3.31Å; I8-D10 VanDerWaalsContact C-N 3.31Å; I8-D10 PolarHBondContact O-N 3.42Å
11	S	75	Confident	66.3	Low	100 Å²	100	158.6 Å²	158.6	70%	0.699	81%	0.806	S	S	*	*	G	3₁₀ helix	trans	-84.4	-11	-173.3	-57.9	0	0	0	0	114.1	I8 T9	I8-S11 PolarHBondContact O-N 3.46Å; T9-S11 PolarHBondContact O-N 3.08Å
12	F	74.9	Confident	66.4	Low	161 Å²	161	150.5 Å²	150.5	71%	0.706	78%	0.783	S	S	*	*	S	Bend	trans	-96.3	128.9	-174.5	-63.9	-80.3	0	0	0	112.3	V14	F12-V14 PolarHBondContact O-N 3.02Å
13	K	73.9	Confident	66.5	Low	207 Å²	207	154.2 Å²	154.2	90%	0.9	79%	0.788	S	S	*	*			trans	-74.5	118.1	175.5	-68.3	-178.1	179.3	175.9	0	110.5	L15	K13-L15 PolarHBondContact O-N 2.72Å
14	V	69.3	Low	66.2	Low	136 Å²	136	160.3 Å²	160.3	82%	0.824	80%	0.799	S	S	*	*			trans	-70.3	108.2	172.5	178.7	0	0	0	0	109.7	F12	F12-V14 PolarHBondContact O-N 3.02Å
15	L	72.4	Confident	65.6	Low	166 Å²	166	160.3 Å²	160.3	87%	0.869	80%	0.799	S	S	*	*			trans	-84.8	114	173.3	-170.1	72.7	0	0	0	109.9	K13 K17	K13-L15 PolarHBondContact O-N 2.72Å; L15-K17 PolarHBondContact O-N 2.87Å
16	K	65.6	Low	64.7	Low	191 Å²	191	159.3 Å²	159.3	83%	0.83	80%	0.8	S	S	*	*			trans	-75.8	111.8	171.7	-74.4	-165.7	175.1	-179.9	0	110.3	T18	K16-T18 PolarHBondContact O-N 3.17Å
17	K	60	Low	63.8	Low	199 Å²	199	162.5 Å²	162.5	87%	0.865	81%	0.807	S	S	*	*			trans	-74.5	116	172.7	-172.1	154.3	-178.5	169.1	0	110	L15 R19	L15-K17 PolarHBondContact O-N 2.87Å; K17-R19 PolarHBondContact O-N 3.16Å
18	T	59.8	Low	62.8	Low	115 Å²	115	162.1 Å²	162.1	71%	0.706	81%	0.812	S	S	*	*			trans	-72	124.5	171.8	54	0	0	0	0	109.3	K16 R20	K16-T18 PolarHBondContact O-N 3.17Å; T18-R20 PolarHBondContact O-N 2.93Å
19	R	59.7	Low	62	Low	252 Å²	252	161.4 Å²	161.4	95%	0.951	82%	0.815	S	S	*	*			trans	-73.3	92.8	171.7	-70.9	-179.9	75.5	-179.2	3.7	108.3	K17 G21	K17-R19 PolarHBondContact O-N 3.16Å; R19-G21 PolarHBondContact O-N 3.31Å; R19-G21 VanDerWaalsContact O-N 3.09Å
20	R	54.7	Low	61.7	Low	237 Å²	237	161.7 Å²	161.7	89%	0.894	82%	0.818	S	S	*	*			trans	-73.1	95.2	165.8	-80.8	-177	153.3	-178.5	-6.1	108.8	T18 G22	T18-R20 PolarHBondContact O-N 2.93Å; R20-G22 PolarHBondContact O-N 3.43Å; R20-G22 VanDerWaalsContact O-N 3.08Å
21	G	59.2	Low	61.4	Low	82 Å²	82	161.1 Å²	161.1	85%	0.845	82%	0.821	S	S	*	*			trans	-67.3	96.6	166.8	0	0	0	0	0	110	R19	R19-G21 PolarHBondContact O-N 3.31Å; R19-G21 VanDerWaalsContact O-N 3.09Å
22	G	53	Low	60.7	Low	67 Å²	67	162.4 Å²	162.4	69%	0.691	83%	0.828	S	S	*	*			trans	-100.8	113.9	175.2	0	0	0	0	0	111.2	R20 R24	R20-G22 PolarHBondContact O-N 3.43Å; R20-G22 VanDerWaalsContact O-N 3.08Å; G22-R24 PolarHBondContact O-N 3.42Å
23	K	55.7	Low	59.8	Low	209 Å²	209	159.2 Å²	159.2	91%	0.909	83%	0.831	S	S	*	*			trans	-62.9	111.8	178.4	-146.3	165.2	-177.2	173.4	0	109.6	K25	K23-K25 PolarHBondContact O-N 3.39Å
24	R	55.6	Low	58.8	Low	244 Å²	244	156.4 Å²	156.4	92%	0.921	82%	0.821	S	S	*	*			trans	-65.6	111.7	176.8	-77.4	177.4	146.4	178.8	-7.9	110.1	G22	G22-R24 PolarHBondContact O-N 3.42Å
25	K	52.9	Low	58.2	Low	201 Å²	201	158.1 Å²	158.1	87%	0.874	82%	0.82	S	S	*	*			trans	-81.6	131.2	165.7	-68.8	-158.8	177.6	-170.7	0	109	K23	K23-K25 PolarHBondContact O-N 3.39Å
26	K	55	Low	57.3	Low	205 Å²	205	157.5 Å²	157.5	89%	0.891	81%	0.813	S	S	*	*			trans	-78.5	128.2	172.1	-67.6	178.8	176.1	-178.5	0	109.4
27	T	52.5	Low	56.7	Low	133 Å²	133	152 Å²	152	82%	0.816	79%	0.792	S	S	*	*			trans	-159.2	168.4	152.9	51.6	0	0	0	0	108.1
28	P	55.8	Low	56.7	Low	119 Å²	119	147 Å²	147	77%	0.773	78%	0.778	S	S	*	*				-112	178	-82.3	24.3	-2.7	0	0	0	111.4
29	T	55.5	Low	56.7	Low	130 Å²	130	146.2 Å²	146.2	80%	0.798	77%	0.773	S	S	*	*			trans	-33.9	136.4	-178.2	-35.5	0	0	0	0	116
30	P	65.3	Low	57	Low	112 Å²	112	138.1 Å²	138.1	73%	0.727	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-69.7	143.4	175.1	27.8	-32.1	0	0	0	111.8
31	P	64.1	Low	58.1	Low	117 Å²	117	129.7 Å²	129.7	76%	0.76	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-70.8	160.1	171	29.5	-31.5	0	0	0	111.4
32	P	60.4	Low	59.4	Low	128 Å²	128	129.1 Å²	129.1	83%	0.831	71%	0.707	S	S	*	*	S	Bend	trans	-85.6	138.4	-166.3	20.4	-9.3	0	0	0	114.4
33	A	56.3	Low	61	Low	93 Å²	93	129.9 Å²	129.9	77%	0.769	69%	0.691	S	S	*	*			trans	63.6	89.1	154.2	0	0	0	0	0	118.8
34	Q	52.7	Low	62.6	Low	149 Å²	149	125.5 Å²	125.5	70%	0.696	67%	0.674	S	S	*	*			trans	-78.7	112	165	-63.3	159.5	-67.6	0	0	109.5	D37	Q34-D37 HydrophobicContact CB-CB 4.32Å; Q34-D37 WeakPolarHBondContact CB-OD2 3.32Å; Q34-D37 WeakPolarHBondContact CG-OD2 3.43Å; Q34-D37 PolarHBondContact NE2-OD2 3.29Å
35	Q	55.4	Low	64.3	Low	171 Å²	171	119.4 Å²	119.4	80%	0.799	66%	0.656	S	S	*	*	S	Bend	trans	-92.3	-11.8	167.5	-70.3	-179.6	-13.6	0	0	112.1
36	E	53.1	Low	66.2	Low	154 Å²	154	112.1 Å²	112.1	72%	0.72	63%	0.625	S	S	*	*	S	Bend	trans	-80.1	-24.7	-177.8	-36.3	-79.9	153.7	0	0	113.4	T39 T40	E36-T39 PolarHBondContact O-OG1 3.17Å; E36-T40 PolarHBondContact O-OG1 2.98Å
37	D	54.7	Low	68	Low	74 Å²	74	103.8 Å²	103.8	40%	0.396	59%	0.589	S	S	.	*	H	α-helix	trans	-78.4	-17.9	-174.1	-85.7	-62.6	0	0	0	113.8	Q34 T40 T41	Q34-D37 HydrophobicContact CB-CB 4.32Å; Q34-D37 WeakPolarHBondContact CB-OD2 3.32Å; Q34-D37 WeakPolarHBondContact CG-OD2 3.43Å; Q34-D37 PolarHBondContact NE2-OD2 3.29Å; D37-T40 PolarHBondContact O-OG1 3.03Å; D37-T41 WeakPolarHBondContact O-CG2 3.4Å; D37-T41 PolarHBondContact O-OG1 3.04Å
38	V	58.5	Low	69.9	Low	95 Å²	95	102.7 Å²	102.7	58%	0.576	58%	0.575	S	S	*	*	H	α-helix	trans	-86.8	-30.8	-174.3	-163.1	0	0	0	0	111.8	T41 V42	V38-T41 VanDerWaalsContact C-OG1 3.32Å; V38-T41 WeakPolarHBondContact CA-OG1 3.42Å; V38-T41 PolarHBondContact O-OG1 3.49Å; V38-V42 WeakPolarHBondContact O-CG2 3.19Å
39	T	60.9	Low	71.8	Confident	99 Å²	99	101.3 Å²	101.3	61%	0.607	56%	0.559	S	S	*	*	H	α-helix	trans	-79.8	-34.5	-180	52.9	0	0	0	0	112.1	E36 K43	E36-T39 PolarHBondContact O-OG1 3.17Å; T39-K43 PolarHBondContact O-N 2.99Å
40	T	64.8	Low	73.6	Confident	81 Å²	81	95.2 Å²	95.2	50%	0.497	52%	0.521	S	S	.	.	H	α-helix	trans	-66.6	-38.7	175.7	49.5	0	0	0	0	111.9	E36 D37 K43 E44	E36-T40 PolarHBondContact O-OG1 2.98Å; D37-T40 PolarHBondContact O-OG1 3.03Å; T40-K43 PolarHBondContact O-N 3.01Å; T40-E44 WeakPolarHBondContact O-CB 3.42Å; T40-E44 PolarHBondContact O-N 3.46Å
