A0A077YWW1_TRITR Loading...

Transmembrane protein 229b

AlphaFold DB , UniProt , Accession A0A077YWW1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 177 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	39.7	Very low	42.1	Very low	250 Å²	250	145 Å²	145	100%	1.232	78%	0.776	S	S	*	*				0	124.2	0	-82.3	171.8	162.7	0	0	106.9
2	A	39.6	Very low	41.9	Very low	91 Å²	91	143.7 Å²	143.7	75%	0.752	78%	0.777	S	S	*	*			cis	-155	140.2	9.3	0	0	0	0	0	111.6
3	R	41.6	Very low	42	Very low	214 Å²	214	142.8 Å²	142.8	81%	0.808	78%	0.778	S	S	*	*			trans	52.6	119	136.7	-65.9	-171.5	-174.4	-152.3	3	121.5
4	R	44	Very low	41.5	Very low	209 Å²	209	137.8 Å²	137.8	79%	0.789	78%	0.777	S	S	*	*				82.4	142.7	100.6	-79.8	-169	-173.4	-166.2	0.8	112.9
5	N	41.8	Very low	41.1	Very low	123 Å²	123	133.4 Å²	133.4	66%	0.658	77%	0.774	S	S	*	*			cis	-153.2	138.3	30.6	-109.7	2.5	0	0	0	106.8
6	S	47.2	Very low	40.7	Very low	80 Å²	80	129.1 Å²	129.1	56%	0.559	77%	0.767	S	S	*	*				65.1	138.2	79	86.8	0	0	0	0	116
7	D	44.2	Very low	40.9	Very low	142 Å²	142	129.1 Å²	129.1	76%	0.759	77%	0.768	S	S	*	*			trans	103.4	134.5	160.4	-48.6	-11.2	0	0	0	114.4
8	S	42.2	Very low	41.1	Very low	101 Å²	101	128.7 Å²	128.7	71%	0.706	77%	0.767	S	S	*	*			cis	179	140.2	-23.5	39.9	0	0	0	0	106.9
9	V	40.5	Very low	41.5	Very low	126 Å²	126	129.7 Å²	129.7	76%	0.764	77%	0.768	S	S	*	*			trans	55.9	104.7	137.4	-173.7	0	0	0	0	122.1
10	N	34	Very low	41.9	Very low	149 Å²	149	131.3 Å²	131.3	80%	0.797	77%	0.767	S	S	*	*				54.3	174.3	122.6	-65.6	-22.8	0	0	0	123.3
11	P	48.3	Very low	42.4	Very low	110 Å²	110	130.3 Å²	130.3	71%	0.714	77%	0.766	S	S	*	*				-132.4	-162	-73.8	38.7	-17.4	0	0	0	113.2
12	V	39.6	Very low	43.3	Very low	129 Å²	129	124.5 Å²	124.5	78%	0.782	74%	0.739	S	S	*	*			trans	81.6	126.1	169.5	-161.5	0	0	0	0	113.3
13	V	43.3	Very low	44.5	Very low	132 Å²	132	122.4 Å²	122.4	80%	0.8	73%	0.726	S	S	*	*				-158.8	128.8	81.2	169.8	0	0	0	0	110.6	G15	V13-G15 PolarHBondContact O-N 3.2Å
14	G	34.5	Very low	45.7	Very low	73 Å²	73	121.4 Å²	121.4	75%	0.753	72%	0.723	S	S	*	*			trans	-62.5	111.3	165.4	0	0	0	0	0	110.8	G16	G14-G16 PolarHBondContact O-N 2.85Å
15	G	36.8	Very low	46.8	Very low	72 Å²	72	115.9 Å²	115.9	74%	0.742	71%	0.713	S	S	*	*			trans	-74.3	107.4	168	0	0	0	0	0	109.3	V13 V17	V13-G15 PolarHBondContact O-N 3.2Å; G15-V17 PolarHBondContact O-N 3.36Å
16	G	34	Very low	48	Very low	64 Å²	64	117 Å²	117	66%	0.66	71%	0.712	S	S	*	*			trans	-54.4	128.7	172.4	0	0	0	0	0	111.2	G14 T18	G14-G16 PolarHBondContact O-N 2.85Å; G16-T18 PolarHBondContact O-N 3.29Å
17	V	43.4	Very low	49.1	Very low	130 Å²	130	119.1 Å²	119.1	79%	0.788	71%	0.711	S	S	*	*			trans	-65	90.7	165.4	178.5	0	0	0	0	106.8	G15 N19	G15-V17 PolarHBondContact O-N 3.36Å; V17-N19 PolarHBondContact O-N 2.97Å
18	T	45.9	Very low	50.3	Low	122 Å²	122	117.3 Å²	117.3	75%	0.748	70%	0.696	S	S	*	*			trans	-68.5	99.2	167.6	44	0	0	0	0	107	G16 Q20	G16-T18 PolarHBondContact O-N 3.29Å; T18-Q20 PolarHBondContact O-N 3.02Å
19	N	48.9	Very low	51.6	Low	147 Å²	147	114.7 Å²	114.7	79%	0.786	68%	0.681	S	S	*	*			trans	-63.9	80	167.5	-92.6	-35.7	0	0	0	108.5	V17 P21	V17-N19 PolarHBondContact O-N 2.97Å; N19-P21 WeakPolarHBondContact O-CD 3.32Å
20	Q	48.2	Very low	53.2	Low	161 Å²	161	114.9 Å²	114.9	75%	0.752	67%	0.672	S	S	*	*			trans	-63.7	121.3	163.1	-80.1	-161.6	-1.5	0	0	107.1	T18 N22	T18-Q20 PolarHBondContact O-N 3.02Å; Q20-N22 PolarHBondContact O-N 3Å
21	P	53.1	Low	55.6	Low	112 Å²	112	109 Å²	109	73%	0.727	64%	0.642	S	S	*	*			trans	-61.7	103.8	174.3	23.9	-30.1	0	0	0	107.5	N19 G23	N19-P21 WeakPolarHBondContact O-CD 3.32Å; P21-G23 PolarHBondContact O-N 2.8Å; P21-G23 VanDerWaalsContact O-N 3.11Å
22	N	58.5	Low	57.6	Low	127 Å²	127	109 Å²	109	68%	0.679	63%	0.631	S	S	*	*			trans	-38.1	118.8	-179.5	-84.7	-35.8	0	0	0	110	Q20 R24 T25	Q20-N22 PolarHBondContact O-N 3Å; N22-R24 CarbonylContact O-C 3.48Å; N22-R24 PolarHBondContact O-N 3.01Å; N22-T25 PolarHBondContact O-N 3.42Å
23	G	65.3	Low	60	Low	47 Å²	47	108.1 Å²	108.1	49%	0.485	62%	0.621	S	S	.	*	H	α-helix	trans	-53.4	-15.4	-171.6	0	0	0	0	0	115.3	P21 K27	P21-G23 PolarHBondContact O-N 2.8Å; P21-G23 VanDerWaalsContact O-N 3.11Å; G23-K27 WeakPolarHBondContact O-CG 3.48Å; G23-K27 PolarHBondContact O-N 3.01Å
24	R	65.8	Low	62.3	Low	193 Å²	193	107 Å²	107	73%	0.728	61%	0.609	S	S	*	*	H	α-helix	trans	-61.7	-45.9	169.1	-153.1	-172.8	-68.4	173.3	-0.6	112.8	N22 F26 K27 F28	N22-R24 CarbonylContact O-C 3.48Å; N22-R24 PolarHBondContact O-N 3.01Å; R24-F26 VanDerWaalsContact C-N 3.35Å; R24-K27 PolarHBondContact O-N 2.79Å; R24-F28 HydrophobicContact CG-CD2 4.12Å; R24-F28 HydrophobicContact CG-CE2 3.66Å; R24-F28 WeakPolarHBondContact O-CD2 3.49Å; R24-F28 PolarHBondContact O-N 3.27Å
25	T	68.1	Low	65.1	Low	94 Å²	94	104.7 Å²	104.7	58%	0.577	58%	0.577	S	S	*	*	H	α-helix	trans	-63.4	-43.1	177.8	-56.7	0	0	0	0	110.7	N22 K27 F28 A29	N22-T25 PolarHBondContact O-N 3.42Å; T25-K27 PolarHBondContact O-N 3.38Å; T25-F28 PolarHBondContact O-N 3.32Å; T25-A29 WeakPolarHBondContact O-CB 3.48Å; T25-A29 PolarHBondContact O-N 3.32Å
26	F	66.1	Low	67.9	Low	145 Å²	145	103.4 Å²	103.4	64%	0.636	55%	0.552	S	S	*	*	H	α-helix	trans	-60.6	-44.9	176	-175.6	-101.7	0	0	0	112	R24 F28 A29 K30	R24-F26 VanDerWaalsContact C-N 3.35Å; F26-F28 PolarHBondContact O-N 3.31Å; F26-A29 PolarHBondContact O-N 2.91Å; F26-K30 WeakPolarHBondContact O-CB 3.44Å; F26-K30 PolarHBondContact O-N 3.02Å
27	K	70.8	Confident	70.8	Confident	125 Å²	125	107.2 Å²	107.2	54%	0.543	55%	0.547	S	S	.	.	H	α-helix	trans	-59.5	-43.5	174.8	-76.1	176.7	179.4	-179.9	0	112.3	G23 R24 T25 S31 S174	G23-K27 WeakPolarHBondContact O-CG 3.48Å; G23-K27 PolarHBondContact O-N 3.01Å; R24-K27 PolarHBondContact O-N 2.79Å; T25-K27 PolarHBondContact O-N 3.38Å; K27-S31 PolarHBondContact O-N 3.48Å; K27-S174 PolarHBondContact NZ-OG 3.22Å
28	F	68.9	Low	73.2	Confident	104 Å²	104	104 Å²	104	46%	0.456	53%	0.528	S	S	.	.	H	α-helix	trans	-68.4	-41.8	178.2	-75.9	-57.7	0	0	0	113.2	R24 T25 F26 S31 K32	R24-F28 HydrophobicContact CG-CD2 4.12Å; R24-F28 HydrophobicContact CG-CE2 3.66Å; R24-F28 WeakPolarHBondContact O-CD2 3.49Å; R24-F28 PolarHBondContact O-N 3.27Å; T25-F28 PolarHBondContact O-N 3.32Å; F26-F28 PolarHBondContact O-N 3.31Å; F28-S31 PolarHBondContact O-N 2.89Å; F28-K32 PolarHBondContact O-N 2.95Å
29	A	69.3	Low	75.6	Confident	47 Å²	47	98.2 Å²	98.2	39%	0.388	49%	0.492	S	S	.	.	H	α-helix	trans	-61.9	-45.7	176.1	0	0	0	0	0	110.8	T25 F26 S31 K32 L33	T25-A29 WeakPolarHBondContact O-CB 3.48Å; T25-A29 PolarHBondContact O-N 3.32Å; F26-A29 PolarHBondContact O-N 2.91Å; A29-S31 VanDerWaalsContact C-N 3.32Å; A29-S31 PolarHBondContact O-N 3.31Å; A29-K32 PolarHBondContact O-N 3.36Å; A29-L33 WeakPolarHBondContact O-CG 3.34Å; A29-L33 PolarHBondContact O-N 3.26Å
30	K	73.4	Confident	77.9	Confident	129 Å²	129	91.6 Å²	91.6	56%	0.561	46%	0.458	S	S	*	.	H	α-helix	trans	-57.3	-45	174.3	-173.1	176.6	-179.8	177.6	0	111.5	F26 L33 M34	F26-K30 WeakPolarHBondContact O-CB 3.44Å; F26-K30 PolarHBondContact O-N 3.02Å; K30-L33 PolarHBondContact O-N 2.93Å; K30-M34 VanDerWaalsContact O-CG 3.29Å; K30-M34 WeakPolarHBondContact O-CG 3.49Å; K30-M34 PolarHBondContact O-N 3.06Å
31	S	85.4	Confident	80.2	Confident	26 Å²	26	88 Å²	88	18%	0.182	44%	0.443	C	S	.	.	H	α-helix	trans	-59.9	-49.1	176.1	178.4	0	0	0	0	111.7	K27 F28 A29 L33 M34 R35	K27-S31 PolarHBondContact O-N 3.48Å; F28-S31 PolarHBondContact O-N 2.89Å; A29-S31 VanDerWaalsContact C-N 3.32Å; A29-S31 PolarHBondContact O-N 3.31Å; S31-L33 PolarHBondContact O-N 3.13Å; S31-M34 PolarHBondContact O-N 3.4Å; S31-R35 VanDerWaalsContact O-CG 3.31Å; S31-R35 WeakPolarHBondContact O-CG 3.41Å; S31-R35 PolarHBondContact O-N 3.13Å; S31-R35 PolarHBondContact OG-NH1 3.2Å
32	K	89.4	Confident	82.2	Confident	109 Å²	109	84.9 Å²	84.9	47%	0.474	42%	0.419	S	S	.	.	H	α-helix	trans	-61.3	-41.9	178.9	-74.8	-179.1	-176.6	-176.4	0	113	F28 A29 R35 F36	F28-K32 PolarHBondContact O-N 2.95Å; A29-K32 PolarHBondContact O-N 3.36Å; K32-R35 PolarHBondContact O-N 3.4Å; K32-F36 WeakPolarHBondContact O-CB 3.37Å; K32-F36 PolarHBondContact O-N 3.37Å
33	L	91.4	Very high	84	Confident	111 Å²	111	79 Å²	79	58%	0.581	39%	0.389	S	S	*	.	H	α-helix	trans	-63.8	-41.4	177.6	-72.2	172.8	0	0	0	111.8	A29 K30 S31 F36 Y37	A29-L33 WeakPolarHBondContact O-CG 3.34Å; A29-L33 PolarHBondContact O-N 3.26Å; K30-L33 PolarHBondContact O-N 2.93Å; S31-L33 PolarHBondContact O-N 3.13Å; L33-F36 PolarHBondContact O-N 3.24Å; L33-Y37 PolarHBondContact O-N 2.94Å
34	M	91.1	Very high	85.4	Confident	110 Å²	110	78.5 Å²	78.5	54%	0.542	38%	0.375	S	S	.	.	H	α-helix	trans	-64.6	-40.7	174.7	-67.1	-63.8	103.7	0	0	111.6	K30 S31 Y37 V38	K30-M34 VanDerWaalsContact O-CG 3.29Å; K30-M34 WeakPolarHBondContact O-CG 3.49Å; K30-M34 PolarHBondContact O-N 3.06Å; S31-M34 PolarHBondContact O-N 3.4Å; M34-Y37 PolarHBondContact O-N 3.33Å; M34-V38 WeakPolarHBondContact O-CG2 3.29Å; M34-V38 PolarHBondContact O-N 3.01Å
35	R	92.8	Very high	86.9	Confident	23 Å²	23	71.6 Å²	71.6	9%	0.087	36%	0.359	C	S	.	.	H	α-helix	trans	-62.1	-47	174.4	-65	-157.8	-63.4	-97	5.1	111.5	S31 K32 Y37 V38 Y39 L81 E84 T163 T167	S31-R35 VanDerWaalsContact O-CG 3.31Å; S31-R35 WeakPolarHBondContact O-CG 3.41Å; S31-R35 PolarHBondContact O-N 3.13Å; S31-R35 PolarHBondContact OG-NH1 3.2Å; K32-R35 PolarHBondContact O-N 3.4Å; R35-Y37 VanDerWaalsContact C-N 3.31Å; R35-Y37 PolarHBondContact O-N 3.28Å; R35-V38 PolarHBondContact O-N 3.13Å; R35-Y39 HydrophobicContact CB-CD2 4.4Å; R35-Y39 HydrophobicContact CB-CE2 4Å; R35-Y39 VanDerWaalsContact O-CB 3.31Å; R35-Y39 WeakPolarHBondContact O-CB 3.44Å; R35-Y39 WeakPolarHBondContact O-CD2 3.21Å; R35-Y39 PolarHBondContact O-N 3.43Å; R35-L81 HydrophobicContact CB-CD1 4.04Å; R35-E84 WeakPolarHBondContact CD-OE2 3.23Å; R35-E84 IonicContact CZ-OE1 3.2Å; R35-E84 IonicContact CZ-OE2 3.84Å; R35-E84 IonicContact NE-OE1 3.01Å; R35-E84 PolarHBondContact NE-OE1 2.82Å; R35-E84 IonicContact NE-OE2 2.97Å; R35-E84 PolarHBondContact NE-OE2 3.5Å; R35-E84 IonicContact NH2-OE1 2.69Å; R35-E84 PolarHBondContact NH2-OE1 3.3Å; R35-T163 HydrophobicContact CB-CG2 4.16Å; R35-T163 HydrophobicContact CG-CG2 3.37Å; R35-T167 PolarHBondContact NH1-OG1 3.47Å
36	F	95.2	Very high	88.1	Confident	46 Å²	46	70.3 Å²	70.3	20%	0.202	35%	0.347	C	S	.	.	H	α-helix	trans	-55.1	-47.1	175.7	173.9	-96.2	0	0	0	111.5	K32 L33 V38 Y39 A40 F74 G77 L78 L81	K32-F36 WeakPolarHBondContact O-CB 3.37Å; K32-F36 PolarHBondContact O-N 3.37Å; L33-F36 PolarHBondContact O-N 3.24Å; F36-V38 PolarHBondContact O-N 3.17Å; F36-Y39 PolarHBondContact O-N 3.15Å; F36-A40 HydrophobicContact CE1-CB 4.49Å; F36-A40 VanDerWaalsContact O-CB 3.3Å; F36-A40 WeakPolarHBondContact O-CB 3.27Å; F36-A40 PolarHBondContact O-N 3.26Å; F36-F74 HydrophobicContact CZ-CD1 4.09Å; F36-G77 VanDerWaalsContact CE2-C 3.49Å; F36-L78 HydrophobicContact CD2-CD2 4.39Å; F36-L78 HydrophobicContact CE2-CD2 4.04Å; F36-L78 HydrophobicContact CE2-CG 4Å; F36-L81 HydrophobicContact CB-CD2 4.24Å; F36-L81 HydrophobicContact CD2-CD2 4.41Å