41	T	78.9	Confident	75	Confident	61 Å²	61	93.7 Å²	93.7	37%	0.374	50%	0.503	S	S	.	.	H	α-helix	trans	-64.9	-44	178.4	43.3	0	0	0	0	112.3	D37 V38 E44 E45	D37-T41 WeakPolarHBondContact O-CG2 3.4Å; D37-T41 PolarHBondContact O-OG1 3.04Å; V38-T41 VanDerWaalsContact C-OG1 3.32Å; V38-T41 WeakPolarHBondContact CA-OG1 3.42Å; V38-T41 PolarHBondContact O-OG1 3.49Å; T41-E44 PolarHBondContact O-N 3.26Å; T41-E45 WeakPolarHBondContact O-CG 3.35Å; T41-E45 PolarHBondContact O-N 2.86Å
42	V	85.6	Confident	76.4	Confident	70 Å²	70	94 Å²	94	42%	0.424	49%	0.494	S	S	.	.	H	α-helix	trans	-61.3	-48.5	176.8	176.8	0	0	0	0	111.4	V38 E44 E45 E46	V38-V42 WeakPolarHBondContact O-CG2 3.19Å; V42-E44 VanDerWaalsContact C-N 3.25Å; V42-E44 PolarHBondContact O-N 3.3Å; V42-E45 PolarHBondContact O-N 3.32Å; V42-E45 VanDerWaalsContact O-N 3.17Å; V42-E46 HydrophobicContact CG1-CG 4.48Å; V42-E46 WeakPolarHBondContact O-CG 3.35Å; V42-E46 PolarHBondContact O-N 3.38Å
43	K	87.6	Confident	78.1	Confident	83 Å²	83	88.1 Å²	88.1	36%	0.361	46%	0.456	S	S	.	.	H	α-helix	trans	-58.2	-40.3	177.9	-161.4	-166.3	175.3	-169.5	0	111.7	T39 T40 M47 E97 Y98	T39-K43 PolarHBondContact O-N 2.99Å; T40-K43 PolarHBondContact O-N 3.01Å; K43-M47 WeakPolarHBondContact O-CB 3.39Å; K43-M47 PolarHBondContact O-N 3.44Å; K43-M47 VanDerWaalsContact O-N 3.09Å; K43-E97 IonicContact NZ-OE2 3.83Å; K43-E97 PolarHBondContact NZ-OE2 3.41Å; K43-Y98 WeakPolarHBondContact CG-OH 3.16Å
44	E	89.1	Confident	79.9	Confident	116 Å²	116	83.9 Å²	83.9	54%	0.542	42%	0.42	S	S	.	.	H	α-helix	trans	-66.7	-40.9	178.7	-172.9	170	-169.3	0	0	112.1	T40 T41 V42 M47 Q48	T40-E44 WeakPolarHBondContact O-CB 3.42Å; T40-E44 PolarHBondContact O-N 3.46Å; T41-E44 PolarHBondContact O-N 3.26Å; V42-E44 VanDerWaalsContact C-N 3.25Å; V42-E44 PolarHBondContact O-N 3.3Å; E44-M47 PolarHBondContact O-N 3.19Å; E44-Q48 VanDerWaalsContact O-CG 3.31Å; E44-Q48 WeakPolarHBondContact O-CG 3.43Å; E44-Q48 PolarHBondContact O-N 2.9Å
45	E	91.6	Very high	81.8	Confident	116 Å²	116	81.4 Å²	81.4	54%	0.542	41%	0.411	S	S	.	.	H	α-helix	trans	-63.1	-47.3	176.7	-73.3	175.8	179.6	0	0	112.1	T41 V42 M47 Q48 Q49	T41-E45 WeakPolarHBondContact O-CG 3.35Å; T41-E45 PolarHBondContact O-N 2.86Å; V42-E45 PolarHBondContact O-N 3.32Å; V42-E45 VanDerWaalsContact O-N 3.17Å; E45-M47 VanDerWaalsContact C-N 3.31Å; E45-M47 PolarHBondContact O-N 2.99Å; E45-Q48 WeakPolarHBondContact O-CB 3.46Å; E45-Q48 PolarHBondContact O-N 2.94Å; E45-Q48 VanDerWaalsContact O-N 3.14Å; E45-Q49 WeakPolarHBondContact O-CG 3.37Å; E45-Q49 PolarHBondContact O-N 3.09Å
46	E	92.6	Very high	83.7	Confident	48 Å²	48	74.3 Å²	74.3	22%	0.224	38%	0.379	C	S	.	.	H	α-helix	trans	-56.5	-46.2	174.6	-69.6	177.9	169.5	0	0	111.7	V42 Q48 Q49 L50 L88 Y98	V42-E46 HydrophobicContact CG1-CG 4.48Å; V42-E46 WeakPolarHBondContact O-CG 3.35Å; V42-E46 PolarHBondContact O-N 3.38Å; E46-Q48 VanDerWaalsContact C-N 3.31Å; E46-Q48 PolarHBondContact O-N 3.37Å; E46-Q49 WeakPolarHBondContact O-CB 3.43Å; E46-Q49 PolarHBondContact O-N 3.06Å; E46-L50 PolarHBondContact O-N 3.34Å; E46-L88 HydrophobicContact CB-CD1 3.6Å; E46-L88 HydrophobicContact CB-CD2 4.4Å; E46-L88 HydrophobicContact CG-CD1 3.42Å; E46-L88 VanDerWaalsContact CG-CD1 3.42Å; E46-Y98 HydrophobicContact CB-CE1 4.21Å; E46-Y98 PolarHBondContact OE2-OH 3.36Å
47	M	92.3	Very high	85.5	Confident	30 Å²	30	77.3 Å²	77.3	15%	0.148	38%	0.383	C	S	.	.	H	α-helix	trans	-64.6	-37.2	177.9	-166.9	-168.9	-53.2	0	0	111.7	K43 E44 E45 Q49 L50 K51 E97	K43-M47 WeakPolarHBondContact O-CB 3.39Å; K43-M47 PolarHBondContact O-N 3.44Å; K43-M47 VanDerWaalsContact O-N 3.09Å; E44-M47 PolarHBondContact O-N 3.19Å; E45-M47 VanDerWaalsContact C-N 3.31Å; E45-M47 PolarHBondContact O-N 2.99Å; M47-Q49 VanDerWaalsContact C-N 3.34Å; M47-L50 PolarHBondContact O-N 3.43Å; M47-K51 HydrophobicContact CG-CD 4.43Å; M47-K51 WeakPolarHBondContact O-CB 3.39Å; M47-K51 VanDerWaalsContact O-CG 3.22Å; M47-K51 WeakPolarHBondContact O-CG 3.21Å; M47-K51 PolarHBondContact O-N 3.14Å; M47-K51 PolarHBondContact SD-NZ 3.29Å; M47-E97 HydrophobicContact CE-CG 4.44Å; M47-E97 WeakPolarHBondContact CE-OE1 3.31Å
48	Q	93.3	Very high	87.4	Confident	111 Å²	111	80.7 Å²	80.7	52%	0.519	39%	0.391	S	S	.	.	H	α-helix	trans	-63.2	-39.6	174.1	-76.3	-178.9	14.3	0	0	111.8	E44 E45 E46 K51 Q52	E44-Q48 VanDerWaalsContact O-CG 3.31Å; E44-Q48 WeakPolarHBondContact O-CG 3.43Å; E44-Q48 PolarHBondContact O-N 2.9Å; E45-Q48 WeakPolarHBondContact O-CB 3.46Å; E45-Q48 PolarHBondContact O-N 2.94Å; E45-Q48 VanDerWaalsContact O-N 3.14Å; E46-Q48 VanDerWaalsContact C-N 3.31Å; E46-Q48 PolarHBondContact O-N 3.37Å; Q48-K51 PolarHBondContact O-N 3.41Å; Q48-Q52 WeakPolarHBondContact O-CB 3.34Å; Q48-Q52 PolarHBondContact O-N 3.38Å
49	Q	94.3	Very high	89.1	Confident	90 Å²	90	76.8 Å²	76.8	42%	0.421	37%	0.366	S	S	.	.	H	α-helix	trans	-62.1	-45	174.7	-66.8	176.8	2.8	0	0	111.7	E45 E46 M47 K51 Q52 F53	E45-Q49 WeakPolarHBondContact O-CG 3.37Å; E45-Q49 PolarHBondContact O-N 3.09Å; E46-Q49 WeakPolarHBondContact O-CB 3.43Å; E46-Q49 PolarHBondContact O-N 3.06Å; M47-Q49 VanDerWaalsContact C-N 3.34Å; Q49-K51 VanDerWaalsContact C-N 3.34Å; Q49-K51 PolarHBondContact O-N 2.79Å; Q49-Q52 PolarHBondContact O-N 3.15Å; Q49-F53 PolarHBondContact O-N 2.65Å
50	L	94.5	Very high	90.5	Very high	1 Å²	1	73.3 Å²	73.3	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-61.4	-41	175.5	-69.8	-176.7	0	0	0	112.5	E46 M47 F53 D54 I85 L88 L89 Y98	E46-L50 PolarHBondContact O-N 3.34Å; M47-L50 PolarHBondContact O-N 3.43Å; L50-F53 WeakPolarHBondContact O-CB 3.25Å; L50-F53 PolarHBondContact O-N 2.95Å; L50-D54 PolarHBondContact O-N 2.69Å; L50-I85 HydrophobicContact CD2-CG2 3.89Å; L50-L88 HydrophobicContact CD1-CD2 3.47Å; L50-L88 VanDerWaalsContact CD1-CD2 3.47Å; L50-L88 HydrophobicContact CD2-CD2 3.54Å; L50-L88 HydrophobicContact CG-CD2 3.43Å; L50-L88 VanDerWaalsContact CG-CD2 3.43Å; L50-L89 HydrophobicContact CD1-CD2 4.43Å; L50-L89 HydrophobicContact CD2-CD2 4.03Å; L50-L89 HydrophobicContact CD2-CG 4.16Å; L50-Y98 HydrophobicContact CD1-CD1 3.54Å; L50-Y98 HydrophobicContact CD1-CE1 4.22Å; L50-Y98 HydrophobicContact CD1-CG 4.01Å
51	K	93.9	Very high	91.8	Very high	80 Å²	80	73.5 Å²	73.5	35%	0.348	35%	0.352	S	S	.	.	H	α-helix	trans	-64.8	-41.5	175.5	-71.4	174.5	177.7	165.3	0	111.6	M47 Q48 Q49 F53 D54 L55 L102	M47-K51 HydrophobicContact CG-CD 4.43Å; M47-K51 WeakPolarHBondContact O-CB 3.39Å; M47-K51 VanDerWaalsContact O-CG 3.22Å; M47-K51 WeakPolarHBondContact O-CG 3.21Å; M47-K51 PolarHBondContact O-N 3.14Å; M47-K51 PolarHBondContact SD-NZ 3.29Å; Q48-K51 PolarHBondContact O-N 3.41Å; Q49-K51 VanDerWaalsContact C-N 3.34Å; Q49-K51 PolarHBondContact O-N 2.79Å; K51-F53 VanDerWaalsContact C-N 3.28Å; K51-F53 PolarHBondContact O-N 3.03Å; K51-D54 WeakPolarHBondContact O-CB 3.1Å; K51-D54 PolarHBondContact O-N 3.21Å; K51-L55 WeakPolarHBondContact O-CG 3.14Å; K51-L55 PolarHBondContact O-N 2.93Å; K51-L102 HydrophobicContact CB-CD1 4.16Å; K51-L102 HydrophobicContact CD-CD1 4.04Å; K51-L102 HydrophobicContact CG-CD1 3.66Å
52	Q	94.6	Very high	92.4	Very high	123 Å²	123	70.7 Å²	70.7	58%	0.575	34%	0.335	S	S	*	.	H	α-helix	trans	-63.3	-38.2	177	-174.4	56	67.1	0	0	111.4	Q48 Q49 L55 D56	Q48-Q52 WeakPolarHBondContact O-CB 3.34Å; Q48-Q52 PolarHBondContact O-N 3.38Å; Q49-Q52 PolarHBondContact O-N 3.15Å; Q52-L55 PolarHBondContact O-N 3.22Å; Q52-D56 PolarHBondContact O-N 3.34Å
53	F	95.4	Very high	92.5	Very high	6 Å²	6	70.3 Å²	70.3	3%	0.026	33%	0.333	C	S	.	.	H	α-helix	trans	-62.3	-49.3	171.2	178.5	-114.5	0	0	0	111.4	Q49 L50 K51 L55 D56 F59 R70 W71 P81 I85	Q49-F53 PolarHBondContact O-N 2.65Å; L50-F53 WeakPolarHBondContact O-CB 3.25Å; L50-F53 PolarHBondContact O-N 2.95Å; K51-F53 VanDerWaalsContact C-N 3.28Å; K51-F53 PolarHBondContact O-N 3.03Å; F53-L55 PolarHBondContact O-N 3Å; F53-D56 WeakPolarHBondContact O-CB 3.45Å; F53-D56 PolarHBondContact O-N 2.94Å; F53-F59 AromaticContact CD2-CD2 3.53Å; F53-F59 HydrophobicContact CD2-CD2 3.53Å; F53-F59 AromaticContact CD2-CE2 3.85Å; F53-F59 HydrophobicContact CD2-CE2 3.85Å; F53-F59 HydrophobicContact CD2-CG 4.36Å; F53-F59 HydrophobicContact CE2-CB 4Å; F53-F59 AromaticContact CE2-CD2 3.33Å; F53-F59 HydrophobicContact CE2-CD2 3.33Å; F53-F59 AromaticContact CE2-CE2 3.89Å; F53-F59 HydrophobicContact CE2-CE2 3.89Å; F53-F59 AromaticContact CE2-CG 3.7Å; F53-F59 HydrophobicContact CE2-CG 3.7Å; F53-F59 HydrophobicContact CZ-CB 4.38Å; F53-F59 HydrophobicContact CZ-CD2 4.43Å; F53-R70 VanDerWaalsContact C-NH1 3.27Å; F53-R70 HydrophobicContact CE1-CB 4.46Å; F53-R70 HydrophobicContact CE1-CG 4.37Å; F53-R70 HydrophobicContact CZ-CG 4.36Å; F53-R70 PolarHBondContact O-NH1 3.23Å; F53-W71 HydrophobicContact CZ-CB 4.24Å; F53-P81 HydrophobicContact CE2-CB 4.22Å; F53-I85 HydrophobicContact CB-CD1 3.59Å; F53-I85 HydrophobicContact CB-CG1 4.5Å; F53-I85 HydrophobicContact CD1-CD1 4.43Å; F53-I85 HydrophobicContact CD1-CG2 4.15Å; F53-I85 HydrophobicContact CD2-CD1 3.5Å; F53-I85 HydrophobicContact CE1-CG2 4.38Å; F53-I85 HydrophobicContact CE2-CD1 4.25Å; F53-I85 HydrophobicContact CG-CD1 3.6Å; F53-I85 HydrophobicContact CG-CG2 4.37Å
54	D	94.3	Very high	92.6	Very high	3 Å²	3	70.3 Å²	70.3	2%	0.016	36%	0.356	C	S	.	.	H	α-helix	trans	-52	-38.8	176.8	-75.8	-14.9	0	0	0	113.2	L50 K51 C62 R67 R70 L102	L50-D54 PolarHBondContact O-N 2.69Å; K51-D54 WeakPolarHBondContact O-CB 3.1Å; K51-D54 PolarHBondContact O-N 3.21Å; D54-C62 PolarHBondContact O-SG 3.37Å; D54-R67 IonicContact OD1-NE 2.72Å; D54-R67 PolarHBondContact OD1-NE 2.93Å; D54-R67 IonicContact OD2-CZ 2.85Å; D54-R67 VanDerWaalsContact OD2-CZ 3.26Å; D54-R67 IonicContact OD2-NE 3.26Å; D54-R67 PolarHBondContact OD2-NE 3.47Å; D54-R67 IonicContact OD2-NH2 3.37Å; D54-R67 PolarHBondContact OD2-NH2 3.04Å; D54-R70 PolarHBondContact O-NH1 3.21Å; D54-R70 PolarHBondContact O-NH2 2.99Å; D54-R70 IonicContact OD1-NH1 2.94Å; D54-L102 HydrophobicContact CB-CB 4.21Å; D54-L102 PolarHBondContact OD2-N 3.2Å
55	L	93.1	Very high	92.8	Very high	98 Å²	98	66.1 Å²	66.1	51%	0.513	34%	0.337	S	S	.	.	H	α-helix	trans	-80.7	-15.5	179.7	-66.8	173.2	0	0	0	114.3	K51 Q52 F53 W57 W103	K51-L55 WeakPolarHBondContact O-CG 3.14Å; K51-L55 PolarHBondContact O-N 2.93Å; Q52-L55 PolarHBondContact O-N 3.22Å; F53-L55 PolarHBondContact O-N 3Å; L55-W57 PolarHBondContact O-N 3.44Å; L55-W103 HydrophobicContact CD2-CZ2 4.24Å
56	D	94.1	Very high	92.9	Very high	22 Å²	22	61.3 Å²	61.3	12%	0.118	32%	0.316	C	S	.	.			trans	-77.6	106.9	-178.3	-169.3	-13.2	0	0	0	111.3	Q52 F53 R58 F59 R70	Q52-D56 PolarHBondContact O-N 3.34Å; F53-D56 WeakPolarHBondContact O-CB 3.45Å; F53-D56 PolarHBondContact O-N 2.94Å; D56-R58 PolarHBondContact O-N 3.42Å; D56-R58 VanDerWaalsContact OD1-CB 3.25Å; D56-R58 WeakPolarHBondContact OD1-CB 3.22Å; D56-R58 WeakPolarHBondContact OD1-CG 3.49Å; D56-R58 PolarHBondContact OD1-N 3.42Å; D56-R58 IonicContact OD1-NE 3.03Å; D56-R58 PolarHBondContact OD1-NE 2.92Å; D56-R58 IonicContact OD2-CZ 3.2Å; D56-R58 IonicContact OD2-NE 2.95Å; D56-R58 PolarHBondContact OD2-NE 3.48Å; D56-R58 IonicContact OD2-NH2 2.65Å; D56-R58 PolarHBondContact OD2-NH2 3.2Å; D56-F59 HydrophobicContact CB-CD2 3.92Å; D56-F59 HydrophobicContact CB-CE2 4.12Å; D56-F59 WeakPolarHBondContact OD2-CE2 3.48Å; D56-R70 PolarHBondContact O-NH2 3.21Å
57	W	91.6	Very high	93	Very high	216 Å²	216	59.4 Å²	59.4	82%	0.818	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-64.8	-20	-179.2	61	-91.7	0	0	0	113.6	L55 F59 G60	L55-W57 PolarHBondContact O-N 3.44Å; W57-F59 PolarHBondContact O-N 3.24Å; W57-G60 PolarHBondContact O-N 3.31Å; W57-G60 VanDerWaalsContact O-N 3.1Å
58	R	93.9	Very high	93.2	Very high	145 Å²	145	59.2 Å²	59.2	55%	0.547	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-62.2	-31.4	-176.4	-63.2	178.6	-62.7	166.7	2.3	112.5	D56 G60 L79	D56-R58 PolarHBondContact O-N 3.42Å; D56-R58 VanDerWaalsContact OD1-CB 3.25Å; D56-R58 WeakPolarHBondContact OD1-CB 3.22Å; D56-R58 WeakPolarHBondContact OD1-CG 3.49Å; D56-R58 PolarHBondContact OD1-N 3.42Å; D56-R58 IonicContact OD1-NE 3.03Å; D56-R58 PolarHBondContact OD1-NE 2.92Å; D56-R58 IonicContact OD2-CZ 3.2Å; D56-R58 IonicContact OD2-NE 2.95Å; D56-R58 PolarHBondContact OD2-NE 3.48Å; D56-R58 IonicContact OD2-NH2 2.65Å; D56-R58 PolarHBondContact OD2-NH2 3.2Å; R58-G60 VanDerWaalsContact C-N 3.29Å; R58-L79 VanDerWaalsContact O-CD1 3.26Å; R58-L79 WeakPolarHBondContact O-CD1 3.36Å