37	Y	95.4	Very high	89.5	Confident	143 Å²	143	65.2 Å²	65.2	56%	0.561	33%	0.325	S	S	*	.	H	α-helix	trans	-59.9	-48.2	178.8	-180	-103.5	0	0	0	112.2	L33 M34 R35 Y39 A40 L41	L33-Y37 PolarHBondContact O-N 2.94Å; M34-Y37 PolarHBondContact O-N 3.33Å; R35-Y37 VanDerWaalsContact C-N 3.31Å; R35-Y37 PolarHBondContact O-N 3.28Å; Y37-Y39 VanDerWaalsContact C-N 3.33Å; Y37-Y39 PolarHBondContact O-N 3.03Å; Y37-A40 PolarHBondContact O-N 3.33Å; Y37-L41 HydrophobicContact CD1-CD1 4.04Å; Y37-L41 HydrophobicContact CE1-CD1 3.43Å; Y37-L41 VanDerWaalsContact CE1-CD1 3.43Å; Y37-L41 HydrophobicContact CE1-CG 4.32Å; Y37-L41 HydrophobicContact CE2-CD1 4.29Å; Y37-L41 HydrophobicContact CE2-CG 4.44Å; Y37-L41 WeakPolarHBondContact O-CG 3.32Å; Y37-L41 PolarHBondContact O-N 2.97Å
38	V	94.6	Very high	90.7	Very high	63 Å²	63	62.7 Å²	62.7	38%	0.382	32%	0.317	S	S	.	.	H	α-helix	trans	-61.5	-42.6	176.8	171	0	0	0	0	111.2	M34 R35 F36 L41 H42 L159	M34-V38 WeakPolarHBondContact O-CG2 3.29Å; M34-V38 PolarHBondContact O-N 3.01Å; R35-V38 PolarHBondContact O-N 3.13Å; F36-V38 PolarHBondContact O-N 3.17Å; V38-L41 PolarHBondContact O-N 2.93Å; V38-H42 WeakPolarHBondContact O-CB 3.48Å; V38-H42 PolarHBondContact O-N 3.35Å; V38-L159 HydrophobicContact CG1-CD1 3.76Å; V38-L159 HydrophobicContact CG1-CD2 4.44Å; V38-L159 HydrophobicContact CG1-CG 4.4Å
39	Y	95.9	Very high	91.9	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-67	-39.4	178.4	-67.3	-15.4	0	0	0	112.6	R35 F36 Y37 H42 G43 L80 L81 E84 L159 T163	R35-Y39 HydrophobicContact CB-CD2 4.4Å; R35-Y39 HydrophobicContact CB-CE2 4Å; R35-Y39 VanDerWaalsContact O-CB 3.31Å; R35-Y39 WeakPolarHBondContact O-CB 3.44Å; R35-Y39 WeakPolarHBondContact O-CD2 3.21Å; R35-Y39 PolarHBondContact O-N 3.43Å; F36-Y39 PolarHBondContact O-N 3.15Å; Y37-Y39 VanDerWaalsContact C-N 3.33Å; Y37-Y39 PolarHBondContact O-N 3.03Å; Y39-H42 PolarHBondContact O-N 3.44Å; Y39-G43 PolarHBondContact O-N 3.49Å; Y39-L80 HydrophobicContact CD1-CB 4.43Å; Y39-L80 HydrophobicContact CD2-CB 3.74Å; Y39-L80 HydrophobicContact CE2-CB 4.45Å; Y39-L80 HydrophobicContact CG-CB 3.72Å; Y39-L80 HydrophobicContact CG-CD1 4.33Å; Y39-L81 HydrophobicContact CD2-CB 4.08Å; Y39-L81 HydrophobicContact CD2-CD1 4.34Å; Y39-L81 HydrophobicContact CE2-CB 4.43Å; Y39-L81 HydrophobicContact CE2-CD1 4.16Å; Y39-E84 WeakPolarHBondContact CE2-OE2 3.38Å; Y39-E84 PolarHBondContact OH-OE2 2.96Å; Y39-L159 HydrophobicContact CD1-CD2 3.48Å; Y39-L159 VanDerWaalsContact CD1-CD2 3.48Å; Y39-L159 HydrophobicContact CD1-CG 3.94Å; Y39-L159 HydrophobicContact CE1-CD2 3.91Å; Y39-L159 HydrophobicContact CE1-CG 3.87Å; Y39-T163 HydrophobicContact CE1-CG2 4.29Å
40	A	96.5	Very high	93.1	Very high	9 Å²	9	63.2 Å²	63.2	7%	0.074	32%	0.315	C	S	.	.	H	α-helix	trans	-63.8	-44.8	176.1	0	0	0	0	0	111.2	F36 Y37 G43 L44 A73	F36-A40 HydrophobicContact CE1-CB 4.49Å; F36-A40 VanDerWaalsContact O-CB 3.3Å; F36-A40 WeakPolarHBondContact O-CB 3.27Å; F36-A40 PolarHBondContact O-N 3.26Å; Y37-A40 PolarHBondContact O-N 3.33Å; A40-G43 PolarHBondContact O-N 3.04Å; A40-L44 WeakPolarHBondContact O-CG 3.47Å; A40-L44 PolarHBondContact O-N 3.11Å; A40-A73 HydrophobicContact CB-CB 4.37Å; A40-A73 VanDerWaalsContact CB-O 3.27Å; A40-A73 WeakPolarHBondContact CB-O 3.37Å
41	L	96.4	Very high	94.1	Very high	84 Å²	84	58.5 Å²	58.5	44%	0.44	30%	0.297	S	S	.	.	H	α-helix	trans	-63.8	-44	175.6	-71.3	-179.1	0	0	0	112.3	Y37 V38 G43 L44 A45	Y37-L41 HydrophobicContact CD1-CD1 4.04Å; Y37-L41 HydrophobicContact CE1-CD1 3.43Å; Y37-L41 VanDerWaalsContact CE1-CD1 3.43Å; Y37-L41 HydrophobicContact CE1-CG 4.32Å; Y37-L41 HydrophobicContact CE2-CD1 4.29Å; Y37-L41 HydrophobicContact CE2-CG 4.44Å; Y37-L41 WeakPolarHBondContact O-CG 3.32Å; Y37-L41 PolarHBondContact O-N 2.97Å; V38-L41 PolarHBondContact O-N 2.93Å; L41-G43 VanDerWaalsContact C-N 3.33Å; L41-G43 PolarHBondContact O-N 2.81Å; L41-L44 PolarHBondContact O-N 3.37Å; L41-A45 WeakPolarHBondContact O-CB 3.5Å; L41-A45 PolarHBondContact O-N 3.25Å
42	H	95.7	Very high	94.5	Very high	47 Å²	47	57.6 Å²	57.6	22%	0.218	29%	0.291	C	S	.	.	H	α-helix	trans	-60.7	-44.8	175.9	179.9	84.4	0	0	0	111.4	V38 Y39 A45 M46 T155 L159	V38-H42 WeakPolarHBondContact O-CB 3.48Å; V38-H42 PolarHBondContact O-N 3.35Å; Y39-H42 PolarHBondContact O-N 3.44Å; H42-A45 PolarHBondContact O-N 2.76Å; H42-M46 WeakPolarHBondContact O-CG 3.28Å; H42-M46 PolarHBondContact O-N 3.07Å; H42-T155 PolarHBondContact NE2-OG1 2.95Å; H42-T155 VanDerWaalsContact NE2-OG1 3.15Å; H42-L159 HydrophobicContact CB-CD2 3.54Å; H42-L159 VanDerWaalsContact CG-CD2 3.47Å
43	G	95.7	Very high	94.8	Very high	5 Å²	5	55.8 Å²	55.8	5%	0.052	29%	0.289	C	S	.	.	H	α-helix	trans	-58.8	-49.5	175.1	0	0	0	0	0	112.8	Y39 A40 L41 A45 M46 E47 Y76	Y39-G43 PolarHBondContact O-N 3.49Å; A40-G43 PolarHBondContact O-N 3.04Å; L41-G43 VanDerWaalsContact C-N 3.33Å; L41-G43 PolarHBondContact O-N 2.81Å; G43-A45 VanDerWaalsContact C-N 3.32Å; G43-A45 PolarHBondContact O-N 2.76Å; G43-M46 PolarHBondContact O-N 3.4Å; G43-E47 WeakPolarHBondContact O-CB 3.38Å; G43-E47 PolarHBondContact O-N 3.27Å; G43-Y76 VanDerWaalsContact C-CD2 3.46Å
44	L	96.3	Very high	94.8	Very high	35 Å²	35	54.9 Å²	54.9	18%	0.183	28%	0.278	C	S	.	.	H	α-helix	trans	-58	-43.5	175.7	-75.8	172.1	0	0	0	112.2	A40 L41 E47 I48 T68 A72 A73	A40-L44 WeakPolarHBondContact O-CG 3.47Å; A40-L44 PolarHBondContact O-N 3.11Å; L41-L44 PolarHBondContact O-N 3.37Å; L44-E47 PolarHBondContact O-N 3.17Å; L44-I48 WeakPolarHBondContact O-CD1 3.45Å; L44-I48 VanDerWaalsContact O-CG1 3.25Å; L44-I48 WeakPolarHBondContact O-CG1 3.43Å; L44-I48 PolarHBondContact O-N 2.93Å; L44-T68 HydrophobicContact CD2-CG2 4.05Å; L44-A72 HydrophobicContact CD2-CB 4.16Å; L44-A73 HydrophobicContact CD1-CB 3.72Å; L44-A73 HydrophobicContact CD2-CB 4.02Å; L44-A73 HydrophobicContact CG-CB 3.88Å
45	A	95.5	Very high	94.8	Very high	49 Å²	49	50.8 Å²	50.8	41%	0.405	26%	0.258	S	S	.	.	H	α-helix	trans	-63.3	-44.5	178.2	0	0	0	0	0	111.7	L41 H42 G43 E47 I48 L49	L41-A45 WeakPolarHBondContact O-CB 3.5Å; L41-A45 PolarHBondContact O-N 3.25Å; H42-A45 PolarHBondContact O-N 2.76Å; G43-A45 VanDerWaalsContact C-N 3.32Å; G43-A45 PolarHBondContact O-N 2.76Å; A45-E47 VanDerWaalsContact C-N 3.34Å; A45-E47 PolarHBondContact O-N 2.92Å; A45-I48 PolarHBondContact O-N 3Å; A45-L49 WeakPolarHBondContact O-CB 3.35Å; A45-L49 VanDerWaalsContact O-CG 3.31Å; A45-L49 WeakPolarHBondContact O-CG 3.41Å; A45-L49 PolarHBondContact O-N 3.46Å
46	M	94.7	Very high	94.9	Very high	66 Å²	66	51.6 Å²	51.6	33%	0.325	27%	0.266	S	S	.	.	H	α-helix	trans	-63.8	-39	176.8	-70.7	-64.1	-67.7	0	0	111.9	H42 G43 L49 F50 A151	H42-M46 WeakPolarHBondContact O-CG 3.28Å; H42-M46 PolarHBondContact O-N 3.07Å; G43-M46 PolarHBondContact O-N 3.4Å; M46-L49 PolarHBondContact O-N 2.91Å; M46-F50 VanDerWaalsContact O-CB 3.23Å; M46-F50 WeakPolarHBondContact O-CB 3.29Å; M46-F50 PolarHBondContact O-N 3.16Å; M46-A151 HydrophobicContact CE-CB 4.48Å
47	E	95	Very high	94.8	Very high	38 Å²	38	55.6 Å²	55.6	18%	0.178	29%	0.289	C	S	.	.	H	α-helix	trans	-65.7	-45.1	177.6	-176.9	62	-169.5	0	0	112.5	G43 L44 A45 L49 F50 T51 T68 Y76	G43-E47 WeakPolarHBondContact O-CB 3.38Å; G43-E47 PolarHBondContact O-N 3.27Å; L44-E47 PolarHBondContact O-N 3.17Å; A45-E47 VanDerWaalsContact C-N 3.34Å; A45-E47 PolarHBondContact O-N 2.92Å; E47-L49 VanDerWaalsContact C-N 3.34Å; E47-L49 PolarHBondContact O-N 2.9Å; E47-F50 PolarHBondContact O-N 2.55Å; E47-T51 WeakPolarHBondContact O-CB 3.45Å; E47-T51 WeakPolarHBondContact O-CG2 3.48Å; E47-T51 PolarHBondContact O-N 2.6Å; E47-T51 PolarHBondContact O-OG1 3.36Å; E47-T68 WeakPolarHBondContact CG-OG1 3.5Å; E47-Y76 HydrophobicContact CB-CE2 3.67Å; E47-Y76 HydrophobicContact CG-CE2 3.99Å; E47-Y76 PolarHBondContact OE2-OH 2.94Å
48	I	95.9	Very high	94.5	Very high	73 Å²	73	52.4 Å²	52.4	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-62.8	-44.1	176.4	-68.7	166.2	0	0	0	109.8	L44 A45 T51 A52 G66 T68	L44-I48 WeakPolarHBondContact O-CD1 3.45Å; L44-I48 VanDerWaalsContact O-CG1 3.25Å; L44-I48 WeakPolarHBondContact O-CG1 3.43Å; L44-I48 PolarHBondContact O-N 2.93Å; A45-I48 PolarHBondContact O-N 3Å; I48-T51 PolarHBondContact O-OG1 3.36Å; I48-A52 WeakPolarHBondContact O-CB 3.43Å; I48-A52 PolarHBondContact O-N 3.32Å; I48-G66 WeakPolarHBondContact O-CA 3.11Å; I48-T68 HydrophobicContact CD1-CG2 4.15Å; I48-T68 HydrophobicContact CG1-CG2 3.81Å
49	L	95.1	Very high	94.3	Very high	107 Å²	107	56.9 Å²	56.9	56%	0.56	30%	0.299	S	S	*	.	H	α-helix	trans	-62.9	-43.8	176.2	-76.4	166.7	0	0	0	111.9	A45 M46 E47 T53	A45-L49 WeakPolarHBondContact O-CB 3.35Å; A45-L49 VanDerWaalsContact O-CG 3.31Å; A45-L49 WeakPolarHBondContact O-CG 3.41Å; A45-L49 PolarHBondContact O-N 3.46Å; M46-L49 PolarHBondContact O-N 2.91Å; E47-L49 VanDerWaalsContact C-N 3.34Å; E47-L49 PolarHBondContact O-N 2.9Å; L49-T53 VanDerWaalsContact O-CB 3.3Å; L49-T53 WeakPolarHBondContact O-CB 3.27Å; L49-T53 PolarHBondContact O-N 2.98Å; L49-T53 PolarHBondContact O-OG1 3.15Å
50	F	93.7	Very high	94	Very high	54 Å²	54	59.3 Å²	59.3	24%	0.237	32%	0.324	C	S	.	.	H	α-helix	trans	-62.9	-52.9	179.5	175.4	-107.4	0	0	0	111.1	M46 E47 A52 T53 W54 Y144 V147	M46-F50 VanDerWaalsContact O-CB 3.23Å; M46-F50 WeakPolarHBondContact O-CB 3.29Å; M46-F50 PolarHBondContact O-N 3.16Å; E47-F50 PolarHBondContact O-N 2.55Å; F50-A52 PolarHBondContact O-N 2.99Å; F50-T53 PolarHBondContact O-N 2.62Å; F50-W54 HydrophobicContact CZ-CE3 4.49Å; F50-W54 WeakPolarHBondContact O-CB 3.11Å; F50-W54 PolarHBondContact O-N 3.42Å; F50-Y144 HydrophobicContact CE1-CD2 4.47Å; F50-Y144 AromaticContact CE1-CE2 3.86Å; F50-Y144 HydrophobicContact CE1-CE2 3.86Å; F50-Y144 HydrophobicContact CZ-CD1 4.4Å; F50-Y144 HydrophobicContact CZ-CD2 4.14Å; F50-Y144 AromaticContact CZ-CE1 3.97Å; F50-Y144 HydrophobicContact CZ-CE1 3.97Å; F50-Y144 AromaticContact CZ-CE2 3.68Å; F50-Y144 HydrophobicContact CZ-CE2 3.68Å; F50-Y144 HydrophobicContact CZ-CG 4.48Å; F50-Y144 AromaticContact CZ-CZ 3.59Å; F50-V147 HydrophobicContact CD2-CG1 3.98Å; F50-V147 HydrophobicContact CE2-CG1 3.83Å; F50-V147 HydrophobicContact CE2-CG2 4.31Å