59	F	93.9	Very high	93.2	Very high	14 Å²	14	58.7 Å²	58.7	6%	0.061	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-89	7.4	-178.8	-54.1	-56.2	0	0	0	113.6	F53 D56 W57 A74 L79 P81	F53-F59 AromaticContact CD2-CD2 3.53Å; F53-F59 HydrophobicContact CD2-CD2 3.53Å; F53-F59 AromaticContact CD2-CE2 3.85Å; F53-F59 HydrophobicContact CD2-CE2 3.85Å; F53-F59 HydrophobicContact CD2-CG 4.36Å; F53-F59 HydrophobicContact CE2-CB 4Å; F53-F59 AromaticContact CE2-CD2 3.33Å; F53-F59 HydrophobicContact CE2-CD2 3.33Å; F53-F59 AromaticContact CE2-CE2 3.89Å; F53-F59 HydrophobicContact CE2-CE2 3.89Å; F53-F59 AromaticContact CE2-CG 3.7Å; F53-F59 HydrophobicContact CE2-CG 3.7Å; F53-F59 HydrophobicContact CZ-CB 4.38Å; F53-F59 HydrophobicContact CZ-CD2 4.43Å; D56-F59 HydrophobicContact CB-CD2 3.92Å; D56-F59 HydrophobicContact CB-CE2 4.12Å; D56-F59 WeakPolarHBondContact OD2-CE2 3.48Å; W57-F59 PolarHBondContact O-N 3.24Å; F59-A74 HydrophobicContact CB-CB 3.9Å; F59-A74 HydrophobicContact CD1-CB 3.94Å; F59-A74 HydrophobicContact CG-CB 4.3Å; F59-L79 HydrophobicContact CD1-CB 4.05Å; F59-L79 HydrophobicContact CE1-CB 4.39Å; F59-P81 HydrophobicContact CD1-CB 4.08Å; F59-P81 HydrophobicContact CE1-CB 4Å; F59-P81 HydrophobicContact CZ-CB 4.49Å
60	G	90.6	Very high	93.3	Very high	25 Å²	25	54.6 Å²	54.6	26%	0.258	28%	0.284	S	S	.	.			trans	84.8	-179.1	179.9	0	0	0	0	0	113.7	W57 R58 R70	W57-G60 PolarHBondContact O-N 3.31Å; W57-G60 VanDerWaalsContact O-N 3.1Å; R58-G60 VanDerWaalsContact C-N 3.29Å; G60-R70 VanDerWaalsContact O-CZ 3.24Å; G60-R70 PolarHBondContact O-NE 3.14Å; G60-R70 PolarHBondContact O-NH2 3.1Å
61	P	92.4	Very high	93.4	Very high	86 Å²	86	54.8 Å²	54.8	56%	0.558	29%	0.285	S	S	*	.			trans	-67.3	137.9	-175.4	27.7	-34.4	0	0	0	111.9	I65	P61-I65 WeakPolarHBondContact O-CD1 3.42Å
62	C	90.9	Very high	93.5	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.014	29%	0.292	C	S	.	.			trans	-100.6	-5.9	175.3	68	0	0	0	0	114.3	D54 R70 S101 W103	D54-C62 PolarHBondContact O-SG 3.37Å; C62-R70 VanDerWaalsContact CB-CD 3.44Å; C62-S101 WeakPolarHBondContact O-CB 3.32Å; C62-S101 PolarHBondContact O-OG 3.3Å; C62-S101 PolarHBondContact SG-OG 2.94Å; C62-W103 WeakPolarHBondContact SG-CZ3 3.45Å
63	T	89.4	Confident	93.6	Very high	62 Å²	62	54.9 Å²	54.9	38%	0.38	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	136	178	50.4	0	0	0	0	111.2	I65 W103 F108	T63-I65 VanDerWaalsContact C-N 3.28Å; T63-I65 PolarHBondContact O-N 2.83Å; T63-W103 HydrophobicContact CG2-CB 4.37Å; T63-W103 HydrophobicContact CG2-CD2 4.16Å; T63-W103 HydrophobicContact CG2-CE3 3.32Å; T63-W103 HydrophobicContact CG2-CZ3 3.9Å; T63-F108 HydrophobicContact CG2-CZ 4.09Å
64	G	88.6	Confident	93.6	Very high	82 Å²	82	54.6 Å²	54.6	85%	0.845	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	9.1	172.3	0	0	0	0	0	115.7
65	I	93.1	Very high	93.7	Very high	28 Å²	28	59.7 Å²	59.7	14%	0.144	30%	0.303	C	S	.	.	S	Bend	trans	-135.8	159.1	175.2	60.8	176.4	0	0	0	110.6	P61 T63 Q69 R70	P61-I65 WeakPolarHBondContact O-CD1 3.42Å; T63-I65 VanDerWaalsContact C-N 3.28Å; T63-I65 PolarHBondContact O-N 2.83Å; I65-Q69 HydrophobicContact CB-CB 4.29Å; I65-R70 HydrophobicContact CD1-CB 3.63Å; I65-R70 HydrophobicContact CD1-CG 4.03Å; I65-R70 HydrophobicContact CG1-CB 4.26Å
66	S	94.1	Very high	93.8	Very high	15 Å²	15	62.2 Å²	62.2	11%	0.105	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-73.2	158.4	172.4	73.3	0	0	0	0	111.4	M68 Q69 R70 S99	S66-M68 PolarHBondContact O-N 2.96Å; S66-Q69 PolarHBondContact O-N 2.94Å; S66-Q69 VanDerWaalsContact OG-CG 3.28Å; S66-Q69 WeakPolarHBondContact OG-CG 3.45Å; S66-Q69 PolarHBondContact OG-N 3.15Å; S66-Q69 PolarHBondContact OG-OE1 2.72Å; S66-R70 PolarHBondContact O-N 3.03Å; S66-S99 WeakPolarHBondContact CB-O 3.32Å
67	R	95	Very high	93.8	Very high	8 Å²	8	67.4 Å²	67.4	3%	0.03	34%	0.34	C	S	.	.	H	α-helix	trans	-59.4	-37.2	175.9	-67.1	-165.4	-179.4	111.5	-0.2	111.6	D54 R70 W71 L89 E97 Y98 S99 M100	D54-R67 IonicContact OD1-NE 2.72Å; D54-R67 PolarHBondContact OD1-NE 2.93Å; D54-R67 IonicContact OD2-CZ 2.85Å; D54-R67 VanDerWaalsContact OD2-CZ 3.26Å; D54-R67 IonicContact OD2-NE 3.26Å; D54-R67 PolarHBondContact OD2-NE 3.47Å; D54-R67 IonicContact OD2-NH2 3.37Å; D54-R67 PolarHBondContact OD2-NH2 3.04Å; R67-R70 PolarHBondContact O-N 3.47Å; R67-W71 WeakPolarHBondContact O-CB 3.39Å; R67-W71 PolarHBondContact O-N 3.25Å; R67-L89 HydrophobicContact CB-CD1 3.69Å; R67-L89 HydrophobicContact CB-CD2 3.75Å; R67-L89 HydrophobicContact CB-CG 4.39Å; R67-E97 PolarHBondContact NH1-O 2.9Å; R67-Y98 WeakPolarHBondContact CD-O 3.12Å; R67-Y98 VanDerWaalsContact NH1-C 3.26Å; R67-Y98 PolarHBondContact NH1-O 3.48Å; R67-S99 PolarHBondContact N-O 2.96Å; R67-M100 PolarHBondContact NE-O 3.33Å; R67-M100 PolarHBondContact NH1-O 3.03Å; R67-M100 PolarHBondContact NH2-O 2.85Å
68	M	95.3	Very high	94	Very high	27 Å²	27	59.4 Å²	59.4	13%	0.133	32%	0.324	C	S	.	.	H	α-helix	trans	-62.5	-49.1	174.8	-79.8	-57.5	-67.6	0	0	112.6	S66 R70 W71 E72 K86 L89 L90	S66-M68 PolarHBondContact O-N 2.96Å; M68-R70 VanDerWaalsContact C-N 3.25Å; M68-R70 PolarHBondContact O-N 3.35Å; M68-W71 WeakPolarHBondContact O-CB 3.22Å; M68-W71 PolarHBondContact O-N 2.72Å; M68-W71 VanDerWaalsContact O-N 3.15Å; M68-E72 WeakPolarHBondContact O-CG 3.15Å; M68-E72 PolarHBondContact O-N 3.4Å; M68-K86 HydrophobicContact CE-CG 4.22Å; M68-K86 HydrophobicContact SD-CG 4.47Å; M68-L89 HydrophobicContact CG-CB 3.77Å; M68-L89 HydrophobicContact CG-CD1 3.94Å; M68-L89 HydrophobicContact CG-CG 4.35Å; M68-L89 HydrophobicContact SD-CB 3.25Å; M68-L89 WeakPolarHBondContact SD-CB 3.25Å; M68-L89 HydrophobicContact SD-CD1 3.53Å; M68-L89 VanDerWaalsContact SD-CD1 3.53Å; M68-L89 HydrophobicContact SD-CG 4.02Å; M68-L90 HydrophobicContact CE-CD2 4.24Å; M68-L90 HydrophobicContact CE-CG 4.49Å