51	T	93.5	Very high	93.6	Very high	31 Å²	31	61.4 Å²	61.4	19%	0.19	33%	0.334	C	S	.	.	H	α-helix	trans	-64.7	-38.7	-179.3	53.5	0	0	0	0	112.3	E47 I48 W54 D55 G66 L67	E47-T51 WeakPolarHBondContact O-CB 3.45Å; E47-T51 WeakPolarHBondContact O-CG2 3.48Å; E47-T51 PolarHBondContact O-N 2.6Å; E47-T51 PolarHBondContact O-OG1 3.36Å; I48-T51 PolarHBondContact O-OG1 3.36Å; T51-W54 PolarHBondContact O-N 3.04Å; T51-D55 WeakPolarHBondContact O-CB 3.48Å; T51-D55 PolarHBondContact O-N 2.66Å; T51-G66 VanDerWaalsContact OG1-CA 3.22Å; T51-G66 WeakPolarHBondContact OG1-CA 3.48Å; T51-L67 WeakPolarHBondContact CG2-O 3.39Å; T51-L67 PolarHBondContact OG1-N 2.98Å; T51-L67 VanDerWaalsContact OG1-N 3.17Å; T51-L67 PolarHBondContact OG1-O 3.11Å
52	A	94.9	Very high	93.2	Very high	6 Å²	6	67.8 Å²	67.8	5%	0.05	35%	0.352	C	S	.	.	H	α-helix	trans	-62.3	-44.8	173.1	0	0	0	0	0	112	I48 F50 D55 V56 L64	I48-A52 WeakPolarHBondContact O-CB 3.43Å; I48-A52 PolarHBondContact O-N 3.32Å; F50-A52 PolarHBondContact O-N 2.99Å; A52-D55 PolarHBondContact O-N 2.98Å; A52-V56 WeakPolarHBondContact O-CG2 3.47Å; A52-V56 PolarHBondContact O-N 3.29Å; A52-V56 VanDerWaalsContact O-N 3.1Å; A52-L64 HydrophobicContact CB-CB 4.43Å; A52-L64 HydrophobicContact CB-CD2 4.47Å
53	T	94.5	Very high	92.9	Very high	71 Å²	71	72.9 Å²	72.9	44%	0.436	37%	0.374	S	S	.	.	H	α-helix	trans	-65.8	-42.1	178.4	-56.4	0	0	0	0	110.7	L49 F50 D55 V56 L57	L49-T53 VanDerWaalsContact O-CB 3.3Å; L49-T53 WeakPolarHBondContact O-CB 3.27Å; L49-T53 PolarHBondContact O-N 2.98Å; L49-T53 PolarHBondContact O-OG1 3.15Å; F50-T53 PolarHBondContact O-N 2.62Å; T53-D55 PolarHBondContact O-N 3.14Å; T53-V56 WeakPolarHBondContact O-CB 3.16Å; T53-V56 PolarHBondContact O-N 3.21Å; T53-L57 HydrophobicContact CG2-CD1 3.99Å; T53-L57 HydrophobicContact CG2-CG 4.36Å; T53-L57 VanDerWaalsContact O-CG 3.29Å; T53-L57 WeakPolarHBondContact O-CG 3.3Å; T53-L57 PolarHBondContact O-N 2.78Å
54	W	92	Very high	92.6	Very high	93 Å²	93	78 Å²	78	35%	0.352	40%	0.399	S	S	.	.	H	α-helix	trans	-62.7	-41.6	177.7	-168.5	-103.9	0	0	0	112	F50 T51 V56 L57 T58 F132 Y144	F50-W54 HydrophobicContact CZ-CE3 4.49Å; F50-W54 WeakPolarHBondContact O-CB 3.11Å; F50-W54 PolarHBondContact O-N 3.42Å; T51-W54 PolarHBondContact O-N 3.04Å; W54-V56 VanDerWaalsContact C-N 3.35Å; W54-V56 PolarHBondContact O-N 3.16Å; W54-L57 PolarHBondContact O-N 2.79Å; W54-T58 HydrophobicContact CD2-CG2 4.08Å; W54-T58 HydrophobicContact CG-CG2 4.38Å; W54-T58 HydrophobicContact CZ2-CG2 3.82Å; W54-T58 WeakPolarHBondContact O-CB 3.29Å; W54-T58 WeakPolarHBondContact O-CG2 3.27Å; W54-T58 PolarHBondContact O-N 3.42Å; W54-T58 PolarHBondContact O-OG1 3.37Å; W54-F132 HydrophobicContact CH2-CE1 4.06Å; W54-F132 AromaticContact CH2-CZ 3.91Å; W54-F132 HydrophobicContact CH2-CZ 3.91Å; W54-F132 AromaticContact CZ2-CE1 3.94Å; W54-F132 HydrophobicContact CZ2-CE1 3.94Å; W54-F132 AromaticContact CZ2-CZ 3.49Å; W54-F132 HydrophobicContact CZ2-CZ 3.49Å; W54-F132 VanDerWaalsContact CZ2-CZ 3.49Å; W54-Y144 HydrophobicContact CE3-CE1 4.48Å; W54-Y144 HydrophobicContact CH2-CE1 4Å; W54-Y144 HydrophobicContact CZ2-CE1 4.32Å; W54-Y144 HydrophobicContact CZ3-CE1 4.08Å
55	D	92.2	Very high	92.2	Very high	23 Å²	23	82.2 Å²	82.2	12%	0.123	42%	0.418	C	S	.	.	H	α-helix	trans	-64.7	-38	176.1	-160.3	59.2	0	0	0	111.9	T51 A52 T53 K59 G60 N61	T51-D55 WeakPolarHBondContact O-CB 3.48Å; T51-D55 PolarHBondContact O-N 2.66Å; A52-D55 PolarHBondContact O-N 2.98Å; T53-D55 PolarHBondContact O-N 3.14Å; D55-K59 WeakPolarHBondContact O-CA 3.13Å; D55-K59 WeakPolarHBondContact O-CB 3.37Å; D55-K59 PolarHBondContact O-N 2.9Å; D55-K59 WeakPolarHBondContact OD1-CD 3.39Å; D55-K59 VanDerWaalsContact OD1-CE 3.31Å; D55-K59 WeakPolarHBondContact OD1-CE 3.2Å; D55-K59 IonicContact OD1-NZ 2.73Å; D55-K59 PolarHBondContact OD1-NZ 3.23Å; D55-G60 PolarHBondContact O-N 2.92Å; D55-N61 VanDerWaalsContact OD2-CB 3.32Å; D55-N61 WeakPolarHBondContact OD2-CB 3.43Å; D55-N61 PolarHBondContact OD2-ND2 3.07Å
56	V	93.7	Very high	91.9	Very high	41 Å²	41	81 Å²	81	25%	0.248	41%	0.409	C	S	.	.	H	α-helix	trans	-62.7	-46.9	171.9	171.9	0	0	0	0	111.2	A52 T53 W54 G60 N61 L64	A52-V56 WeakPolarHBondContact O-CG2 3.47Å; A52-V56 PolarHBondContact O-N 3.29Å; A52-V56 VanDerWaalsContact O-N 3.1Å; T53-V56 WeakPolarHBondContact O-CB 3.16Å; T53-V56 PolarHBondContact O-N 3.21Å; W54-V56 VanDerWaalsContact C-N 3.35Å; W54-V56 PolarHBondContact O-N 3.16Å; V56-G60 WeakPolarHBondContact O-CA 3.42Å; V56-G60 PolarHBondContact O-N 3.28Å; V56-N61 WeakPolarHBondContact CG2-O 3.39Å; V56-L64 HydrophobicContact CG2-CD2 3.6Å; V56-L64 HydrophobicContact CG2-CG 4.38Å
57	L	92.8	Very high	91.7	Very high	129 Å²	129	84.7 Å²	84.7	68%	0.675	43%	0.43	S	S	*	.	H	α-helix	trans	-69.2	-37.6	-175.6	-70.8	173.8	0	0	0	112.6	T53 W54	T53-L57 HydrophobicContact CG2-CD1 3.99Å; T53-L57 HydrophobicContact CG2-CG 4.36Å; T53-L57 VanDerWaalsContact O-CG 3.29Å; T53-L57 WeakPolarHBondContact O-CG 3.3Å; T53-L57 PolarHBondContact O-N 2.78Å; W54-L57 PolarHBondContact O-N 2.79Å
58	T	89.9	Confident	91.6	Very high	76 Å²	76	85.7 Å²	85.7	47%	0.466	44%	0.439	S	S	.	.	H	α-helix	trans	-93	-36.9	-174.3	56.4	0	0	0	0	113.5	W54	W54-T58 HydrophobicContact CD2-CG2 4.08Å; W54-T58 HydrophobicContact CG-CG2 4.38Å; W54-T58 HydrophobicContact CZ2-CG2 3.82Å; W54-T58 WeakPolarHBondContact O-CB 3.29Å; W54-T58 WeakPolarHBondContact O-CG2 3.27Å; W54-T58 PolarHBondContact O-N 3.42Å; W54-T58 PolarHBondContact O-OG1 3.37Å
59	K	90.6	Very high	91.4	Very high	157 Å²	157	83.7 Å²	83.7	68%	0.683	43%	0.431	S	S	*	.	H	α-helix	trans	-112.1	-5.6	-176	-51.4	-170.6	-163.5	135.1	0	113.7	D55 N61	D55-K59 WeakPolarHBondContact O-CA 3.13Å; D55-K59 WeakPolarHBondContact O-CB 3.37Å; D55-K59 PolarHBondContact O-N 2.9Å; D55-K59 WeakPolarHBondContact OD1-CD 3.39Å; D55-K59 VanDerWaalsContact OD1-CE 3.31Å; D55-K59 WeakPolarHBondContact OD1-CE 3.2Å; D55-K59 IonicContact OD1-NZ 2.73Å; D55-K59 PolarHBondContact OD1-NZ 3.23Å; K59-N61 PolarHBondContact O-N 3.3Å
60	G	88.7	Confident	91.4	Very high	52 Å²	52	84.2 Å²	84.2	54%	0.536	43%	0.433	S	S	.	.			trans	70	10.7	-176.8	0	0	0	0	0	114.1	D55 V56 R62	D55-G60 PolarHBondContact O-N 2.92Å; V56-G60 WeakPolarHBondContact O-CA 3.42Å; V56-G60 PolarHBondContact O-N 3.28Å; G60-R62 PolarHBondContact O-N 3.41Å; G60-R62 VanDerWaalsContact O-N 3.12Å
61	N	87.9	Confident	91.4	Very high	52 Å²	52	87.1 Å²	87.1	28%	0.278	44%	0.443	S	S	.	.			trans	-79.8	96.6	-174	178.5	16.8	0	0	0	111.8	D55 V56 K59 K63	D55-N61 VanDerWaalsContact OD2-CB 3.32Å; D55-N61 WeakPolarHBondContact OD2-CB 3.43Å; D55-N61 PolarHBondContact OD2-ND2 3.07Å; V56-N61 WeakPolarHBondContact CG2-O 3.39Å; K59-N61 PolarHBondContact O-N 3.3Å; N61-K63 PolarHBondContact O-N 2.79Å; N61-K63 VanDerWaalsContact O-N 3.09Å; N61-K63 VanDerWaalsContact OD1-CB 3.32Å; N61-K63 WeakPolarHBondContact OD1-CB 3.39Å; N61-K63 VanDerWaalsContact OD1-CG 3.31Å; N61-K63 WeakPolarHBondContact OD1-CG 3.25Å; N61-K63 PolarHBondContact OD1-N 2.97Å
62	R	88.4	Confident	91.5	Very high	219 Å²	219	86 Å²	86	83%	0.826	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	6.4	-178.7	-60.6	-173.8	-174.9	148.7	2.2	115.4	G60 L64	G60-R62 PolarHBondContact O-N 3.41Å; G60-R62 VanDerWaalsContact O-N 3.12Å; R62-L64 PolarHBondContact O-N 2.69Å
63	K	89.9	Confident	91.5	Very high	154 Å²	154	86.2 Å²	86.2	67%	0.67	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.5	175.2	-64.6	179.3	-179.6	179.2	0	112.9	N61 H65	N61-K63 PolarHBondContact O-N 2.79Å; N61-K63 VanDerWaalsContact O-N 3.09Å; N61-K63 VanDerWaalsContact OD1-CB 3.32Å; N61-K63 WeakPolarHBondContact OD1-CB 3.39Å; N61-K63 VanDerWaalsContact OD1-CG 3.31Å; N61-K63 WeakPolarHBondContact OD1-CG 3.25Å; N61-K63 PolarHBondContact OD1-N 2.97Å; K63-H65 PolarHBondContact O-CD2 2.85Å; K63-H65 VanDerWaalsContact O-CD2 3.3Å; K63-H65 PolarHBondContact O-N 3.01Å
64	L	89.2	Confident	91.6	Very high	111 Å²	111	87.8 Å²	87.8	58%	0.581	44%	0.439	S	S	*	.			trans	54.7	37.4	175.7	-65.9	167.9	0	0	0	112.9	A52 V56 R62 G66	A52-L64 HydrophobicContact CB-CB 4.43Å; A52-L64 HydrophobicContact CB-CD2 4.47Å; V56-L64 HydrophobicContact CG2-CD2 3.6Å; V56-L64 HydrophobicContact CG2-CG 4.38Å; R62-L64 PolarHBondContact O-N 2.69Å; L64-G66 PolarHBondContact O-N 3.32Å
65	H	88.7	Confident	91.7	Very high	125 Å²	125	84.1 Å²	84.1	58%	0.579	43%	0.426	S	S	*	.			trans	-76.6	110.6	173.6	-71	-175.1	0	0	0	109.1	K63	K63-H65 PolarHBondContact O-CD2 2.85Å; K63-H65 VanDerWaalsContact O-CD2 3.3Å; K63-H65 PolarHBondContact O-N 3.01Å
66	G	89.4	Confident	91.9	Very high	22 Å²	22	84.8 Å²	84.8	23%	0.227	43%	0.427	C	S	.	.			trans	-89.5	129.8	167.4	0	0	0	0	0	110.1	I48 T51 L64	I48-G66 WeakPolarHBondContact O-CA 3.11Å; T51-G66 VanDerWaalsContact OG1-CA 3.22Å; T51-G66 WeakPolarHBondContact OG1-CA 3.48Å; L64-G66 PolarHBondContact O-N 3.32Å
67	L	89.2	Confident	92	Very high	144 Å²	144	82.8 Å²	82.8	75%	0.754	42%	0.416	S	S	*	.			trans	-108.4	133.4	177.4	-72.9	168.4	0	0	0	108.4	T51	T51-L67 WeakPolarHBondContact CG2-O 3.39Å; T51-L67 PolarHBondContact OG1-N 2.98Å; T51-L67 VanDerWaalsContact OG1-N 3.17Å; T51-L67 PolarHBondContact OG1-O 3.11Å
68	T	92.7	Very high	92.2	Very high	60 Å²	60	80 Å²	80	37%	0.368	40%	0.401	S	S	.	.			trans	-146.9	163.8	177.6	-169.8	0	0	0	0	110.7	L44 E47 I48 A72	L44-T68 HydrophobicContact CD2-CG2 4.05Å; E47-T68 WeakPolarHBondContact CG-OG1 3.5Å; I48-T68 HydrophobicContact CD1-CG2 4.15Å; I48-T68 HydrophobicContact CG1-CG2 3.81Å; T68-A72 WeakPolarHBondContact OG1-CB 3.35Å
69	S	93.3	Very high	92.5	Very high	31 Å²	31	77.2 Å²	77.2	22%	0.217	38%	0.384	C	S	.	.			trans	-103.6	150.8	174.4	177.1	0	0	0	0	110.6	W71 A72	S69-W71 PolarHBondContact O-N 3.09Å; S69-W71 VanDerWaalsContact O-N 3.17Å; S69-W71 VanDerWaalsContact OG-CD1 3.3Å; S69-W71 PolarHBondContact OG-N 3.39Å; S69-A72 WeakPolarHBondContact O-CB 3.48Å; S69-A72 PolarHBondContact O-N 3.47Å
70	I	93.8	Very high	92.8	Very high	117 Å²	117	71.3 Å²	71.3	60%	0.6	36%	0.359	S	S	*	.	H	α-helix	trans	-60.6	-26.1	172.8	-165.6	60.3	0	0	0	112.2	A72 A73 F74	I70-A72 PolarHBondContact O-N 3.21Å; I70-A73 HydrophobicContact CD1-CB 4.42Å; I70-A73 VanDerWaalsContact O-CB 3.28Å; I70-A73 WeakPolarHBondContact O-CB 3.48Å; I70-A73 PolarHBondContact O-N 3.03Å; I70-A73 VanDerWaalsContact O-N 3.11Å; I70-F74 HydrophobicContact CG1-CE2 4.38Å; I70-F74 WeakPolarHBondContact O-CD2 3.38Å
71	W	94.9	Very high	93.1	Very high	116 Å²	116	70.3 Å²	70.3	44%	0.439	34%	0.342	S	S	.	.	H	α-helix	trans	-59.1	-31.4	173	-65	120.3	0	0	0	112.2	S69 A73 F74 I75 L118	S69-W71 PolarHBondContact O-N 3.09Å; S69-W71 VanDerWaalsContact O-N 3.17Å; S69-W71 VanDerWaalsContact OG-CD1 3.3Å; S69-W71 PolarHBondContact OG-N 3.39Å; W71-A73 VanDerWaalsContact C-N 3.25Å; W71-A73 PolarHBondContact O-N 3.03Å; W71-F74 HydrophobicContact CE3-CD2 4.28Å; W71-F74 PolarHBondContact O-N 3.43Å; W71-F74 VanDerWaalsContact O-N 3.09Å; W71-I75 HydrophobicContact CB-CD1 4.3Å; W71-I75 WeakPolarHBondContact O-CD1 3.13Å; W71-I75 VanDerWaalsContact O-CG1 3.26Å; W71-I75 WeakPolarHBondContact O-CG1 3.37Å; W71-I75 PolarHBondContact O-N 3.02Å; W71-L118 HydrophobicContact CB-CD1 4Å; W71-L118 HydrophobicContact CD2-CD2 3.74Å; W71-L118 HydrophobicContact CE3-CD2 4.1Å; W71-L118 HydrophobicContact CG-CD1 4.13Å; W71-L118 HydrophobicContact CG-CD2 3.98Å; W71-L118 HydrophobicContact CZ2-CD2 4.36Å
72	A	94.7	Very high	93.4	Very high	7 Å²	7	69.7 Å²	69.7	6%	0.058	34%	0.34	C	S	.	.	H	α-helix	trans	-59.8	-36.3	177	0	0	0	0	0	111.9	L44 T68 S69 I70 F74 I75 Y76	L44-A72 HydrophobicContact CD2-CB 4.16Å; T68-A72 WeakPolarHBondContact OG1-CB 3.35Å; S69-A72 WeakPolarHBondContact O-CB 3.48Å; S69-A72 PolarHBondContact O-N 3.47Å; I70-A72 PolarHBondContact O-N 3.21Å; A72-F74 VanDerWaalsContact C-N 3.31Å; A72-F74 PolarHBondContact O-N 3.42Å; A72-I75 PolarHBondContact O-N 2.89Å; A72-Y76 HydrophobicContact CB-CD2 3.99Å; A72-Y76 HydrophobicContact CB-CE2 3.77Å; A72-Y76 WeakPolarHBondContact O-CB 3.4Å; A72-Y76 WeakPolarHBondContact O-CD2 3.23Å; A72-Y76 PolarHBondContact O-N 2.96Å
73	A	95.3	Very high	93.6	Very high	11 Å²	11	59.7 Å²	59.7	9%	0.091	31%	0.305	C	S	.	.	H	α-helix	trans	-58.6	-44.9	175.7	0	0	0	0	0	111.6	A40 L44 I70 W71 G77	A40-A73 HydrophobicContact CB-CB 4.37Å; A40-A73 VanDerWaalsContact CB-O 3.27Å; A40-A73 WeakPolarHBondContact CB-O 3.37Å; L44-A73 HydrophobicContact CD1-CB 3.72Å; L44-A73 HydrophobicContact CD2-CB 4.02Å; L44-A73 HydrophobicContact CG-CB 3.88Å; I70-A73 HydrophobicContact CD1-CB 4.42Å; I70-A73 VanDerWaalsContact O-CB 3.28Å; I70-A73 WeakPolarHBondContact O-CB 3.48Å; I70-A73 PolarHBondContact O-N 3.03Å; I70-A73 VanDerWaalsContact O-N 3.11Å; W71-A73 VanDerWaalsContact C-N 3.25Å; W71-A73 PolarHBondContact O-N 3.03Å; A73-G77 WeakPolarHBondContact O-CA 3.14Å; A73-G77 PolarHBondContact O-N 2.92Å
74	F	95.8	Very high	93.7	Very high	103 Å²	103	52.8 Å²	52.8	45%	0.452	28%	0.275	S	S	.	.	H	α-helix	trans	-70.3	-45.6	178.9	-65.5	-77.8	0	0	0	111.5	F36 I70 W71 A72 L78	F36-F74 HydrophobicContact CZ-CD1 4.09Å; I70-F74 HydrophobicContact CG1-CE2 4.38Å; I70-F74 WeakPolarHBondContact O-CD2 3.38Å; W71-F74 HydrophobicContact CE3-CD2 4.28Å; W71-F74 PolarHBondContact O-N 3.43Å; W71-F74 VanDerWaalsContact O-N 3.09Å; A72-F74 VanDerWaalsContact C-N 3.31Å; A72-F74 PolarHBondContact O-N 3.42Å; F74-L78 VanDerWaalsContact O-CB 3.29Å; F74-L78 WeakPolarHBondContact O-CB 3.37Å; F74-L78 VanDerWaalsContact O-CG 3.23Å; F74-L78 WeakPolarHBondContact O-CG 3.48Å; F74-L78 PolarHBondContact O-N 3.38Å
75	I	95.8	Very high	93.8	Very high	16 Å²	16	52.6 Å²	52.6	8%	0.082	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-53.8	179.7	-63.6	161.1	0	0	0	109.8	W71 A72 L78 T79 T114 L118 W126	W71-I75 HydrophobicContact CB-CD1 4.3Å; W71-I75 WeakPolarHBondContact O-CD1 3.13Å; W71-I75 VanDerWaalsContact O-CG1 3.26Å; W71-I75 WeakPolarHBondContact O-CG1 3.37Å; W71-I75 PolarHBondContact O-N 3.02Å; A72-I75 PolarHBondContact O-N 2.89Å; I75-L78 PolarHBondContact O-N 3Å; I75-T79 VanDerWaalsContact O-CB 3.23Å; I75-T79 WeakPolarHBondContact O-CB 3.37Å; I75-T79 PolarHBondContact O-N 3Å; I75-T79 PolarHBondContact O-OG1 3.47Å; I75-T114 HydrophobicContact CG1-CG2 4.01Å; I75-T114 HydrophobicContact CG2-CG2 4.47Å; I75-L118 HydrophobicContact CD1-CD1 4.08Å; I75-W126 HydrophobicContact CD1-CH2 3.66Å; I75-W126 HydrophobicContact CD1-CZ3 3.71Å
76	Y	96.1	Very high	94	Very high	37 Å²	37	48 Å²	48	15%	0.145	25%	0.25	C	S	.	.	H	α-helix	trans	-67.4	-42.1	-179.2	-65	-45.9	0	0	0	112.8	G43 E47 A72 L78 T79 L80 W148	G43-Y76 VanDerWaalsContact C-CD2 3.46Å; E47-Y76 HydrophobicContact CB-CE2 3.67Å; E47-Y76 HydrophobicContact CG-CE2 3.99Å; E47-Y76 PolarHBondContact OE2-OH 2.94Å; A72-Y76 HydrophobicContact CB-CD2 3.99Å; A72-Y76 HydrophobicContact CB-CE2 3.77Å; A72-Y76 WeakPolarHBondContact O-CB 3.4Å; A72-Y76 WeakPolarHBondContact O-CD2 3.23Å; A72-Y76 PolarHBondContact O-N 2.96Å; Y76-L78 VanDerWaalsContact C-N 3.34Å; Y76-L78 PolarHBondContact O-N 3.2Å; Y76-T79 PolarHBondContact O-N 2.93Å; Y76-L80 VanDerWaalsContact O-CB 3.31Å; Y76-L80 WeakPolarHBondContact O-CB 3.37Å; Y76-L80 VanDerWaalsContact O-CG 3.3Å; Y76-L80 WeakPolarHBondContact O-CG 3.45Å; Y76-L80 PolarHBondContact O-N 2.93Å; Y76-W148 AromaticContact CE1-CH2 3.67Å; Y76-W148 HydrophobicContact CE1-CH2 3.67Å; Y76-W148 AromaticContact CE1-CZ3 3.98Å; Y76-W148 HydrophobicContact CE1-CZ3 3.98Å
77	G	96	Very high	94.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57	-46.8	175.9	0	0	0	0	0	112	F36 A73 L81	F36-G77 VanDerWaalsContact CE2-C 3.49Å; A73-G77 WeakPolarHBondContact O-CA 3.14Å; A73-G77 PolarHBondContact O-N 2.92Å; G77-L81 WeakPolarHBondContact O-CB 3.37Å; G77-L81 PolarHBondContact O-N 3.42Å
78	L	96.2	Very high	94.2	Very high	71 Å²	71	43.5 Å²	43.5	37%	0.372	23%	0.227	S	C	.	.	H	α-helix	trans	-71.1	-42.8	178.9	-70.1	176	0	0	0	112.4	F36 F74 I75 Y76 L80 L81 T82 W110	F36-L78 HydrophobicContact CD2-CD2 4.39Å; F36-L78 HydrophobicContact CE2-CD2 4.04Å; F36-L78 HydrophobicContact CE2-CG 4Å; F74-L78 VanDerWaalsContact O-CB 3.29Å; F74-L78 WeakPolarHBondContact O-CB 3.37Å; F74-L78 VanDerWaalsContact O-CG 3.23Å; F74-L78 WeakPolarHBondContact O-CG 3.48Å; F74-L78 PolarHBondContact O-N 3.38Å; I75-L78 PolarHBondContact O-N 3Å; Y76-L78 VanDerWaalsContact C-N 3.34Å; Y76-L78 PolarHBondContact O-N 3.2Å; L78-L80 VanDerWaalsContact C-N 3.33Å; L78-L80 PolarHBondContact O-N 3.39Å; L78-L81 PolarHBondContact O-N 2.88Å; L78-T82 WeakPolarHBondContact O-CB 3.43Å; L78-T82 WeakPolarHBondContact O-CG2 3.26Å; L78-T82 PolarHBondContact O-N 3.29Å; L78-T82 PolarHBondContact O-OG1 3.44Å; L78-W110 HydrophobicContact CB-CH2 4.18Å; L78-W110 HydrophobicContact CB-CZ3 4.21Å; L78-W110 HydrophobicContact CD1-CH2 4.48Å; L78-W110 HydrophobicContact CD1-CZ3 4.27Å
79	T	96.5	Very high	94.2	Very high	17 Å²	17	47.8 Å²	47.8	10%	0.104	24%	0.24	C	C	.	.	H	α-helix	trans	-58.7	-46.6	178.9	-59	0	0	0	0	110.6	I75 Y76 T82 G83 W106 W110	I75-T79 VanDerWaalsContact O-CB 3.23Å; I75-T79 WeakPolarHBondContact O-CB 3.37Å; I75-T79 PolarHBondContact O-N 3Å; I75-T79 PolarHBondContact O-OG1 3.47Å; Y76-T79 PolarHBondContact O-N 2.93Å; T79-T82 PolarHBondContact O-OG1 2.61Å; T79-G83 WeakPolarHBondContact O-CA 3.17Å; T79-G83 PolarHBondContact O-N 3.41Å; T79-W106 PolarHBondContact O-NE1 2.84Å; T79-W110 HydrophobicContact CG2-CB 4.1Å; T79-W110 HydrophobicContact CG2-CG 4.07Å; T79-W110 WeakPolarHBondContact OG1-CB 3.45Å; T79-W110 VanDerWaalsContact OG1-CG 3.25Å
80	L	96.1	Very high	94.1	Very high	32 Å²	32	47.7 Å²	47.7	17%	0.168	24%	0.237	C	C	.	.	H	α-helix	trans	-73.4	-40.3	179.2	-69	173.2	0	0	0	112.4	Y39 Y76 L78 T82 G83 E84 T155	Y39-L80 HydrophobicContact CD1-CB 4.43Å; Y39-L80 HydrophobicContact CD2-CB 3.74Å; Y39-L80 HydrophobicContact CE2-CB 4.45Å; Y39-L80 HydrophobicContact CG-CB 3.72Å; Y39-L80 HydrophobicContact CG-CD1 4.33Å; Y76-L80 VanDerWaalsContact O-CB 3.31Å; Y76-L80 WeakPolarHBondContact O-CB 3.37Å; Y76-L80 VanDerWaalsContact O-CG 3.3Å; Y76-L80 WeakPolarHBondContact O-CG 3.45Å; Y76-L80 PolarHBondContact O-N 2.93Å; L78-L80 VanDerWaalsContact C-N 3.33Å; L78-L80 PolarHBondContact O-N 3.39Å; L80-T82 VanDerWaalsContact C-N 3.3Å; L80-T82 PolarHBondContact O-N 3.14Å; L80-G83 PolarHBondContact O-N 3.01Å; L80-E84 PolarHBondContact O-N 3.36Å; L80-T155 HydrophobicContact CD1-CG2 4.1Å; L80-T155 HydrophobicContact CD2-CG2 3.46Å; L80-T155 VanDerWaalsContact CD2-CG2 3.46Å; L80-T155 HydrophobicContact CG-CG2 4.42Å
81	L	94.4	Very high	93.9	Very high	32 Å²	32	47.1 Å²	47.1	17%	0.168	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-37.8	177.6	-174	70.2	0	0	0	111.9	R35 F36 Y39 G77 L78 E84	R35-L81 HydrophobicContact CB-CD1 4.04Å; F36-L81 HydrophobicContact CB-CD2 4.24Å; F36-L81 HydrophobicContact CD2-CD2 4.41Å; Y39-L81 HydrophobicContact CD2-CB 4.08Å; Y39-L81 HydrophobicContact CD2-CD1 4.34Å; Y39-L81 HydrophobicContact CE2-CB 4.43Å; Y39-L81 HydrophobicContact CE2-CD1 4.16Å; G77-L81 WeakPolarHBondContact O-CB 3.37Å; G77-L81 PolarHBondContact O-N 3.42Å; L78-L81 PolarHBondContact O-N 2.88Å; L81-E84 VanDerWaalsContact O-CG 3.25Å; L81-E84 WeakPolarHBondContact O-CG 3.43Å
82	T	94.5	Very high	93.6	Very high	39 Å²	39	46.2 Å²	46.2	24%	0.239	24%	0.241	C	C	.	.	H	α-helix	trans	-79.8	-36.3	174.8	57.3	0	0	0	0	111.7	L78 T79 L80 E84 Q85 W106 W110	L78-T82 WeakPolarHBondContact O-CB 3.43Å; L78-T82 WeakPolarHBondContact O-CG2 3.26Å; L78-T82 PolarHBondContact O-N 3.29Å; L78-T82 PolarHBondContact O-OG1 3.44Å; T79-T82 PolarHBondContact O-OG1 2.61Å; L80-T82 VanDerWaalsContact C-N 3.3Å; L80-T82 PolarHBondContact O-N 3.14Å; T82-E84 VanDerWaalsContact C-N 3.26Å; T82-E84 PolarHBondContact O-N 2.91Å; T82-Q85 VanDerWaalsContact O-CB 3.28Å; T82-Q85 WeakPolarHBondContact O-CB 3.43Å; T82-Q85 WeakPolarHBondContact O-CG 3.41Å; T82-Q85 PolarHBondContact O-N 2.88Å; T82-W106 WeakPolarHBondContact OG1-CZ2 3.29Å; T82-W106 PolarHBondContact OG1-NE1 3.38Å; T82-W106 VanDerWaalsContact OG1-NE1 3.07Å; T82-W110 HydrophobicContact CG2-CZ2 4.03Å; T82-W110 PolarHBondContact OG1-NE1 3.44Å
83	G	93.5	Very high	93.3	Very high	9 Å²	9	55.7 Å²	55.7	9%	0.093	28%	0.276	C	S	.	.	H	α-helix	trans	-62.5	-27.2	176.2	0	0	0	0	0	113.9	T79 L80 Q85 I86 Y87	T79-G83 WeakPolarHBondContact O-CA 3.17Å; T79-G83 PolarHBondContact O-N 3.41Å; L80-G83 PolarHBondContact O-N 3.01Å; G83-Q85 PolarHBondContact O-N 3.23Å; G83-Q85 VanDerWaalsContact O-N 3.14Å; G83-I86 WeakPolarHBondContact O-CA 3.45Å; G83-I86 VanDerWaalsContact O-CB 3.27Å; G83-I86 WeakPolarHBondContact O-CB 3.47Å; G83-I86 PolarHBondContact O-N 3.15Å; G83-Y87 PolarHBondContact O-N 3.3Å; G83-Y87 VanDerWaalsContact O-N 3.13Å
84	E	92.9	Very high	93.1	Very high	9 Å²	9	59 Å²	59	4%	0.042	29%	0.289	C	S	.	.	H	α-helix	trans	-60.4	-25.4	173.7	88.8	-173.1	-180	0	0	112.4	R35 Y39 L80 L81 T82 Y87 A88 V160 M164	R35-E84 WeakPolarHBondContact CD-OE2 3.23Å; R35-E84 IonicContact CZ-OE1 3.2Å; R35-E84 IonicContact CZ-OE2 3.84Å; R35-E84 IonicContact NE-OE1 3.01Å; R35-E84 PolarHBondContact NE-OE1 2.82Å; R35-E84 IonicContact NE-OE2 2.97Å; R35-E84 PolarHBondContact NE-OE2 3.5Å; R35-E84 IonicContact NH2-OE1 2.69Å; R35-E84 PolarHBondContact NH2-OE1 3.3Å; Y39-E84 WeakPolarHBondContact CE2-OE2 3.38Å; Y39-E84 PolarHBondContact OH-OE2 2.96Å; L80-E84 PolarHBondContact O-N 3.36Å; L81-E84 VanDerWaalsContact O-CG 3.25Å; L81-E84 WeakPolarHBondContact O-CG 3.43Å; T82-E84 VanDerWaalsContact C-N 3.26Å; T82-E84 PolarHBondContact O-N 2.91Å; E84-Y87 WeakPolarHBondContact O-CB 3.32Å; E84-Y87 PolarHBondContact O-N 3.37Å; E84-A88 WeakPolarHBondContact O-CB 3.37Å; E84-A88 PolarHBondContact O-N 3.47Å; E84-V160 HydrophobicContact CB-CG1 4.04Å; E84-M164 HydrophobicContact CB-CE 3.99Å; E84-M164 HydrophobicContact CG-CE 3.68Å