69	Q	94.9	Very high	93.9	Very high	99 Å²	99	56.2 Å²	56.2	46%	0.463	32%	0.318	S	S	.	.	H	α-helix	trans	-60.3	-38.7	177.8	-75.1	171.4	-26.4	0	0	111.8	I65 S66 R73	I65-Q69 HydrophobicContact CB-CB 4.29Å; S66-Q69 PolarHBondContact O-N 2.94Å; S66-Q69 VanDerWaalsContact OG-CG 3.28Å; S66-Q69 WeakPolarHBondContact OG-CG 3.45Å; S66-Q69 PolarHBondContact OG-N 3.15Å; S66-Q69 PolarHBondContact OG-OE1 2.72Å; Q69-R73 VanDerWaalsContact O-CB 3.32Å; Q69-R73 WeakPolarHBondContact O-CB 3.42Å; Q69-R73 PolarHBondContact O-N 3.4Å
70	R	96.2	Very high	93.9	Very high	4 Å²	4	62.3 Å²	62.3	2%	0.015	35%	0.351	C	S	.	.	H	α-helix	trans	-65.1	-44	175.9	-170.8	-176.6	-175.8	-146.9	3.3	111.9	F53 D54 D56 G60 C62 I65 S66 R67 M68 R73 A74	F53-R70 VanDerWaalsContact C-NH1 3.27Å; F53-R70 HydrophobicContact CE1-CB 4.46Å; F53-R70 HydrophobicContact CE1-CG 4.37Å; F53-R70 HydrophobicContact CZ-CG 4.36Å; F53-R70 PolarHBondContact O-NH1 3.23Å; D54-R70 PolarHBondContact O-NH1 3.21Å; D54-R70 PolarHBondContact O-NH2 2.99Å; D54-R70 IonicContact OD1-NH1 2.94Å; D56-R70 PolarHBondContact O-NH2 3.21Å; G60-R70 VanDerWaalsContact O-CZ 3.24Å; G60-R70 PolarHBondContact O-NE 3.14Å; G60-R70 PolarHBondContact O-NH2 3.1Å; C62-R70 VanDerWaalsContact CB-CD 3.44Å; I65-R70 HydrophobicContact CD1-CB 3.63Å; I65-R70 HydrophobicContact CD1-CG 4.03Å; I65-R70 HydrophobicContact CG1-CB 4.26Å; S66-R70 PolarHBondContact O-N 3.03Å; R67-R70 PolarHBondContact O-N 3.47Å; M68-R70 VanDerWaalsContact C-N 3.25Å; M68-R70 PolarHBondContact O-N 3.35Å; R70-R73 PolarHBondContact O-N 3.02Å; R70-A74 WeakPolarHBondContact O-CB 3.02Å; R70-A74 PolarHBondContact O-N 3.29Å
71	W	96.1	Very high	94	Very high	6 Å²	6	61.7 Å²	61.7	2%	0.023	34%	0.342	C	S	.	.	H	α-helix	trans	-60.5	-47.8	177.5	-171.3	99	0	0	0	111.5	F53 R67 M68 R73 A74 K75 P81 P82 E83 K86	F53-W71 HydrophobicContact CZ-CB 4.24Å; R67-W71 WeakPolarHBondContact O-CB 3.39Å; R67-W71 PolarHBondContact O-N 3.25Å; M68-W71 WeakPolarHBondContact O-CB 3.22Å; M68-W71 PolarHBondContact O-N 2.72Å; M68-W71 VanDerWaalsContact O-N 3.15Å; W71-R73 PolarHBondContact O-N 2.72Å; W71-A74 PolarHBondContact O-N 2.81Å; W71-K75 HydrophobicContact CE3-CD 4.44Å; W71-K75 HydrophobicContact CH2-CD 3.4Å; W71-K75 VanDerWaalsContact CH2-CD 3.4Å; W71-K75 HydrophobicContact CZ2-CD 4.35Å; W71-K75 HydrophobicContact CZ3-CB 4.26Å; W71-K75 HydrophobicContact CZ3-CD 3.45Å; W71-K75 VanDerWaalsContact CZ3-CD 3.45Å; W71-K75 PolarHBondContact O-N 3.04Å; W71-P81 HydrophobicContact CD2-CG 3.97Å; W71-P81 HydrophobicContact CG-CB 4.27Å; W71-P81 HydrophobicContact CG-CG 4.1Å; W71-P81 HydrophobicContact CZ2-CG 4.09Å; W71-P82 PolarHBondContact NE1-O 2.96Å; W71-E83 WeakPolarHBondContact CH2-OE2 3.09Å; W71-E83 VanDerWaalsContact CZ2-OE2 3.24Å; W71-E83 WeakPolarHBondContact CZ2-OE2 3.09Å; W71-K86 HydrophobicContact CD2-CB 3.89Å; W71-K86 HydrophobicContact CD2-CG 4.1Å; W71-K86 HydrophobicContact CE3-CB 4.33Å; W71-K86 HydrophobicContact CE3-CD 4.29Å; W71-K86 HydrophobicContact CE3-CG 4.02Å; W71-K86 HydrophobicContact CG-CB 4.35Å; W71-K86 HydrophobicContact CH2-CB 4.21Å; W71-K86 HydrophobicContact CH2-CD 3.48Å; W71-K86 VanDerWaalsContact CH2-CD 3.48Å; W71-K86 HydrophobicContact CH2-CG 4.04Å; W71-K86 HydrophobicContact CZ2-CB 3.77Å; W71-K86 HydrophobicContact CZ2-CD 3.83Å; W71-K86 HydrophobicContact CZ2-CG 4.12Å; W71-K86 HydrophobicContact CZ3-CB 4.47Å; W71-K86 HydrophobicContact CZ3-CD 3.74Å; W71-K86 HydrophobicContact CZ3-CG 3.99Å
72	E	95.8	Very high	94.2	Very high	103 Å²	103	60.1 Å²	60.1	48%	0.481	33%	0.332	S	S	.	.	H	α-helix	trans	-59.8	-45.5	176.4	-71.5	174	171.9	0	0	111.8	M68 A74 K75 L76	M68-E72 WeakPolarHBondContact O-CG 3.15Å; M68-E72 PolarHBondContact O-N 3.4Å; E72-A74 PolarHBondContact O-N 2.85Å; E72-K75 PolarHBondContact O-N 3.2Å; E72-L76 VanDerWaalsContact O-CG 3.3Å; E72-L76 WeakPolarHBondContact O-CG 3.25Å; E72-L76 PolarHBondContact O-N 3.05Å
73	R	95.8	Very high	94.4	Very high	101 Å²	101	63.8 Å²	63.8	38%	0.381	35%	0.349	S	S	.	.	H	α-helix	trans	-59.1	-47	176	-176.5	-177.3	-61.7	167	0.8	111.5	Q69 R70 W71 K75 L76 H77	Q69-R73 VanDerWaalsContact O-CB 3.32Å; Q69-R73 WeakPolarHBondContact O-CB 3.42Å; Q69-R73 PolarHBondContact O-N 3.4Å; R70-R73 PolarHBondContact O-N 3.02Å; W71-R73 PolarHBondContact O-N 2.72Å; R73-K75 VanDerWaalsContact C-N 3.3Å; R73-K75 PolarHBondContact O-N 3Å; R73-L76 WeakPolarHBondContact O-CB 3.49Å; R73-L76 PolarHBondContact O-N 3.29Å; R73-H77 PolarHBondContact O-CD2 3.4Å; R73-H77 PolarHBondContact O-N 3.37Å
74	A	96.3	Very high	94.6	Very high	0 Å²	0	67 Å²	67	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-60.6	-40.6	177.8	0	0	0	0	0	112	F59 R70 W71 E72 H77 G78 L79 P81	F59-A74 HydrophobicContact CB-CB 3.9Å; F59-A74 HydrophobicContact CD1-CB 3.94Å; F59-A74 HydrophobicContact CG-CB 4.3Å; R70-A74 WeakPolarHBondContact O-CB 3.02Å; R70-A74 PolarHBondContact O-N 3.29Å; W71-A74 PolarHBondContact O-N 2.81Å; E72-A74 PolarHBondContact O-N 2.85Å; A74-H77 PolarHBondContact O-N 3.02Å; A74-G78 PolarHBondContact O-N 3.39Å; A74-L79 HydrophobicContact CB-CB 4.4Å; A74-L79 HydrophobicContact CB-CD1 4.38Å; A74-L79 WeakPolarHBondContact O-CB 3.45Å; A74-L79 PolarHBondContact O-N 3.15Å; A74-P81 HydrophobicContact CB-CB 4.14Å; A74-P81 HydrophobicContact CB-CG 3.98Å
75	K	95.8	Very high	94.9	Very high	110 Å²	110	63.6 Å²	63.6	48%	0.478	32%	0.322	S	S	.	.	H	α-helix	trans	-64.1	-43.1	174.1	-178.3	166.2	-177.7	167	0	112.3	W71 E72 R73 H77 G78 P81	W71-K75 HydrophobicContact CE3-CD 4.44Å; W71-K75 HydrophobicContact CH2-CD 3.4Å; W71-K75 VanDerWaalsContact CH2-CD 3.4Å; W71-K75 HydrophobicContact CZ2-CD 4.35Å; W71-K75 HydrophobicContact CZ3-CB 4.26Å; W71-K75 HydrophobicContact CZ3-CD 3.45Å; W71-K75 VanDerWaalsContact CZ3-CD 3.45Å; W71-K75 PolarHBondContact O-N 3.04Å; E72-K75 PolarHBondContact O-N 3.2Å; R73-K75 VanDerWaalsContact C-N 3.3Å; R73-K75 PolarHBondContact O-N 3Å; K75-H77 PolarHBondContact O-N 2.98Å; K75-G78 PolarHBondContact O-N 3.28Å; K75-P81 HydrophobicContact CB-CG 4.14Å