85	Q	91.1	Very high	92.9	Very high	106 Å²	106	56.2 Å²	56.2	50%	0.495	29%	0.29	S	S	.	.	H	α-helix	trans	-72.2	-34.3	174.2	-56.6	-169.5	-5.7	0	0	112	T82 G83 A88 K89	T82-Q85 VanDerWaalsContact O-CB 3.28Å; T82-Q85 WeakPolarHBondContact O-CB 3.43Å; T82-Q85 WeakPolarHBondContact O-CG 3.41Å; T82-Q85 PolarHBondContact O-N 2.88Å; G83-Q85 PolarHBondContact O-N 3.23Å; G83-Q85 VanDerWaalsContact O-N 3.14Å; Q85-A88 PolarHBondContact O-N 2.98Å; Q85-K89 WeakPolarHBondContact O-CB 3.28Å; Q85-K89 VanDerWaalsContact O-CG 3.32Å; Q85-K89 WeakPolarHBondContact O-CG 3.26Å; Q85-K89 PolarHBondContact O-N 3.49Å
86	I	92.5	Very high	92.8	Very high	28 Å²	28	58.7 Å²	58.7	14%	0.144	30%	0.302	C	S	.	.	H	α-helix	trans	-62	-49.1	172.4	-60.1	178.1	0	0	0	108.6	G83 A88 K89 M90 A102 Y103 W106	G83-I86 WeakPolarHBondContact O-CA 3.45Å; G83-I86 VanDerWaalsContact O-CB 3.27Å; G83-I86 WeakPolarHBondContact O-CB 3.47Å; G83-I86 PolarHBondContact O-N 3.15Å; I86-A88 PolarHBondContact O-N 3.08Å; I86-K89 PolarHBondContact O-N 2.82Å; I86-M90 HydrophobicContact CG2-CG 4.24Å; I86-M90 HydrophobicContact CG2-SD 3.41Å; I86-M90 WeakPolarHBondContact CG2-SD 3.3Å; I86-M90 VanDerWaalsContact O-CB 3.32Å; I86-M90 WeakPolarHBondContact O-CB 3.19Å; I86-M90 WeakPolarHBondContact O-CG 3.23Å; I86-M90 PolarHBondContact O-N 3.18Å; I86-A102 HydrophobicContact CG2-CB 4Å; I86-Y103 HydrophobicContact CB-CE1 4.24Å; I86-Y103 HydrophobicContact CG2-CD1 4.28Å; I86-Y103 HydrophobicContact CG2-CE1 3.95Å; I86-W106 HydrophobicContact CD1-CB 3.72Å; I86-W106 HydrophobicContact CD1-CD2 3.42Å; I86-W106 VanDerWaalsContact CD1-CD2 3.42Å; I86-W106 HydrophobicContact CD1-CE3 3.72Å; I86-W106 HydrophobicContact CD1-CG 3.42Å; I86-W106 VanDerWaalsContact CD1-CG 3.42Å; I86-W106 HydrophobicContact CD1-CZ3 4.49Å
87	Y	92.3	Very high	92.7	Very high	26 Å²	26	64.5 Å²	64.5	10%	0.102	33%	0.329	C	S	.	.	H	α-helix	trans	-54.9	-49.8	173.9	170.9	-100.2	0	0	0	111.7	G83 E84 K89 M90 K91 R99 Y103 E156 V160 K161	G83-Y87 PolarHBondContact O-N 3.3Å; G83-Y87 VanDerWaalsContact O-N 3.13Å; E84-Y87 WeakPolarHBondContact O-CB 3.32Å; E84-Y87 PolarHBondContact O-N 3.37Å; Y87-K89 VanDerWaalsContact C-N 3.3Å; Y87-K89 PolarHBondContact O-N 2.86Å; Y87-M90 PolarHBondContact O-N 3Å; Y87-K91 HydrophobicContact CD1-CD 4.43Å; Y87-K91 HydrophobicContact CD2-CB 4.27Å; Y87-K91 HydrophobicContact CE1-CD 3.81Å; Y87-K91 HydrophobicContact CE2-CB 3.97Å; Y87-K91 WeakPolarHBondContact O-CB 3.31Å; Y87-K91 WeakPolarHBondContact O-CG 3.36Å; Y87-K91 PolarHBondContact O-N 2.9Å; Y87-R99 VanDerWaalsContact CD2-NH2 3.29Å; Y87-Y103 WeakPolarHBondContact CB-OH 3.4Å; Y87-E156 HydrophobicContact CD2-CG 3.62Å; Y87-E156 HydrophobicContact CE2-CG 3.89Å; Y87-V160 HydrophobicContact CD1-CG1 3.62Å; Y87-V160 HydrophobicContact CD2-CG1 4.44Å; Y87-V160 HydrophobicContact CE1-CG1 4.28Å; Y87-V160 HydrophobicContact CG-CG1 3.72Å; Y87-K161 HydrophobicContact CE2-CG 4Å; Y87-K161 WeakPolarHBondContact OH-CG 3.45Å
88	A	90.4	Very high	92.6	Very high	46 Å²	46	68.1 Å²	68.1	38%	0.38	35%	0.35	S	S	.	.	H	α-helix	trans	-59.5	-39.1	-178.2	0	0	0	0	0	113	E84 Q85 I86 M164	E84-A88 WeakPolarHBondContact O-CB 3.37Å; E84-A88 PolarHBondContact O-N 3.47Å; Q85-A88 PolarHBondContact O-N 2.98Å; I86-A88 PolarHBondContact O-N 3.08Å; A88-M164 HydrophobicContact CB-CE 4.13Å
89	K	91.6	Very high	92.6	Very high	150 Å²	150	65.8 Å²	65.8	65%	0.652	34%	0.337	S	S	*	.	H	α-helix	trans	-77.7	-35.4	179.6	-70.7	173.8	-178.7	176.6	0	112.9	Q85 I86 Y87	Q85-K89 WeakPolarHBondContact O-CB 3.28Å; Q85-K89 VanDerWaalsContact O-CG 3.32Å; Q85-K89 WeakPolarHBondContact O-CG 3.26Å; Q85-K89 PolarHBondContact O-N 3.49Å; I86-K89 PolarHBondContact O-N 2.82Å; Y87-K89 VanDerWaalsContact C-N 3.3Å; Y87-K89 PolarHBondContact O-N 2.86Å
90	M	92.1	Very high	92.5	Very high	30 Å²	30	65 Å²	65	15%	0.148	33%	0.332	C	S	.	.	H	α-helix	trans	-96.1	-24.7	-170.7	-66.1	-177.3	72	0	0	114.2	I86 Y87 S92 R93 H94 V98 R99 A102	I86-M90 HydrophobicContact CG2-CG 4.24Å; I86-M90 HydrophobicContact CG2-SD 3.41Å; I86-M90 WeakPolarHBondContact CG2-SD 3.3Å; I86-M90 VanDerWaalsContact O-CB 3.32Å; I86-M90 WeakPolarHBondContact O-CB 3.19Å; I86-M90 WeakPolarHBondContact O-CG 3.23Å; I86-M90 PolarHBondContact O-N 3.18Å; Y87-M90 PolarHBondContact O-N 3Å; M90-S92 PolarHBondContact O-N 2.87Å; M90-R93 PolarHBondContact O-N 2.76Å; M90-H94 HydrophobicContact CB-CB 4.43Å; M90-H94 HydrophobicContact CE-CB 4.04Å; M90-H94 PolarHBondContact O-N 3.35Å; M90-V98 HydrophobicContact CE-CG1 3.85Å; M90-R99 HydrophobicContact CB-CG 3.91Å; M90-R99 HydrophobicContact CE-CG 4.1Å; M90-A102 HydrophobicContact CE-CB 3.9Å; M90-A102 HydrophobicContact SD-CB 3.67Å
91	K	89.7	Confident	92.6	Very high	104 Å²	104	67.8 Å²	67.8	45%	0.452	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-28.6	-171	68.4	178.7	-174.5	177.6	0	115.1	Y87	Y87-K91 HydrophobicContact CD1-CD 4.43Å; Y87-K91 HydrophobicContact CD2-CB 4.27Å; Y87-K91 HydrophobicContact CE1-CD 3.81Å; Y87-K91 HydrophobicContact CE2-CB 3.97Å; Y87-K91 WeakPolarHBondContact O-CB 3.31Å; Y87-K91 WeakPolarHBondContact O-CG 3.36Å; Y87-K91 PolarHBondContact O-N 2.9Å
92	S	88.3	Confident	92.7	Very high	97 Å²	97	67.2 Å²	67.2	68%	0.678	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-17.7	-177.9	55.5	0	0	0	0	114.1	M90	M90-S92 PolarHBondContact O-N 2.87Å
93	R	88.8	Confident	92.8	Very high	207 Å²	207	66.4 Å²	66.4	78%	0.781	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-23.1	-171.3	-62.1	-175.2	-172	-178.3	1.7	113.6	M90	M90-R93 PolarHBondContact O-N 2.76Å
94	H	90.6	Very high	92.9	Very high	79 Å²	79	66.8 Å²	66.8	37%	0.366	34%	0.339	S	S	.	.	S	Bend	trans	-127.8	139.7	-170.1	-55	96.7	0	0	0	111.7	M90 V98 R99	M90-H94 HydrophobicContact CB-CB 4.43Å; M90-H94 HydrophobicContact CE-CB 4.04Å; M90-H94 PolarHBondContact O-N 3.35Å; H94-V98 HydrophobicContact CB-CB 4.21Å; H94-V98 HydrophobicContact CB-CG1 4.19Å; H94-R99 HydrophobicContact CB-CG 4.3Å; H94-R99 VanDerWaalsContact O-CD 3.29Å; H94-R99 WeakPolarHBondContact O-CD 3.49Å
95	G	91.8	Very high	93.1	Very high	46 Å²	46	71.5 Å²	71.5	47%	0.474	36%	0.364	S	S	.	.			trans	-64.3	166.1	173.4	0	0	0	0	0	112.7	F97 V98 R99	G95-F97 PolarHBondContact O-N 2.98Å; G95-V98 PolarHBondContact O-N 3.1Å; G95-R99 WeakPolarHBondContact O-CD 3.47Å; G95-R99 PolarHBondContact O-N 2.9Å
96	I	92.7	Very high	93.4	Very high	67 Å²	67	70 Å²	70	34%	0.344	35%	0.354	S	S	.	.	H	α-helix	trans	-58.5	-35.2	-177	-167	164.7	0	0	0	112.7	R99 G100 L153 I157	I96-R99 PolarHBondContact O-N 3.37Å; I96-G100 PolarHBondContact O-N 2.88Å; I96-L153 HydrophobicContact CD1-CD2 4.33Å; I96-L153 HydrophobicContact CG1-CD1 4.48Å; I96-L153 HydrophobicContact CG1-CD2 3.62Å; I96-I157 HydrophobicContact CD1-CD1 4.42Å
97	F	94.4	Very high	93.5	Very high	160 Å²	160	69.3 Å²	69.3	70%	0.702	35%	0.353	S	S	*	.	H	α-helix	trans	-64.7	-48.5	-179	-63.2	-76.1	0	0	0	113.3	G95 R99 G100 L101 Y149	G95-F97 PolarHBondContact O-N 2.98Å; F97-R99 PolarHBondContact O-N 2.65Å; F97-G100 PolarHBondContact O-N 3.48Å; F97-G100 VanDerWaalsContact O-N 3.17Å; F97-L101 PolarHBondContact O-N 2.82Å; F97-Y149 VanDerWaalsContact CA-OH 3.29Å; F97-Y149 WeakPolarHBondContact CA-OH 3.36Å; F97-Y149 WeakPolarHBondContact CD1-OH 3.3Å; F97-Y149 PolarHBondContact O-OH 3.5Å
98	V	95.2	Very high	93.7	Very high	75 Å²	75	69.1 Å²	69.1	46%	0.455	35%	0.352	S	S	.	.	H	α-helix	trans	-63.1	-34.5	178.3	179.5	0	0	0	0	110.8	M90 H94 G95 L101 A102	M90-V98 HydrophobicContact CE-CG1 3.85Å; H94-V98 HydrophobicContact CB-CB 4.21Å; H94-V98 HydrophobicContact CB-CG1 4.19Å; G95-V98 PolarHBondContact O-N 3.1Å; V98-L101 PolarHBondContact O-N 3.3Å; V98-A102 PolarHBondContact O-N 2.95Å
99	R	94.7	Very high	94	Very high	22 Å²	22	71 Å²	71	8%	0.083	36%	0.355	C	S	.	.	H	α-helix	trans	-69.7	-40.8	175.7	-73.2	157.2	55.7	-177.7	5	112.3	Y87 M90 H94 G95 I96 F97 L101 A102 Y103 E156	Y87-R99 VanDerWaalsContact CD2-NH2 3.29Å; M90-R99 HydrophobicContact CB-CG 3.91Å; M90-R99 HydrophobicContact CE-CG 4.1Å; H94-R99 HydrophobicContact CB-CG 4.3Å; H94-R99 VanDerWaalsContact O-CD 3.29Å; H94-R99 WeakPolarHBondContact O-CD 3.49Å; G95-R99 WeakPolarHBondContact O-CD 3.47Å; G95-R99 PolarHBondContact O-N 2.9Å; I96-R99 PolarHBondContact O-N 3.37Å; F97-R99 PolarHBondContact O-N 2.65Å; R99-L101 VanDerWaalsContact C-N 3.27Å; R99-L101 PolarHBondContact O-N 2.94Å; R99-A102 WeakPolarHBondContact O-CB 3.48Å; R99-A102 PolarHBondContact O-N 2.85Å; R99-A102 VanDerWaalsContact O-N 3.16Å; R99-Y103 HydrophobicContact CB-CE2 4.08Å; R99-Y103 WeakPolarHBondContact O-CD2 3.31Å; R99-Y103 VanDerWaalsContact O-CG 3.22Å; R99-Y103 PolarHBondContact O-N 3.42Å; R99-E156 IonicContact CZ-OE1 3.47Å; R99-E156 IonicContact CZ-OE2 3.12Å; R99-E156 IonicContact NE-OE2 2.99Å; R99-E156 PolarHBondContact NE-OE2 2.92Å; R99-E156 IonicContact NH2-OE1 2.6Å; R99-E156 PolarHBondContact NH2-OE1 3.4Å; R99-E156 IonicContact NH2-OE2 2.62Å; R99-E156 PolarHBondContact NH2-OE2 3.37Å
100	G	95.8	Very high	94.2	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-56.4	-43.3	172.2	0	0	0	0	0	111.8	I96 F97 Y103 L104 Y149	I96-G100 PolarHBondContact O-N 2.88Å; F97-G100 PolarHBondContact O-N 3.48Å; F97-G100 VanDerWaalsContact O-N 3.17Å; G100-Y103 PolarHBondContact O-N 3.45Å; G100-L104 WeakPolarHBondContact O-CB 3.44Å; G100-L104 PolarHBondContact O-N 3.47Å; G100-Y149 VanDerWaalsContact CA-CE2 3.44Å; G100-Y149 WeakPolarHBondContact O-CD2 3.23Å
101	L	96.8	Very high	94.4	Very high	91 Å²	91	66 Å²	66	48%	0.476	33%	0.331	S	S	.	.	H	α-helix	trans	-65.2	-40.8	176.4	-176.7	60.1	0	0	0	111.9	F97 V98 R99 Y103 L104 L105 Y149	F97-L101 PolarHBondContact O-N 2.82Å; V98-L101 PolarHBondContact O-N 3.3Å; R99-L101 VanDerWaalsContact C-N 3.27Å; R99-L101 PolarHBondContact O-N 2.94Å; L101-Y103 VanDerWaalsContact C-N 3.33Å; L101-Y103 PolarHBondContact O-N 2.66Å; L101-L104 HydrophobicContact CD1-CD2 4.12Å; L101-L104 WeakPolarHBondContact O-CB 3.29Å; L101-L104 PolarHBondContact O-N 3.39Å; L101-L105 HydrophobicContact CD1-CG 4.46Å; L101-L105 HydrophobicContact CG-CD1 4.43Å; L101-L105 WeakPolarHBondContact O-CG 3.4Å; L101-L105 PolarHBondContact O-N 3.44Å; L101-Y149 VanDerWaalsContact N-CE2 3.3Å