76	L	96.1	Very high	95	Very high	151 Å²	151	64.7 Å²	64.7	79%	0.791	33%	0.326	S	S	*	.	H	α-helix	trans	-60.8	-34.4	175.2	-72.2	172.2	0	0	0	112.3	E72 R73 G78	E72-L76 VanDerWaalsContact O-CG 3.3Å; E72-L76 WeakPolarHBondContact O-CG 3.25Å; E72-L76 PolarHBondContact O-N 3.05Å; R73-L76 WeakPolarHBondContact O-CB 3.49Å; R73-L76 PolarHBondContact O-N 3.29Å; L76-G78 PolarHBondContact O-N 3.3Å
77	H	94.1	Very high	95	Very high	131 Å²	131	69.2 Å²	69.2	61%	0.606	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	2.8	174.2	-69.8	-63.4	0	0	0	114.2	R73 A74 K75 L79	R73-H77 PolarHBondContact O-CD2 3.4Å; R73-H77 PolarHBondContact O-N 3.37Å; A74-H77 PolarHBondContact O-N 3.02Å; K75-H77 PolarHBondContact O-N 2.98Å; H77-L79 VanDerWaalsContact C-N 3.28Å; H77-L79 HydrophobicContact CB-CD1 3.87Å; H77-L79 HydrophobicContact CB-CG 4.02Å; H77-L79 PolarHBondContact O-N 2.95Å
78	G	94.7	Very high	94.9	Very high	48 Å²	48	69.4 Å²	69.4	50%	0.495	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	20.5	178.8	0	0	0	0	0	114.2	A74 K75 L76 N80	A74-G78 PolarHBondContact O-N 3.39Å; K75-G78 PolarHBondContact O-N 3.28Å; L76-G78 PolarHBondContact O-N 3.3Å; G78-N80 PolarHBondContact O-N 3.37Å; G78-N80 PolarHBondContact O-ND2 3.4Å
79	L	92.5	Very high	94.8	Very high	78 Å²	78	68.2 Å²	68.2	41%	0.408	34%	0.341	S	S	.	.			trans	-81.4	-0.6	-177.3	-62.5	164.4	0	0	0	113.3	R58 F59 A74 H77	R58-L79 VanDerWaalsContact O-CD1 3.26Å; R58-L79 WeakPolarHBondContact O-CD1 3.36Å; F59-L79 HydrophobicContact CD1-CB 4.05Å; F59-L79 HydrophobicContact CE1-CB 4.39Å; A74-L79 HydrophobicContact CB-CB 4.4Å; A74-L79 HydrophobicContact CB-CD1 4.38Å; A74-L79 WeakPolarHBondContact O-CB 3.45Å; A74-L79 PolarHBondContact O-N 3.15Å; H77-L79 VanDerWaalsContact C-N 3.28Å; H77-L79 HydrophobicContact CB-CD1 3.87Å; H77-L79 HydrophobicContact CB-CG 4.02Å; H77-L79 PolarHBondContact O-N 2.95Å
80	N	93.3	Very high	94.7	Very high	143 Å²	143	67.8 Å²	67.8	77%	0.765	34%	0.342	S	S	*	.			trans	45.7	62.9	179.5	-62.7	-63.4	0	0	0	113.1	G78	G78-N80 PolarHBondContact O-N 3.37Å; G78-N80 PolarHBondContact O-ND2 3.4Å
81	P	94.6	Very high	94.4	Very high	11 Å²	11	74.6 Å²	74.6	7%	0.071	37%	0.374	C	S	.	.			trans	-62.6	151.2	175.5	30.8	-37.1	0	0	0	111.2	F53 F59 W71 A74 K75 E83	F53-P81 HydrophobicContact CE2-CB 4.22Å; F59-P81 HydrophobicContact CD1-CB 4.08Å; F59-P81 HydrophobicContact CE1-CB 4Å; F59-P81 HydrophobicContact CZ-CB 4.49Å; W71-P81 HydrophobicContact CD2-CG 3.97Å; W71-P81 HydrophobicContact CG-CB 4.27Å; W71-P81 HydrophobicContact CG-CG 4.1Å; W71-P81 HydrophobicContact CZ2-CG 4.09Å; A74-P81 HydrophobicContact CB-CB 4.14Å; A74-P81 HydrophobicContact CB-CG 3.98Å; K75-P81 HydrophobicContact CB-CG 4.14Å; P81-E83 PolarHBondContact O-N 3.03Å
82	P	95.7	Very high	94	Very high	53 Å²	53	75.7 Å²	75.7	34%	0.344	38%	0.381	S	S	.	.			trans	-59.7	131.7	-178.9	-20.8	30.4	0	0	0	112.4	W71 E84 I85	W71-P82 PolarHBondContact NE1-O 2.96Å; P82-E84 VanDerWaalsContact C-N 3.33Å; P82-I85 HydrophobicContact CB-CD1 3.87Å; P82-I85 HydrophobicContact CB-CG1 4.35Å; P82-I85 HydrophobicContact CG-CD1 3.76Å; P82-I85 PolarHBondContact O-N 2.94Å
83	E	95.1	Very high	93.2	Very high	80 Å²	80	75.6 Å²	75.6	37%	0.374	38%	0.383	S	S	.	.	H	α-helix	trans	-71.4	-29.4	-178.7	-161.4	76.3	-161	0	0	111.7	W71 P81 I85 K86 E87	W71-E83 WeakPolarHBondContact CH2-OE2 3.09Å; W71-E83 VanDerWaalsContact CZ2-OE2 3.24Å; W71-E83 WeakPolarHBondContact CZ2-OE2 3.09Å; P81-E83 PolarHBondContact O-N 3.03Å; E83-I85 PolarHBondContact O-N 3.23Å; E83-K86 WeakPolarHBondContact O-CA 3.37Å; E83-K86 WeakPolarHBondContact O-CB 3.24Å; E83-K86 PolarHBondContact O-N 2.97Å; E83-K86 WeakPolarHBondContact OE1-CD 3.47Å; E83-K86 WeakPolarHBondContact OE1-CE 3.38Å; E83-K86 IonicContact OE1-NZ 2.81Å; E83-K86 PolarHBondContact OE1-NZ 3.25Å; E83-E87 PolarHBondContact O-N 3.19Å
84	E	94.1	Very high	92.8	Very high	129 Å²	129	78.6 Å²	78.6	60%	0.603	41%	0.407	S	S	*	.	H	α-helix	trans	-50.9	-42.3	174.6	-65.9	164.2	-171	0	0	111.9	P82 K86 E87 L88	P82-E84 VanDerWaalsContact C-N 3.33Å; E84-K86 VanDerWaalsContact C-N 3.32Å; E84-K86 PolarHBondContact O-N 3.18Å; E84-E87 PolarHBondContact O-N 2.77Å; E84-L88 VanDerWaalsContact O-CB 3.32Å; E84-L88 WeakPolarHBondContact O-CB 3.26Å; E84-L88 PolarHBondContact O-N 2.75Å
85	I	94.2	Very high	92.4	Very high	11 Å²	11	81 Å²	81	6%	0.056	42%	0.42	C	S	.	.	H	α-helix	trans	-64.1	-39.6	178.4	-68.2	161.9	0	0	0	111	L50 F53 P82 E83 L89	L50-I85 HydrophobicContact CD2-CG2 3.89Å; F53-I85 HydrophobicContact CB-CD1 3.59Å; F53-I85 HydrophobicContact CB-CG1 4.5Å; F53-I85 HydrophobicContact CD1-CD1 4.43Å; F53-I85 HydrophobicContact CD1-CG2 4.15Å; F53-I85 HydrophobicContact CD2-CD1 3.5Å; F53-I85 HydrophobicContact CE1-CG2 4.38Å; F53-I85 HydrophobicContact CE2-CD1 4.25Å; F53-I85 HydrophobicContact CG-CD1 3.6Å; F53-I85 HydrophobicContact CG-CG2 4.37Å; P82-I85 HydrophobicContact CB-CD1 3.87Å; P82-I85 HydrophobicContact CB-CG1 4.35Å; P82-I85 HydrophobicContact CG-CD1 3.76Å; P82-I85 PolarHBondContact O-N 2.94Å; E83-I85 PolarHBondContact O-N 3.23Å; I85-L89 HydrophobicContact CG2-CD1 3.76Å; I85-L89 HydrophobicContact CG2-CG 4.34Å; I85-L89 WeakPolarHBondContact O-CB 3.38Å; I85-L89 WeakPolarHBondContact O-CD1 3.43Å; I85-L89 WeakPolarHBondContact O-CG 3.4Å; I85-L89 PolarHBondContact O-N 3.44Å
86	K	94.9	Very high	92.1	Very high	50 Å²	50	79.6 Å²	79.6	22%	0.217	42%	0.422	C	S	.	.	H	α-helix	trans	-70.7	-42.1	179.8	-176.1	-144.4	-172	-172.7	0	111	M68 W71 E83 E84 L88 L89 L90	M68-K86 HydrophobicContact CE-CG 4.22Å; M68-K86 HydrophobicContact SD-CG 4.47Å; W71-K86 HydrophobicContact CD2-CB 3.89Å; W71-K86 HydrophobicContact CD2-CG 4.1Å; W71-K86 HydrophobicContact CE3-CB 4.33Å; W71-K86 HydrophobicContact CE3-CD 4.29Å; W71-K86 HydrophobicContact CE3-CG 4.02Å; W71-K86 HydrophobicContact CG-CB 4.35Å; W71-K86 HydrophobicContact CH2-CB 4.21Å; W71-K86 HydrophobicContact CH2-CD 3.48Å; W71-K86 VanDerWaalsContact CH2-CD 3.48Å; W71-K86 HydrophobicContact CH2-CG 4.04Å; W71-K86 HydrophobicContact CZ2-CB 3.77Å; W71-K86 HydrophobicContact CZ2-CD 3.83Å; W71-K86 HydrophobicContact CZ2-CG 4.12Å; W71-K86 HydrophobicContact CZ3-CB 4.47Å; W71-K86 HydrophobicContact CZ3-CD 3.74Å; W71-K86 HydrophobicContact CZ3-CG 3.99Å; E83-K86 WeakPolarHBondContact O-CA 3.37Å; E83-K86 WeakPolarHBondContact O-CB 3.24Å; E83-K86 PolarHBondContact O-N 2.97Å; E83-K86 WeakPolarHBondContact OE1-CD 3.47Å; E83-K86 WeakPolarHBondContact OE1-CE 3.38Å; E83-K86 IonicContact OE1-NZ 2.81Å; E83-K86 PolarHBondContact OE1-NZ 3.25Å; E84-K86 VanDerWaalsContact C-N 3.32Å; E84-K86 PolarHBondContact O-N 3.18Å; K86-L88 VanDerWaalsContact C-N 3.3Å; K86-L88 PolarHBondContact O-N 2.87Å; K86-L89 PolarHBondContact O-N 3.2Å; K86-L90 HydrophobicContact CD-CD1 4.38Å; K86-L90 HydrophobicContact CG-CD1 4.26Å; K86-L90 WeakPolarHBondContact O-CB 3.46Å; K86-L90 VanDerWaalsContact O-CG 3.25Å; K86-L90 WeakPolarHBondContact O-CG 3.48Å; K86-L90 PolarHBondContact O-N 3.38Å