102	A	96.5	Very high	94.7	Very high	21 Å²	21	63.2 Å²	63.2	17%	0.174	32%	0.319	C	S	.	.	H	α-helix	trans	-62.2	-39.8	174.9	0	0	0	0	0	112.1	I86 M90 V98 R99 W106	I86-A102 HydrophobicContact CG2-CB 4Å; M90-A102 HydrophobicContact CE-CB 3.9Å; M90-A102 HydrophobicContact SD-CB 3.67Å; V98-A102 PolarHBondContact O-N 2.95Å; R99-A102 WeakPolarHBondContact O-CB 3.48Å; R99-A102 PolarHBondContact O-N 2.85Å; R99-A102 VanDerWaalsContact O-N 3.16Å; A102-W106 VanDerWaalsContact O-CB 3.27Å; A102-W106 WeakPolarHBondContact O-CB 3.43Å; A102-W106 PolarHBondContact O-N 3.41Å
103	Y	96	Very high	95.1	Very high	22 Å²	22	61.2 Å²	61.2	9%	0.086	31%	0.305	C	S	.	.	H	α-helix	trans	-67.9	-39.7	175.5	-57.7	-36.8	0	0	0	112.5	I86 Y87 R99 G100 L101 W106 A107 L153 E156	I86-Y103 HydrophobicContact CB-CE1 4.24Å; I86-Y103 HydrophobicContact CG2-CD1 4.28Å; I86-Y103 HydrophobicContact CG2-CE1 3.95Å; Y87-Y103 WeakPolarHBondContact CB-OH 3.4Å; R99-Y103 HydrophobicContact CB-CE2 4.08Å; R99-Y103 WeakPolarHBondContact O-CD2 3.31Å; R99-Y103 VanDerWaalsContact O-CG 3.22Å; R99-Y103 PolarHBondContact O-N 3.42Å; G100-Y103 PolarHBondContact O-N 3.45Å; L101-Y103 VanDerWaalsContact C-N 3.33Å; L101-Y103 PolarHBondContact O-N 2.66Å; Y103-W106 PolarHBondContact O-N 2.95Å; Y103-A107 WeakPolarHBondContact O-CB 3.31Å; Y103-A107 PolarHBondContact O-N 3.3Å; Y103-L153 HydrophobicContact CD2-CD2 4.48Å; Y103-L153 HydrophobicContact CE2-CD2 4.5Å; Y103-E156 HydrophobicContact CE2-CB 3.93Å; Y103-E156 HydrophobicContact CE2-CG 4.18Å; Y103-E156 WeakPolarHBondContact CE2-OE2 3.44Å; Y103-E156 VanDerWaalsContact CZ-OE2 3.26Å; Y103-E156 PolarHBondContact OH-OE2 2.91Å
104	L	96.6	Very high	95.4	Very high	17 Å²	17	52.2 Å²	52.2	9%	0.089	27%	0.273	C	S	.	.	H	α-helix	trans	-57.6	-52.8	174.5	169.9	62.3	0	0	0	111.1	G100 L101 W106 A107 Y108 A145 W148	G100-L104 WeakPolarHBondContact O-CB 3.44Å; G100-L104 PolarHBondContact O-N 3.47Å; L101-L104 HydrophobicContact CD1-CD2 4.12Å; L101-L104 WeakPolarHBondContact O-CB 3.29Å; L101-L104 PolarHBondContact O-N 3.39Å; L104-W106 VanDerWaalsContact C-N 3.27Å; L104-W106 PolarHBondContact O-N 3.03Å; L104-A107 PolarHBondContact O-N 3.17Å; L104-Y108 HydrophobicContact CD1-CD2 3.9Å; L104-Y108 HydrophobicContact CD1-CE2 3.52Å; L104-Y108 HydrophobicContact CG-CD2 4.25Å; L104-Y108 HydrophobicContact CG-CE2 4.12Å; L104-Y108 PolarHBondContact O-N 3.23Å; L104-A145 HydrophobicContact CD1-CB 4.04Å; L104-A145 WeakPolarHBondContact CD1-O 3.38Å; L104-A145 HydrophobicContact CD2-CB 4.02Å; L104-W148 HydrophobicContact CD1-CB 3.45Å; L104-W148 VanDerWaalsContact CD1-CB 3.45Å; L104-W148 HydrophobicContact CD1-CG 4.4Å
105	L	96.8	Very high	95.6	Very high	108 Å²	108	48.4 Å²	48.4	57%	0.565	26%	0.256	S	S	*	.	H	α-helix	trans	-62.5	-36.8	178.8	-65.9	175.7	0	0	0	111.8	L101 L109	L101-L105 HydrophobicContact CD1-CG 4.46Å; L101-L105 HydrophobicContact CG-CD1 4.43Å; L101-L105 WeakPolarHBondContact O-CG 3.4Å; L101-L105 PolarHBondContact O-N 3.44Å; L105-L109 WeakPolarHBondContact O-CB 3.45Å; L105-L109 PolarHBondContact O-N 3.36Å
106	W	97.1	Very high	95.8	Very high	73 Å²	73	49.2 Å²	49.2	28%	0.277	25%	0.248	S	C	.	.	H	α-helix	trans	-67	-41.2	176.5	-166.5	-109	0	0	0	112.5	T79 T82 I86 A102 Y103 L104 L109 W110	T79-W106 PolarHBondContact O-NE1 2.84Å; T82-W106 WeakPolarHBondContact OG1-CZ2 3.29Å; T82-W106 PolarHBondContact OG1-NE1 3.38Å; T82-W106 VanDerWaalsContact OG1-NE1 3.07Å; I86-W106 HydrophobicContact CD1-CB 3.72Å; I86-W106 HydrophobicContact CD1-CD2 3.42Å; I86-W106 VanDerWaalsContact CD1-CD2 3.42Å; I86-W106 HydrophobicContact CD1-CE3 3.72Å; I86-W106 HydrophobicContact CD1-CG 3.42Å; I86-W106 VanDerWaalsContact CD1-CG 3.42Å; I86-W106 HydrophobicContact CD1-CZ3 4.49Å; A102-W106 VanDerWaalsContact O-CB 3.27Å; A102-W106 WeakPolarHBondContact O-CB 3.43Å; A102-W106 PolarHBondContact O-N 3.41Å; Y103-W106 PolarHBondContact O-N 2.95Å; L104-W106 VanDerWaalsContact C-N 3.27Å; L104-W106 PolarHBondContact O-N 3.03Å; W106-L109 HydrophobicContact CE3-CD2 4Å; W106-L109 HydrophobicContact CH2-CD2 4.46Å; W106-L109 HydrophobicContact CZ3-CD2 3.81Å; W106-L109 PolarHBondContact O-N 3.29Å; W106-W110 AromaticContact CD1-CD1 3.71Å; W106-W110 AromaticContact CE2-CD1 3.61Å; W106-W110 AromaticContact CE2-NE1 3.22Å; W106-W110 AromaticContact CZ2-NE1 3.31Å; W106-W110 VanDerWaalsContact CZ2-NE1 3.31Å; W106-W110 AromaticContact NE1-CD1 3.34Å; W106-W110 VanDerWaalsContact NE1-CD1 3.34Å; W106-W110 AromaticContact NE1-NE1 3.15Å; W106-W110 VanDerWaalsContact NE1-NE1 3.15Å; W106-W110 PolarHBondContact O-N 2.92Å; W106-W110 VanDerWaalsContact O-N 3.11Å
107	A	95.9	Very high	95.9	Very high	15 Å²	15	50.5 Å²	50.5	12%	0.124	26%	0.256	C	S	.	.	H	α-helix	trans	-61	-49.1	175.2	0	0	0	0	0	110.4	Y103 L104 L109 W110 E111 W148	Y103-A107 WeakPolarHBondContact O-CB 3.31Å; Y103-A107 PolarHBondContact O-N 3.3Å; L104-A107 PolarHBondContact O-N 3.17Å; A107-L109 VanDerWaalsContact C-N 3.32Å; A107-L109 PolarHBondContact O-N 3.44Å; A107-W110 PolarHBondContact O-N 3.28Å; A107-E111 VanDerWaalsContact O-CB 3.32Å; A107-E111 WeakPolarHBondContact O-CB 3.35Å; A107-E111 PolarHBondContact O-N 3.39Å; A107-W148 HydrophobicContact CB-CD2 4.25Å; A107-W148 HydrophobicContact CB-CE3 4.1Å; A107-W148 HydrophobicContact CB-CG 4.47Å
108	Y	95.9	Very high	96	Very high	21 Å²	21	43.5 Å²	43.5	8%	0.082	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-37.6	176.6	-79.7	-39.3	0	0	0	113.7	L104 W110 E111 F112 I140 T141 L142 A145 W148	L104-Y108 HydrophobicContact CD1-CD2 3.9Å; L104-Y108 HydrophobicContact CD1-CE2 3.52Å; L104-Y108 HydrophobicContact CG-CD2 4.25Å; L104-Y108 HydrophobicContact CG-CE2 4.12Å; L104-Y108 PolarHBondContact O-N 3.23Å; Y108-W110 VanDerWaalsContact C-N 3.34Å; Y108-W110 PolarHBondContact O-N 3.27Å; Y108-E111 WeakPolarHBondContact CD1-OE2 3.32Å; Y108-F112 WeakPolarHBondContact O-CB 3.36Å; Y108-F112 PolarHBondContact O-N 2.97Å; Y108-I140 HydrophobicContact CD1-CB 3.86Å; Y108-I140 HydrophobicContact CD1-CD1 4.46Å; Y108-I140 HydrophobicContact CD1-CG2 3.87Å; Y108-I140 HydrophobicContact CE1-CB 4.13Å; Y108-T141 WeakPolarHBondContact CE1-O 3.41Å; Y108-T141 PolarHBondContact OH-O 3.06Å; Y108-L142 WeakPolarHBondContact OH-CA 3.21Å; Y108-A145 HydrophobicContact CE2-CB 4.23Å; Y108-A145 VanDerWaalsContact OH-CA 3.26Å; Y108-A145 WeakPolarHBondContact OH-CA 3.39Å; Y108-A145 WeakPolarHBondContact OH-CB 3.32Å; Y108-A145 PolarHBondContact OH-N 2.85Å; Y108-W148 AromaticContact CE1-CD1 3.65Å; Y108-W148 AromaticContact CE1-NE1 3.97Å
109	L	96.7	Very high	95.9	Very high	86 Å²	86	45.8 Å²	45.8	45%	0.45	23%	0.226	S	C	.	.	H	α-helix	trans	-60.1	-47.2	175.7	177.7	64.1	0	0	0	110.9	L105 W106 A107 S113	L105-L109 WeakPolarHBondContact O-CB 3.45Å; L105-L109 PolarHBondContact O-N 3.36Å; W106-L109 HydrophobicContact CE3-CD2 4Å; W106-L109 HydrophobicContact CH2-CD2 4.46Å; W106-L109 HydrophobicContact CZ3-CD2 3.81Å; W106-L109 PolarHBondContact O-N 3.29Å; A107-L109 VanDerWaalsContact C-N 3.32Å; A107-L109 PolarHBondContact O-N 3.44Å; L109-S113 WeakPolarHBondContact O-CB 3.4Å; L109-S113 PolarHBondContact O-N 3.06Å; L109-S113 PolarHBondContact O-OG 3.29Å
110	W	96.1	Very high	95.9	Very high	61 Å²	61	51.2 Å²	51.2	23%	0.231	26%	0.256	C	S	.	.	H	α-helix	trans	-69	-44.2	179	-85.4	100.9	0	0	0	112.4	L78 T79 T82 W106 A107 Y108 S113 T114	L78-W110 HydrophobicContact CB-CH2 4.18Å; L78-W110 HydrophobicContact CB-CZ3 4.21Å; L78-W110 HydrophobicContact CD1-CH2 4.48Å; L78-W110 HydrophobicContact CD1-CZ3 4.27Å; T79-W110 HydrophobicContact CG2-CB 4.1Å; T79-W110 HydrophobicContact CG2-CG 4.07Å; T79-W110 WeakPolarHBondContact OG1-CB 3.45Å; T79-W110 VanDerWaalsContact OG1-CG 3.25Å; T82-W110 HydrophobicContact CG2-CZ2 4.03Å; T82-W110 PolarHBondContact OG1-NE1 3.44Å; W106-W110 AromaticContact CD1-CD1 3.71Å; W106-W110 AromaticContact CE2-CD1 3.61Å; W106-W110 AromaticContact CE2-NE1 3.22Å; W106-W110 AromaticContact CZ2-NE1 3.31Å; W106-W110 VanDerWaalsContact CZ2-NE1 3.31Å; W106-W110 AromaticContact NE1-CD1 3.34Å; W106-W110 VanDerWaalsContact NE1-CD1 3.34Å; W106-W110 AromaticContact NE1-NE1 3.15Å; W106-W110 VanDerWaalsContact NE1-NE1 3.15Å; W106-W110 PolarHBondContact O-N 2.92Å; W106-W110 VanDerWaalsContact O-N 3.11Å; A107-W110 PolarHBondContact O-N 3.28Å; Y108-W110 VanDerWaalsContact C-N 3.34Å; Y108-W110 PolarHBondContact O-N 3.27Å; W110-S113 PolarHBondContact O-N 3.46Å; W110-T114 HydrophobicContact CE3-CG2 3.81Å; W110-T114 HydrophobicContact CZ3-CG2 4.28Å; W110-T114 VanDerWaalsContact O-CB 3.28Å; W110-T114 WeakPolarHBondContact O-CB 3.46Å; W110-T114 VanDerWaalsContact O-CG2 3.26Å; W110-T114 WeakPolarHBondContact O-CG2 3.26Å; W110-T114 PolarHBondContact O-N 3.35Å; W110-T114 PolarHBondContact O-OG1 2.99Å
111	E	95.4	Very high	95.8	Very high	13 Å²	13	58.5 Å²	58.5	6%	0.061	29%	0.288	C	S	.	.	H	α-helix	trans	-57.8	-52.3	176.4	-172.4	177	-158.6	0	0	110.5	A107 Y108 S113 T114 G115 W126 Y128 I140 W148	A107-E111 VanDerWaalsContact O-CB 3.32Å; A107-E111 WeakPolarHBondContact O-CB 3.35Å; A107-E111 PolarHBondContact O-N 3.39Å; Y108-E111 WeakPolarHBondContact CD1-OE2 3.32Å; E111-S113 PolarHBondContact O-N 3.24Å; E111-T114 PolarHBondContact O-OG1 3.04Å; E111-G115 WeakPolarHBondContact O-CA 3.29Å; E111-G115 PolarHBondContact O-N 3.27Å; E111-W126 HydrophobicContact CG-CZ2 4.03Å; E111-W126 WeakPolarHBondContact O-CZ2 3.47Å; E111-Y128 PolarHBondContact OE1-OH 2.89Å; E111-I140 HydrophobicContact CB-CG2 4.1Å; E111-I140 HydrophobicContact CG-CG2 3.97Å; E111-W148 PolarHBondContact OE2-NE1 2.91Å; E111-W148 VanDerWaalsContact OE2-NE1 3.17Å
112	F	96.4	Very high	95.5	Very high	47 Å²	47	61.7 Å²	61.7	21%	0.206	31%	0.305	C	S	.	.	H	α-helix	trans	-61.6	-48.4	178.3	-176.8	-103.9	0	0	0	112.6	Y108 G115 L116 F136 M137 L139 I140	Y108-F112 WeakPolarHBondContact O-CB 3.36Å; Y108-F112 PolarHBondContact O-N 2.97Å; F112-G115 PolarHBondContact O-N 2.84Å; F112-L116 HydrophobicContact CD1-CD1 3.84Å; F112-L116 HydrophobicContact CE1-CD1 3.23Å; F112-L116 HydrophobicContact CE1-CG 4.36Å; F112-L116 HydrophobicContact CE2-CD1 4.18Å; F112-L116 HydrophobicContact CZ-CD1 3.43Å; F112-L116 VanDerWaalsContact CZ-CD1 3.43Å; F112-L116 HydrophobicContact CZ-CG 4.25Å; F112-L116 WeakPolarHBondContact O-CB 3.33Å; F112-L116 PolarHBondContact O-N 2.93Å; F112-F136 HydrophobicContact CD2-CD1 4.15Å; F112-F136 HydrophobicContact CD2-CE1 4.48Å; F112-F136 AromaticContact CE2-CD1 3.59Å; F112-F136 HydrophobicContact CE2-CD1 3.59Å; F112-F136 AromaticContact CE2-CE1 3.61Å; F112-F136 HydrophobicContact CE2-CE1 3.61Å; F112-F136 HydrophobicContact CZ-CD1 4.26Å; F112-F136 AromaticContact CZ-CE1 3.8Å; F112-F136 HydrophobicContact CZ-CE1 3.8Å; F112-M137 HydrophobicContact CE2-CG 4.48Å; F112-M137 HydrophobicContact CE2-SD 3.83Å; F112-M137 HydrophobicContact CZ-SD 3.83Å; F112-L139 HydrophobicContact CD2-CB 4.01Å; F112-L139 HydrophobicContact CD2-CD1 4.11Å; F112-L139 HydrophobicContact CE2-CB 4.47Å; F112-L139 HydrophobicContact CE2-CD1 4.05Å; F112-I140 HydrophobicContact CB-CG2 3.8Å; F112-I140 HydrophobicContact CD2-CG1 4.49Å; F112-I140 HydrophobicContact CD2-CG2 4.47Å
113	S	96.5	Very high	95.3	Very high	54 Å²	54	62.2 Å²	62.2	38%	0.378	31%	0.31	S	S	.	.	H	α-helix	trans	-66	-42.8	-176.2	-56.2	0	0	0	0	111.9	L109 W110 E111 L117	L109-S113 WeakPolarHBondContact O-CB 3.4Å; L109-S113 PolarHBondContact O-N 3.06Å; L109-S113 PolarHBondContact O-OG 3.29Å; W110-S113 PolarHBondContact O-N 3.46Å; E111-S113 PolarHBondContact O-N 3.24Å; S113-L117 WeakPolarHBondContact O-CB 3.29Å; S113-L117 PolarHBondContact O-N 3.22Å
114	T	96	Very high	95.1	Very high	18 Å²	18	62.7 Å²	62.7	11%	0.11	32%	0.316	C	S	.	.	H	α-helix	trans	-74.6	-36.4	179.3	58.7	0	0	0	0	111.6	I75 W110 E111 L117 L118	I75-T114 HydrophobicContact CG1-CG2 4.01Å; I75-T114 HydrophobicContact CG2-CG2 4.47Å; W110-T114 HydrophobicContact CE3-CG2 3.81Å; W110-T114 HydrophobicContact CZ3-CG2 4.28Å; W110-T114 VanDerWaalsContact O-CB 3.28Å; W110-T114 WeakPolarHBondContact O-CB 3.46Å; W110-T114 VanDerWaalsContact O-CG2 3.26Å; W110-T114 WeakPolarHBondContact O-CG2 3.26Å; W110-T114 PolarHBondContact O-N 3.35Å; W110-T114 PolarHBondContact O-OG1 2.99Å; E111-T114 PolarHBondContact O-OG1 3.04Å; T114-L117 PolarHBondContact O-N 3.39Å; T114-L118 WeakPolarHBondContact O-CB 3.22Å; T114-L118 VanDerWaalsContact O-CG 3.26Å; T114-L118 WeakPolarHBondContact O-CG 3.3Å; T114-L118 PolarHBondContact O-N 2.88Å
115	G	95	Very high	94.7	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-59.3	-47	171.6	0	0	0	0	0	111.8	E111 F112 L118 R119	E111-G115 WeakPolarHBondContact O-CA 3.29Å; E111-G115 PolarHBondContact O-N 3.27Å; F112-G115 PolarHBondContact O-N 2.84Å; G115-L118 PolarHBondContact O-N 3.03Å; G115-R119 WeakPolarHBondContact O-CB 3.07Å; G115-R119 PolarHBondContact O-N 3.17Å
116	L	95.3	Very high	94.5	Very high	62 Å²	62	62.2 Å²	62.2	33%	0.325	31%	0.314	S	S	.	.	H	α-helix	trans	-57.2	-51.8	172.9	-96.6	167.1	0	0	0	111.5	F112 L118 R119 L120 M137 L139	F112-L116 HydrophobicContact CD1-CD1 3.84Å; F112-L116 HydrophobicContact CE1-CD1 3.23Å; F112-L116 HydrophobicContact CE1-CG 4.36Å; F112-L116 HydrophobicContact CE2-CD1 4.18Å; F112-L116 HydrophobicContact CZ-CD1 3.43Å; F112-L116 VanDerWaalsContact CZ-CD1 3.43Å; F112-L116 HydrophobicContact CZ-CG 4.25Å; F112-L116 WeakPolarHBondContact O-CB 3.33Å; F112-L116 PolarHBondContact O-N 2.93Å; L116-L118 PolarHBondContact O-N 2.99Å; L116-R119 WeakPolarHBondContact O-CB 3.29Å; L116-R119 PolarHBondContact O-N 3.29Å; L116-L120 WeakPolarHBondContact O-CG 3.28Å; L116-L120 PolarHBondContact O-N 2.88Å; L116-L120 VanDerWaalsContact O-N 3.17Å; L116-M137 HydrophobicContact CD2-CE 4.37Å; L116-L139 HydrophobicContact CB-CD1 4.29Å; L116-L139 HydrophobicContact CD2-CD1 4.23Å; L116-L139 HydrophobicContact CG-CD1 3.65Å
117	L	95.8	Very high	94.3	Very high	95 Å²	95	62.2 Å²	62.2	50%	0.497	32%	0.32	S	S	.	.	H	α-helix	trans	-59.7	-46.2	-178.4	-179.4	62.9	0	0	0	111.8	S113 T114 R119 L120 F121	S113-L117 WeakPolarHBondContact O-CB 3.29Å; S113-L117 PolarHBondContact O-N 3.22Å; T114-L117 PolarHBondContact O-N 3.39Å; L117-R119 VanDerWaalsContact C-N 3.34Å; L117-L120 WeakPolarHBondContact O-CB 3.34Å; L117-L120 PolarHBondContact O-N 2.75Å; L117-F121 HydrophobicContact CD1-CE2 3.94Å; L117-F121 HydrophobicContact CG-CE2 4.41Å; L117-F121 WeakPolarHBondContact O-CD2 3.39Å
118	L	94.8	Very high	94.1	Very high	13 Å²	13	62.9 Å²	62.9	7%	0.068	32%	0.319	C	S	.	.	H	α-helix	trans	-68.6	-34.1	179.2	-70.4	173.2	0	0	0	111.8	W71 I75 T114 G115 L116 L120 F121 N122 A123 C124 W126	W71-L118 HydrophobicContact CB-CD1 4Å; W71-L118 HydrophobicContact CD2-CD2 3.74Å; W71-L118 HydrophobicContact CE3-CD2 4.1Å; W71-L118 HydrophobicContact CG-CD1 4.13Å; W71-L118 HydrophobicContact CG-CD2 3.98Å; W71-L118 HydrophobicContact CZ2-CD2 4.36Å; I75-L118 HydrophobicContact CD1-CD1 4.08Å; T114-L118 WeakPolarHBondContact O-CB 3.22Å; T114-L118 VanDerWaalsContact O-CG 3.26Å; T114-L118 WeakPolarHBondContact O-CG 3.3Å; T114-L118 PolarHBondContact O-N 2.88Å; G115-L118 PolarHBondContact O-N 3.03Å; L116-L118 PolarHBondContact O-N 2.99Å; L118-L120 VanDerWaalsContact C-N 3.27Å; L118-L120 PolarHBondContact O-N 3.11Å; L118-F121 CarbonylContact O-C 3.53Å; L118-F121 PolarHBondContact O-N 2.77Å; L118-N122 PolarHBondContact O-N 2.83Å; L118-A123 HydrophobicContact CD2-CB 4.2Å; L118-A123 PolarHBondContact O-N 3.27Å; L118-C124 HydrophobicContact CB-CB 4.11Å; L118-W126 HydrophobicContact CD1-CH2 4.48Å
119	R	93.8	Very high	93.8	Very high	122 Å²	122	64.7 Å²	64.7	46%	0.46	33%	0.333	S	S	.	.	H	α-helix	trans	-62.1	-34.5	175.4	-169.6	175.1	-171.9	166.7	6.8	111.9	G115 L116 L117 F121 N122 C124 M137	G115-R119 WeakPolarHBondContact O-CB 3.07Å; G115-R119 PolarHBondContact O-N 3.17Å; L116-R119 WeakPolarHBondContact O-CB 3.29Å; L116-R119 PolarHBondContact O-N 3.29Å; L117-R119 VanDerWaalsContact C-N 3.34Å; R119-F121 PolarHBondContact O-N 2.83Å; R119-N122 PolarHBondContact O-N 2.9Å; R119-C124 HydrophobicContact CB-CB 4.21Å; R119-M137 PolarHBondContact NH1-O 3.36Å
120	L	93.8	Very high	93.5	Very high	137 Å²	137	68.4 Å²	68.4	72%	0.717	35%	0.347	S	S	*	.	H	α-helix	trans	-59.5	-30.4	173.9	-63	174.5	0	0	0	112.8	L116 L117 L118	L116-L120 WeakPolarHBondContact O-CG 3.28Å; L116-L120 PolarHBondContact O-N 2.88Å; L116-L120 VanDerWaalsContact O-N 3.17Å; L117-L120 WeakPolarHBondContact O-CB 3.34Å; L117-L120 PolarHBondContact O-N 2.75Å; L118-L120 VanDerWaalsContact C-N 3.27Å; L118-L120 PolarHBondContact O-N 3.11Å
121	F	94.3	Very high	93	Very high	152 Å²	152	70.9 Å²	70.9	67%	0.667	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	10.5	177.5	-58.9	-72.9	0	0	0	113.2	L117 L118 R119 A123	L117-F121 HydrophobicContact CD1-CE2 3.94Å; L117-F121 HydrophobicContact CG-CE2 4.41Å; L117-F121 WeakPolarHBondContact O-CD2 3.39Å; L118-F121 CarbonylContact O-C 3.53Å; L118-F121 PolarHBondContact O-N 2.77Å; R119-F121 PolarHBondContact O-N 2.83Å; F121-A123 HydrophobicContact CB-CB 4.33Å; F121-A123 PolarHBondContact O-N 2.98Å
122	N	91.9	Very high	92.7	Very high	158 Å²	158	71.5 Å²	71.5	85%	0.845	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	34.8	-173.2	-160.7	35.9	0	0	0	113.5	L118 R119	L118-N122 PolarHBondContact O-N 2.83Å; R119-N122 PolarHBondContact O-N 2.9Å
123	A	91.9	Very high	92.2	Very high	32 Å²	32	80.7 Å²	80.7	26%	0.264	40%	0.399	S	S	.	.			trans	-117.5	8.1	-174.7	0	0	0	0	0	113.1	L118 F121 P125	L118-A123 HydrophobicContact CD2-CB 4.2Å; L118-A123 PolarHBondContact O-N 3.27Å; F121-A123 HydrophobicContact CB-CB 4.33Å; F121-A123 PolarHBondContact O-N 2.98Å; A123-P125 VanDerWaalsContact O-CD 3.3Å; A123-P125 WeakPolarHBondContact O-CD 3.2Å
124	C	91.6	Very high	91.7	Very high	33 Å²	33	79.3 Å²	79.3	22%	0.223	39%	0.393	C	S	.	.			trans	-69.1	116.8	179.2	-167.8	0	0	0	0	109.4	L118 R119 W126	L118-C124 HydrophobicContact CB-CB 4.11Å; R119-C124 HydrophobicContact CB-CB 4.21Å; C124-W126 VanDerWaalsContact C-N 3.32Å; C124-W126 PolarHBondContact O-N 3.45Å; C124-W126 PolarHBondContact SG-O 3.31Å
125	P	88.6	Confident	91.6	Very high	66 Å²	66	80.5 Å²	80.5	43%	0.429	40%	0.399	S	S	.	.			trans	-84.7	-5.7	-172.7	28	-24.4	0	0	0	113.8	A123	A123-P125 VanDerWaalsContact O-CD 3.3Å; A123-P125 WeakPolarHBondContact O-CD 3.2Å
126	W	91.4	Very high	91.4	Very high	49 Å²	49	86.3 Å²	86.3	19%	0.186	42%	0.424	C	S	.	.			trans	-125.9	152.4	175.1	66.8	92.2	0	0	0	111.2	I75 E111 L118 C124 Y128 L139	I75-W126 HydrophobicContact CD1-CH2 3.66Å; I75-W126 HydrophobicContact CD1-CZ3 3.71Å; E111-W126 HydrophobicContact CG-CZ2 4.03Å; E111-W126 WeakPolarHBondContact O-CZ2 3.47Å; L118-W126 HydrophobicContact CD1-CH2 4.48Å; C124-W126 VanDerWaalsContact C-N 3.32Å; C124-W126 PolarHBondContact O-N 3.45Å; C124-W126 PolarHBondContact SG-O 3.31Å; W126-Y128 HydrophobicContact CB-CE1 4.47Å; W126-Y128 AromaticContact CD1-CD2 3.96Å; W126-Y128 AromaticContact CD1-CE2 3.46Å; W126-Y128 VanDerWaalsContact CD1-CE2 3.46Å; W126-Y128 AromaticContact CD1-CZ 3.75Å; W126-Y128 HydrophobicContact CG-CE2 4.31Å; W126-Y128 AromaticContact NE1-CE2 3.97Å; W126-L139 PolarHBondContact NE1-O 3.43Å
127	D	92.4	Very high	91.2	Very high	73 Å²	73	87.9 Å²	87.9	39%	0.39	43%	0.431	S	S	.	.			trans	-148	128.1	168	-170.3	-14.8	0	0	0	106.7	T129	D127-T129 WeakPolarHBondContact OD1-CB 3.33Å; D127-T129 PolarHBondContact OD1-N 2.98Å; D127-T129 PolarHBondContact OD1-OG1 2.82Å
128	Y	91.9	Very high	91	Very high	29 Å²	29	83.3 Å²	83.3	11%	0.114	41%	0.408	C	S	.	.			trans	-105.6	5.1	-178.6	-61.6	-46.6	0	0	0	112.9	E111 W126 H130 E131 F132 G138 T141 Y144	E111-Y128 PolarHBondContact OE1-OH 2.89Å; W126-Y128 HydrophobicContact CB-CE1 4.47Å; W126-Y128 AromaticContact CD1-CD2 3.96Å; W126-Y128 AromaticContact CD1-CE2 3.46Å; W126-Y128 VanDerWaalsContact CD1-CE2 3.46Å; W126-Y128 AromaticContact CD1-CZ 3.75Å; W126-Y128 HydrophobicContact CG-CE2 4.31Å; W126-Y128 AromaticContact NE1-CE2 3.97Å; Y128-H130 PolarHBondContact O-N 2.91Å; Y128-E131 VanDerWaalsContact CA-OE2 3.25Å; Y128-E131 WeakPolarHBondContact CA-OE2 3.26Å; Y128-F132 HydrophobicContact CD1-CD2 4.08Å; Y128-F132 HydrophobicContact CD1-CE2 4.04Å; Y128-F132 HydrophobicContact CG-CD2 4.33Å; Y128-F132 PolarHBondContact O-N 3.34Å; Y128-G138 PolarHBondContact N-O 3.49Å; Y128-T141 HydrophobicContact CD1-CG2 4.4Å; Y128-T141 HydrophobicContact CD2-CG2 3.96Å; Y128-T141 HydrophobicContact CE2-CG2 4.14Å; Y128-T141 HydrophobicContact CG-CG2 4.1Å; Y128-Y144 AromaticContact CE1-CE2 3.82Å; Y128-Y144 HydrophobicContact CE1-CE2 3.82Å; Y128-Y144 AromaticContact CZ-CE2 3.99Å
129	T	91.3	Very high	90.9	Very high	59 Å²	59	82.9 Å²	82.9	36%	0.362	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-32	-172.4	-58.4	0	0	0	0	112.7	D127 G138	D127-T129 WeakPolarHBondContact OD1-CB 3.33Å; D127-T129 PolarHBondContact OD1-N 2.98Å; D127-T129 PolarHBondContact OD1-OG1 2.82Å; T129-G138 VanDerWaalsContact OG1-CA 3.3Å; T129-G138 WeakPolarHBondContact OG1-CA 3.26Å
130	H	89.5	Confident	91	Very high	164 Å²	164	78.3 Å²	78.3	76%	0.759	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-14.9	-172.4	-62.3	-55.7	0	0	0	113.4	Y128	Y128-H130 PolarHBondContact O-N 2.91Å
131	E	85.4	Confident	91	Very high	112 Å²	112	71.8 Å²	71.8	52%	0.523	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-32.2	-174.5	-63.6	75.4	-169.3	0	0	112.3	Y128	Y128-E131 VanDerWaalsContact CA-OE2 3.25Å; Y128-E131 WeakPolarHBondContact CA-OE2 3.26Å