87	E	94.6	Very high	91.7	Very high	110 Å²	110	76.8 Å²	76.8	51%	0.514	41%	0.405	S	S	.	.	H	α-helix	trans	-58.5	-46.4	174.5	-68.8	-179.7	-179	0	0	111	E83 E84 L89 L90 Q91	E83-E87 PolarHBondContact O-N 3.19Å; E84-E87 PolarHBondContact O-N 2.77Å; E87-L89 PolarHBondContact O-N 3.28Å; E87-L90 PolarHBondContact O-N 3.09Å; E87-Q91 WeakPolarHBondContact O-CG 3.11Å; E87-Q91 PolarHBondContact O-N 2.98Å
88	L	93.4	Very high	91.6	Very high	13 Å²	13	71 Å²	71	7%	0.068	38%	0.377	C	S	.	.	H	α-helix	trans	-58	-49.3	176.4	-166.1	110.6	0	0	0	111.8	E46 L50 E84 K86 L90 Q91 T92 Y98	E46-L88 HydrophobicContact CB-CD1 3.6Å; E46-L88 HydrophobicContact CB-CD2 4.4Å; E46-L88 HydrophobicContact CG-CD1 3.42Å; E46-L88 VanDerWaalsContact CG-CD1 3.42Å; L50-L88 HydrophobicContact CD1-CD2 3.47Å; L50-L88 VanDerWaalsContact CD1-CD2 3.47Å; L50-L88 HydrophobicContact CD2-CD2 3.54Å; L50-L88 HydrophobicContact CG-CD2 3.43Å; L50-L88 VanDerWaalsContact CG-CD2 3.43Å; E84-L88 VanDerWaalsContact O-CB 3.32Å; E84-L88 WeakPolarHBondContact O-CB 3.26Å; E84-L88 PolarHBondContact O-N 2.75Å; K86-L88 VanDerWaalsContact C-N 3.3Å; K86-L88 PolarHBondContact O-N 2.87Å; L88-L90 VanDerWaalsContact C-N 3.29Å; L88-L90 PolarHBondContact O-N 3.48Å; L88-Q91 PolarHBondContact O-N 3.36Å; L88-Q91 VanDerWaalsContact O-N 3.15Å; L88-T92 PolarHBondContact O-N 3.43Å; L88-T92 VanDerWaalsContact O-N 3.14Å; L88-T92 PolarHBondContact O-OG1 3.24Å; L88-Y98 HydrophobicContact CD2-CD1 3.61Å; L88-Y98 HydrophobicContact CD2-CE1 3.72Å; L88-Y98 HydrophobicContact CG-CD1 4.28Å; L88-Y98 HydrophobicContact CG-CE1 4.19Å
89	L	92.9	Very high	91.4	Very high	2 Å²	2	70 Å²	70	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-65.4	-30.4	179.2	-69.9	169.3	0	0	0	113.3	L50 R67 M68 I85 K86 E87 L93 Y98	L50-L89 HydrophobicContact CD1-CD2 4.43Å; L50-L89 HydrophobicContact CD2-CD2 4.03Å; L50-L89 HydrophobicContact CD2-CG 4.16Å; R67-L89 HydrophobicContact CB-CD1 3.69Å; R67-L89 HydrophobicContact CB-CD2 3.75Å; R67-L89 HydrophobicContact CB-CG 4.39Å; M68-L89 HydrophobicContact CG-CB 3.77Å; M68-L89 HydrophobicContact CG-CD1 3.94Å; M68-L89 HydrophobicContact CG-CG 4.35Å; M68-L89 HydrophobicContact SD-CB 3.25Å; M68-L89 WeakPolarHBondContact SD-CB 3.25Å; M68-L89 HydrophobicContact SD-CD1 3.53Å; M68-L89 VanDerWaalsContact SD-CD1 3.53Å; M68-L89 HydrophobicContact SD-CG 4.02Å; I85-L89 HydrophobicContact CG2-CD1 3.76Å; I85-L89 HydrophobicContact CG2-CG 4.34Å; I85-L89 WeakPolarHBondContact O-CB 3.38Å; I85-L89 WeakPolarHBondContact O-CD1 3.43Å; I85-L89 WeakPolarHBondContact O-CG 3.4Å; I85-L89 PolarHBondContact O-N 3.44Å; K86-L89 PolarHBondContact O-N 3.2Å; E87-L89 PolarHBondContact O-N 3.28Å; L89-L93 WeakPolarHBondContact O-CD2 3.3Å; L89-L93 WeakPolarHBondContact O-CG 3.45Å; L89-L93 PolarHBondContact O-N 3.42Å; L89-Y98 WeakPolarHBondContact CD2-O 3.43Å
90	L	92.6	Very high	91.4	Very high	90 Å²	90	69.2 Å²	69.2	47%	0.471	36%	0.358	S	S	.	.	H	α-helix	trans	-71.9	-32.6	174.3	-74.2	172	0	0	0	112.3	M68 K86 E87 L88 T92 L93	M68-L90 HydrophobicContact CE-CD2 4.24Å; M68-L90 HydrophobicContact CE-CG 4.49Å; K86-L90 HydrophobicContact CD-CD1 4.38Å; K86-L90 HydrophobicContact CG-CD1 4.26Å; K86-L90 WeakPolarHBondContact O-CB 3.46Å; K86-L90 VanDerWaalsContact O-CG 3.25Å; K86-L90 WeakPolarHBondContact O-CG 3.48Å; K86-L90 PolarHBondContact O-N 3.38Å; E87-L90 PolarHBondContact O-N 3.09Å; L88-L90 VanDerWaalsContact C-N 3.29Å; L88-L90 PolarHBondContact O-N 3.48Å; L90-T92 VanDerWaalsContact C-N 3.34Å; L90-L93 HydrophobicContact CD2-CD1 4.48Å
91	Q	90.3	Very high	91.3	Very high	147 Å²	147	63 Å²	63	69%	0.687	33%	0.325	S	S	*	.	H	α-helix	trans	-72.2	-30.1	175.4	-70.3	172.8	1.2	0	0	112.1	E87 L88	E87-Q91 WeakPolarHBondContact O-CG 3.11Å; E87-Q91 PolarHBondContact O-N 2.98Å; L88-Q91 PolarHBondContact O-N 3.36Å; L88-Q91 VanDerWaalsContact O-N 3.15Å
92	T	86.6	Confident	91.1	Very high	28 Å²	28	65.9 Å²	65.9	17%	0.172	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	34.5	-172.2	64.9	0	0	0	0	113.3	L88 L90 D94 D95 Y98	L88-T92 PolarHBondContact O-N 3.43Å; L88-T92 VanDerWaalsContact O-N 3.14Å; L88-T92 PolarHBondContact O-OG1 3.24Å; L90-T92 VanDerWaalsContact C-N 3.34Å; T92-D94 PolarHBondContact O-N 3.04Å; T92-D95 PolarHBondContact O-N 2.98Å; T92-D95 VanDerWaalsContact O-N 3.09Å; T92-Y98 HydrophobicContact CG2-CD1 3.59Å; T92-Y98 HydrophobicContact CG2-CD2 4.42Å; T92-Y98 HydrophobicContact CG2-CE1 3.77Å; T92-Y98 HydrophobicContact CG2-CG 3.95Å; T92-Y98 WeakPolarHBondContact OG1-CB 3.44Å; T92-Y98 VanDerWaalsContact OG1-CD1 3.22Å; T92-Y98 WeakPolarHBondContact OG1-CD1 3.47Å
93	L	80.4	Confident	90.8	Very high	102 Å²	102	68.3 Å²	68.3	53%	0.534	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-31.9	-176	-73.2	171.1	0	0	0	113.6	L89 L90 D95	L89-L93 WeakPolarHBondContact O-CD2 3.3Å; L89-L93 WeakPolarHBondContact O-CG 3.45Å; L89-L93 PolarHBondContact O-N 3.42Å; L90-L93 HydrophobicContact CD2-CD1 4.48Å; L93-D95 VanDerWaalsContact C-N 3.35Å
94	D	85.8	Confident	90.5	Very high	164 Å²	164	70.6 Å²	70.6	88%	0.877	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-15.4	-179.1	-68.7	-37.7	0	0	0	113.3	T92 P96	T92-D94 PolarHBondContact O-N 3.04Å; D94-P96 VanDerWaalsContact O-CD 3.3Å; D94-P96 WeakPolarHBondContact O-CD 3.32Å
95	D	89.5	Confident	90.2	Very high	50 Å²	50	73.3 Å²	73.3	27%	0.267	36%	0.36	S	S	.	.			trans	-90.2	112.6	-176.8	-165	-23.3	0	0	0	111.2	T92 L93 E97 Y98 S99	T92-D95 PolarHBondContact O-N 2.98Å; T92-D95 VanDerWaalsContact O-N 3.09Å; L93-D95 VanDerWaalsContact C-N 3.35Å; D95-E97 PolarHBondContact O-N 3.46Å; D95-E97 WeakPolarHBondContact OD1-CB 3.42Å; D95-E97 PolarHBondContact OD1-N 3.24Å; D95-Y98 HydrophobicContact CB-CD2 3.99Å; D95-Y98 PolarHBondContact O-N 3.21Å; D95-S99 WeakPolarHBondContact O-CB 3.49Å; D95-S99 PolarHBondContact O-N 3.32Å
96	P	88.1	Confident	89.8	Confident	81 Å²	81	80.8 Å²	80.8	53%	0.526	39%	0.389	S	S	.	.	H	α-helix	trans	-63.7	-21.1	177.8	26.7	-34.7	0	0	0	113.7	D94 R104	D94-P96 VanDerWaalsContact O-CD 3.3Å; D94-P96 WeakPolarHBondContact O-CD 3.32Å; P96-R104 PolarHBondContact O-NH2 2.94Å
97	E	89.3	Confident	89.2	Confident	92 Å²	92	83.4 Å²	83.4	43%	0.43	41%	0.411	S	S	.	.	H	α-helix	trans	-70.4	-36.6	176.9	-166.8	175.3	-155.1	0	0	111.1	K43 M47 R67 D95	K43-E97 IonicContact NZ-OE2 3.83Å; K43-E97 PolarHBondContact NZ-OE2 3.41Å; M47-E97 HydrophobicContact CE-CG 4.44Å; M47-E97 WeakPolarHBondContact CE-OE1 3.31Å; R67-E97 PolarHBondContact NH1-O 2.9Å; D95-E97 PolarHBondContact O-N 3.46Å; D95-E97 WeakPolarHBondContact OD1-CB 3.42Å; D95-E97 PolarHBondContact OD1-N 3.24Å
98	Y	90.7	Very high	87.8	Confident	8 Å²	8	88.7 Å²	88.7	3%	0.031	43%	0.433	C	S	.	.	H	α-helix	trans	-85.3	-38.6	177.6	-78.8	-111.6	0	0	0	112.2	K43 E46 L50 R67 L88 L89 T92 D95 M100	K43-Y98 WeakPolarHBondContact CG-OH 3.16Å; E46-Y98 HydrophobicContact CB-CE1 4.21Å; E46-Y98 PolarHBondContact OE2-OH 3.36Å; L50-Y98 HydrophobicContact CD1-CD1 3.54Å; L50-Y98 HydrophobicContact CD1-CE1 4.22Å; L50-Y98 HydrophobicContact CD1-CG 4.01Å; R67-Y98 WeakPolarHBondContact CD-O 3.12Å; R67-Y98 VanDerWaalsContact NH1-C 3.26Å; R67-Y98 PolarHBondContact NH1-O 3.48Å; L88-Y98 HydrophobicContact CD2-CD1 3.61Å; L88-Y98 HydrophobicContact CD2-CE1 3.72Å; L88-Y98 HydrophobicContact CG-CD1 4.28Å; L88-Y98 HydrophobicContact CG-CE1 4.19Å; L89-Y98 WeakPolarHBondContact CD2-O 3.43Å; T92-Y98 HydrophobicContact CG2-CD1 3.59Å; T92-Y98 HydrophobicContact CG2-CD2 4.42Å; T92-Y98 HydrophobicContact CG2-CE1 3.77Å; T92-Y98 HydrophobicContact CG2-CG 3.95Å; T92-Y98 WeakPolarHBondContact OG1-CB 3.44Å; T92-Y98 VanDerWaalsContact OG1-CD1 3.22Å; T92-Y98 WeakPolarHBondContact OG1-CD1 3.47Å; D95-Y98 HydrophobicContact CB-CD2 3.99Å; D95-Y98 PolarHBondContact O-N 3.21Å; Y98-M100 PolarHBondContact O-N 3.38Å
99	S	91.7	Very high	87.5	Confident	28 Å²	28	92.5 Å²	92.5	20%	0.196	45%	0.451	C	S	.	.	H	α-helix	trans	-66	-27	-175.6	-177.3	0	0	0	0	113.1	S66 R67 D95	S66-S99 WeakPolarHBondContact CB-O 3.32Å; R67-S99 PolarHBondContact N-O 2.96Å; D95-S99 WeakPolarHBondContact O-CB 3.49Å; D95-S99 PolarHBondContact O-N 3.32Å
100	M	91.4	Very high	87.2	Confident	62 Å²	62	97.2 Å²	97.2	31%	0.305	47%	0.474	S	S	.	.	B	Isolated β-bridge	trans	-123.4	152.2	-162.5	-63.8	-132.2	169	0	0	116.4	R67 Y98 R104	R67-M100 PolarHBondContact NE-O 3.33Å; R67-M100 PolarHBondContact NH1-O 3.03Å; R67-M100 PolarHBondContact NH2-O 2.85Å; Y98-M100 PolarHBondContact O-N 3.38Å; M100-R104 PolarHBondContact SD-NH1 3.33Å; M100-R104 PolarHBondContact SD-NH2 3.25Å
101	S	91.8	Very high	87	Confident	11 Å²	11	97.6 Å²	97.6	8%	0.077	47%	0.474	C	S	.	.			trans	-59.1	147.3	-174.2	172.9	0	0	0	0	112.8	C62 W103 R104	C62-S101 WeakPolarHBondContact O-CB 3.32Å; C62-S101 PolarHBondContact O-OG 3.3Å; C62-S101 PolarHBondContact SG-OG 2.94Å; S101-W103 PolarHBondContact O-N 3.06Å; S101-W103 PolarHBondContact OG-N 2.85Å; S101-R104 WeakPolarHBondContact O-CB 3.3Å; S101-R104 PolarHBondContact O-N 3.17Å
102	L	90.9	Very high	86.8	Confident	72 Å²	72	94.7 Å²	94.7	38%	0.377	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-30.9	172.3	-172.9	115.6	0	0	0	113.9	K51 D54	K51-L102 HydrophobicContact CB-CD1 4.16Å; K51-L102 HydrophobicContact CD-CD1 4.04Å; K51-L102 HydrophobicContact CG-CD1 3.66Å; D54-L102 HydrophobicContact CB-CB 4.21Å; D54-L102 PolarHBondContact OD2-N 3.2Å
103	W	89.1	Confident	86.8	Confident	105 Å²	105	98.9 Å²	98.9	40%	0.398	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	11.4	-176.5	-60	-53.3	0	0	0	114.8	L55 C62 T63 S101 E105 Y106	L55-W103 HydrophobicContact CD2-CZ2 4.24Å; C62-W103 WeakPolarHBondContact SG-CZ3 3.45Å; T63-W103 HydrophobicContact CG2-CB 4.37Å; T63-W103 HydrophobicContact CG2-CD2 4.16Å; T63-W103 HydrophobicContact CG2-CE3 3.32Å; T63-W103 HydrophobicContact CG2-CZ3 3.9Å; S101-W103 PolarHBondContact O-N 3.06Å; S101-W103 PolarHBondContact OG-N 2.85Å; W103-E105 VanDerWaalsContact C-N 3.25Å; W103-E105 PolarHBondContact O-N 2.99Å; W103-Y106 PolarHBondContact O-N 3.17Å
104	R	88.8	Confident	87.2	Confident	128 Å²	128	98.7 Å²	98.7	48%	0.483	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-39.5	179.5	-178.2	-149.2	-81.5	-102.4	23.7	112.8	P96 M100 S101 Y106	P96-R104 PolarHBondContact O-NH2 2.94Å; M100-R104 PolarHBondContact SD-NH1 3.33Å; M100-R104 PolarHBondContact SD-NH2 3.25Å; S101-R104 WeakPolarHBondContact O-CB 3.3Å; S101-R104 PolarHBondContact O-N 3.17Å; R104-Y106 VanDerWaalsContact C-N 3.27Å; R104-Y106 PolarHBondContact O-N 3.48Å
105	E	87.5	Confident	87.3	Confident	185 Å²	185	94 Å²	94	86%	0.864	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-9	-174	-65.4	177.2	-175.9	0	0	113.5	W103	W103-E105 VanDerWaalsContact C-N 3.25Å; W103-E105 PolarHBondContact O-N 2.99Å
106	Y	85.3	Confident	87.1	Confident	168 Å²	168	97.4 Å²	97.4	66%	0.659	46%	0.462	S	S	*	.	S	Bend	trans	-84	126.5	-177.1	-152.6	-94.3	0	0	0	110.4	W103 R104 F108	W103-Y106 PolarHBondContact O-N 3.17Å; R104-Y106 VanDerWaalsContact C-N 3.27Å; R104-Y106 PolarHBondContact O-N 3.48Å; Y106-F108 WeakPolarHBondContact O-CD2 3.28Å; Y106-F108 PolarHBondContact O-N 3.37Å
107	P	82.2	Confident	87	Confident	106 Å²	106	98.8 Å²	98.8	69%	0.688	46%	0.456	S	S	*	.			trans	-68.2	131.9	175.4	27.6	-32.2	0	0	0	110.2
108	F	65.8	Low	86.8	Confident	220 Å²	220	99.4 Å²	99.4	97%	0.965	46%	0.459	S	S	*	.			trans	-98.5	0	174	-69	-82.7	0	0	0	111.3	T63 Y106	T63-F108 HydrophobicContact CG2-CZ 4.09Å; Y106-F108 WeakPolarHBondContact O-CD2 3.28Å; Y106-F108 PolarHBondContact O-N 3.37Å

Retrieved 108 of 108 residues in 49.3 ms (Link to these results)

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