132	F	88.7	Confident	91	Very high	26 Å²	26	70.2 Å²	70.2	11%	0.114	35%	0.353	C	S	.	.			trans	-136.4	138	-169.8	-59.5	-68.7	0	0	0	112.4	W54 Y128 N135 T141 E143 Y144	W54-F132 HydrophobicContact CH2-CE1 4.06Å; W54-F132 AromaticContact CH2-CZ 3.91Å; W54-F132 HydrophobicContact CH2-CZ 3.91Å; W54-F132 AromaticContact CZ2-CE1 3.94Å; W54-F132 HydrophobicContact CZ2-CE1 3.94Å; W54-F132 AromaticContact CZ2-CZ 3.49Å; W54-F132 HydrophobicContact CZ2-CZ 3.49Å; W54-F132 VanDerWaalsContact CZ2-CZ 3.49Å; Y128-F132 HydrophobicContact CD1-CD2 4.08Å; Y128-F132 HydrophobicContact CD1-CE2 4.04Å; Y128-F132 HydrophobicContact CG-CD2 4.33Å; Y128-F132 PolarHBondContact O-N 3.34Å; F132-N135 PolarHBondContact O-ND2 2.93Å; F132-T141 WeakPolarHBondContact CB-OG1 3.3Å; F132-T141 HydrophobicContact CD2-CG2 4Å; F132-T141 HydrophobicContact CE2-CG2 4.25Å; F132-T141 WeakPolarHBondContact CG-OG1 3.43Å; F132-E143 HydrophobicContact CD1-CB 3.96Å; F132-E143 HydrophobicContact CD1-CG 3.97Å; F132-E143 HydrophobicContact CE1-CB 4.3Å; F132-Y144 HydrophobicContact CE1-CE1 4.1Å; F132-Y144 AromaticContact CE2-CE1 3.88Å; F132-Y144 HydrophobicContact CE2-CE1 3.88Å; F132-Y144 HydrophobicContact CE2-CE2 4.24Å; F132-Y144 AromaticContact CE2-CZ 3.6Å; F132-Y144 WeakPolarHBondContact CE2-OH 3.19Å; F132-Y144 HydrophobicContact CZ-CD1 4.35Å; F132-Y144 AromaticContact CZ-CE1 3.39Å; F132-Y144 HydrophobicContact CZ-CE1 3.39Å; F132-Y144 AromaticContact CZ-CZ 3.49Å; F132-Y144 VanDerWaalsContact CZ-CZ 3.49Å; F132-Y144 VanDerWaalsContact CZ-OH 3.31Å; F132-Y144 WeakPolarHBondContact CZ-OH 3.25Å
133	Y	86	Confident	91	Very high	240 Å²	240	66.4 Å²	66.4	94%	0.941	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-32.9	177.6	-70	-83.5	0	0	0	112	N135 E143	Y133-N135 PolarHBondContact O-N 3.15Å; Y133-E143 PolarHBondContact N-OE1 3.49Å
134	G	87	Confident	91.1	Very high	26 Å²	26	65.5 Å²	65.5	27%	0.268	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	22.9	178	0	0	0	0	0	114.3	L142 E143	G134-L142 PolarHBondContact O-N 3.21Å; G134-E143 WeakPolarHBondContact CA-OE1 3.47Å; G134-E143 VanDerWaalsContact CA-OE2 3.32Å; G134-E143 WeakPolarHBondContact CA-OE2 3.23Å; G134-E143 PolarHBondContact N-OE1 3.03Å
135	N	93.6	Very high	91.3	Very high	43 Å²	43	65 Å²	65	23%	0.23	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	151.1	176.3	84.7	80.5	0	0	0	111.8	F132 Y133 G138 I140	F132-N135 PolarHBondContact O-ND2 2.93Å; Y133-N135 PolarHBondContact O-N 3.15Å; N135-G138 WeakPolarHBondContact OD1-CA 3.49Å; N135-G138 PolarHBondContact OD1-N 2.84Å; N135-I140 CarbonylContact C-O 3.6Å; N135-I140 VanDerWaalsContact CA-O 3.29Å; N135-I140 WeakPolarHBondContact CA-O 3.27Å
136	F	91.5	Very high	91.6	Very high	121 Å²	121	66.2 Å²	66.2	53%	0.531	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	113.1	171.1	-174	-104.4	0	0	0	109.7	F112 G138 L139 I140	F112-F136 HydrophobicContact CD2-CD1 4.15Å; F112-F136 HydrophobicContact CD2-CE1 4.48Å; F112-F136 AromaticContact CE2-CD1 3.59Å; F112-F136 HydrophobicContact CE2-CD1 3.59Å; F112-F136 AromaticContact CE2-CE1 3.61Å; F112-F136 HydrophobicContact CE2-CE1 3.61Å; F112-F136 HydrophobicContact CZ-CD1 4.26Å; F112-F136 AromaticContact CZ-CE1 3.8Å; F112-F136 HydrophobicContact CZ-CE1 3.8Å; F136-G138 PolarHBondContact O-N 2.87Å; F136-G138 VanDerWaalsContact O-N 3.11Å; F136-L139 PolarHBondContact O-N 3.38Å; F136-I140 HydrophobicContact CB-CD1 4.25Å; F136-I140 HydrophobicContact CB-CG1 3.77Å; F136-I140 HydrophobicContact CD1-CD1 4.46Å; F136-I140 HydrophobicContact CD1-CG1 4.47Å; F136-I140 PolarHBondContact N-O 2.85Å; F136-I140 PolarHBondContact O-N 3.44Å
137	M	91	Very high	91.8	Very high	95 Å²	95	66.9 Å²	66.9	47%	0.468	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	16.5	-175.2	-58.1	-178	64.9	0	0	115	F112 L116 R119 L139	F112-M137 HydrophobicContact CE2-CG 4.48Å; F112-M137 HydrophobicContact CE2-SD 3.83Å; F112-M137 HydrophobicContact CZ-SD 3.83Å; L116-M137 HydrophobicContact CD2-CE 4.37Å; R119-M137 PolarHBondContact NH1-O 3.36Å; M137-L139 HydrophobicContact CB-CD1 4.46Å; M137-L139 HydrophobicContact CB-CG 4.39Å; M137-L139 PolarHBondContact O-N 3.38Å
138	G	90.9	Very high	91.9	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	2.8	-169.5	0	0	0	0	0	114.5	Y128 T129 N135 F136	Y128-G138 PolarHBondContact N-O 3.49Å; T129-G138 VanDerWaalsContact OG1-CA 3.3Å; T129-G138 WeakPolarHBondContact OG1-CA 3.26Å; N135-G138 WeakPolarHBondContact OD1-CA 3.49Å; N135-G138 PolarHBondContact OD1-N 2.84Å; F136-G138 PolarHBondContact O-N 2.87Å; F136-G138 VanDerWaalsContact O-N 3.11Å
139	L	93.7	Very high	92.1	Very high	3 Å²	3	67 Å²	67	2%	0.016	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-33.3	-170.9	-67	179.8	0	0	0	113.8	F112 L116 W126 F136 M137	F112-L139 HydrophobicContact CD2-CB 4.01Å; F112-L139 HydrophobicContact CD2-CD1 4.11Å; F112-L139 HydrophobicContact CE2-CB 4.47Å; F112-L139 HydrophobicContact CE2-CD1 4.05Å; L116-L139 HydrophobicContact CB-CD1 4.29Å; L116-L139 HydrophobicContact CD2-CD1 4.23Å; L116-L139 HydrophobicContact CG-CD1 3.65Å; W126-L139 PolarHBondContact NE1-O 3.43Å; F136-L139 PolarHBondContact O-N 3.38Å; M137-L139 HydrophobicContact CB-CD1 4.46Å; M137-L139 HydrophobicContact CB-CG 4.39Å; M137-L139 PolarHBondContact O-N 3.38Å
140	I	94	Very high	92.4	Very high	27 Å²	27	66.2 Å²	66.2	14%	0.138	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.4	172.5	61.1	173.5	0	0	0	108.8	Y108 E111 F112 N135 F136	Y108-I140 HydrophobicContact CD1-CB 3.86Å; Y108-I140 HydrophobicContact CD1-CD1 4.46Å; Y108-I140 HydrophobicContact CD1-CG2 3.87Å; Y108-I140 HydrophobicContact CE1-CB 4.13Å; E111-I140 HydrophobicContact CB-CG2 4.1Å; E111-I140 HydrophobicContact CG-CG2 3.97Å; F112-I140 HydrophobicContact CB-CG2 3.8Å; F112-I140 HydrophobicContact CD2-CG1 4.49Å; F112-I140 HydrophobicContact CD2-CG2 4.47Å; N135-I140 CarbonylContact C-O 3.6Å; N135-I140 VanDerWaalsContact CA-O 3.29Å; N135-I140 WeakPolarHBondContact CA-O 3.27Å; F136-I140 HydrophobicContact CB-CD1 4.25Å; F136-I140 HydrophobicContact CB-CG1 3.77Å; F136-I140 HydrophobicContact CD1-CD1 4.46Å; F136-I140 HydrophobicContact CD1-CG1 4.47Å; F136-I140 PolarHBondContact N-O 2.85Å; F136-I140 PolarHBondContact O-N 3.44Å
141	T	94.2	Very high	92.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	129	178	-179.5	0	0	0	0	110.1	Y108 Y128 F132 E143 Y144	Y108-T141 WeakPolarHBondContact CE1-O 3.41Å; Y108-T141 PolarHBondContact OH-O 3.06Å; Y128-T141 HydrophobicContact CD1-CG2 4.4Å; Y128-T141 HydrophobicContact CD2-CG2 3.96Å; Y128-T141 HydrophobicContact CE2-CG2 4.14Å; Y128-T141 HydrophobicContact CG-CG2 4.1Å; F132-T141 WeakPolarHBondContact CB-OG1 3.3Å; F132-T141 HydrophobicContact CD2-CG2 4Å; F132-T141 HydrophobicContact CE2-CG2 4.25Å; F132-T141 WeakPolarHBondContact CG-OG1 3.43Å; T141-E143 PolarHBondContact O-N 2.96Å; T141-E143 PolarHBondContact OG1-OE2 3.24Å; T141-Y144 HydrophobicContact CG2-CD1 4.05Å; T141-Y144 HydrophobicContact CG2-CD2 3.43Å; T141-Y144 VanDerWaalsContact CG2-CD2 3.43Å; T141-Y144 HydrophobicContact CG2-CE2 3.96Å; T141-Y144 HydrophobicContact CG2-CG 3.48Å; T141-Y144 VanDerWaalsContact CG2-CG 3.48Å; T141-Y144 PolarHBondContact O-N 3.39Å
142	L	93.8	Very high	93.1	Very high	118 Å²	118	54.7 Å²	54.7	62%	0.618	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-68.2	-23.8	-178.9	-67.7	179.7	0	0	0	111.9	Y108 G134 Y144 A145	Y108-L142 WeakPolarHBondContact OH-CA 3.21Å; G134-L142 PolarHBondContact O-N 3.21Å; L142-Y144 PolarHBondContact O-N 3.32Å; L142-A145 WeakPolarHBondContact O-CB 3.44Å; L142-A145 PolarHBondContact O-N 3.27Å
143	E	93.4	Very high	93.5	Very high	79 Å²	79	54.8 Å²	54.8	37%	0.369	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-61.5	-26.7	177.1	-70.7	86	150.7	0	0	111.9	F132 Y133 G134 T141 P146	F132-E143 HydrophobicContact CD1-CB 3.96Å; F132-E143 HydrophobicContact CD1-CG 3.97Å; F132-E143 HydrophobicContact CE1-CB 4.3Å; Y133-E143 PolarHBondContact N-OE1 3.49Å; G134-E143 WeakPolarHBondContact CA-OE1 3.47Å; G134-E143 VanDerWaalsContact CA-OE2 3.32Å; G134-E143 WeakPolarHBondContact CA-OE2 3.23Å; G134-E143 PolarHBondContact N-OE1 3.03Å; T141-E143 PolarHBondContact O-N 2.96Å; T141-E143 PolarHBondContact OG1-OE2 3.24Å; E143-P146 WeakPolarHBondContact O-CD 3.31Å
144	Y	93.3	Very high	93.9	Very high	13 Å²	13	47.1 Å²	47.1	5%	0.051	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-88	1	175.6	-70.3	-4.3	0	0	0	114	F50 W54 Y128 F132 T141 L142 P146 V147 W148	F50-Y144 HydrophobicContact CE1-CD2 4.47Å; F50-Y144 AromaticContact CE1-CE2 3.86Å; F50-Y144 HydrophobicContact CE1-CE2 3.86Å; F50-Y144 HydrophobicContact CZ-CD1 4.4Å; F50-Y144 HydrophobicContact CZ-CD2 4.14Å; F50-Y144 AromaticContact CZ-CE1 3.97Å; F50-Y144 HydrophobicContact CZ-CE1 3.97Å; F50-Y144 AromaticContact CZ-CE2 3.68Å; F50-Y144 HydrophobicContact CZ-CE2 3.68Å; F50-Y144 HydrophobicContact CZ-CG 4.48Å; F50-Y144 AromaticContact CZ-CZ 3.59Å; W54-Y144 HydrophobicContact CE3-CE1 4.48Å; W54-Y144 HydrophobicContact CH2-CE1 4Å; W54-Y144 HydrophobicContact CZ2-CE1 4.32Å; W54-Y144 HydrophobicContact CZ3-CE1 4.08Å; Y128-Y144 AromaticContact CE1-CE2 3.82Å; Y128-Y144 HydrophobicContact CE1-CE2 3.82Å; Y128-Y144 AromaticContact CZ-CE2 3.99Å; F132-Y144 HydrophobicContact CE1-CE1 4.1Å; F132-Y144 AromaticContact CE2-CE1 3.88Å; F132-Y144 HydrophobicContact CE2-CE1 3.88Å; F132-Y144 HydrophobicContact CE2-CE2 4.24Å; F132-Y144 AromaticContact CE2-CZ 3.6Å; F132-Y144 WeakPolarHBondContact CE2-OH 3.19Å; F132-Y144 HydrophobicContact CZ-CD1 4.35Å; F132-Y144 AromaticContact CZ-CE1 3.39Å; F132-Y144 HydrophobicContact CZ-CE1 3.39Å; F132-Y144 AromaticContact CZ-CZ 3.49Å; F132-Y144 VanDerWaalsContact CZ-CZ 3.49Å; F132-Y144 VanDerWaalsContact CZ-OH 3.31Å; F132-Y144 WeakPolarHBondContact CZ-OH 3.25Å; T141-Y144 HydrophobicContact CG2-CD1 4.05Å; T141-Y144 HydrophobicContact CG2-CD2 3.43Å; T141-Y144 VanDerWaalsContact CG2-CD2 3.43Å; T141-Y144 HydrophobicContact CG2-CE2 3.96Å; T141-Y144 HydrophobicContact CG2-CG 3.48Å; T141-Y144 VanDerWaalsContact CG2-CG 3.48Å; T141-Y144 PolarHBondContact O-N 3.39Å; L142-Y144 PolarHBondContact O-N 3.32Å; Y144-P146 VanDerWaalsContact C-CD 3.48Å; Y144-V147 WeakPolarHBondContact O-CB 3.2Å; Y144-V147 PolarHBondContact O-N 2.83Å; Y144-W148 PolarHBondContact O-N 2.86Å
145	A	95.3	Very high	94.2	Very high	22 Å²	22	46.2 Å²	46.2	18%	0.182	25%	0.25	C	S	.	.	H	α-helix	trans	-55.8	-42.9	179.8	0	0	0	0	0	113.5	L104 Y108 L142 V147 W148 Y149	L104-A145 HydrophobicContact CD1-CB 4.04Å; L104-A145 WeakPolarHBondContact CD1-O 3.38Å; L104-A145 HydrophobicContact CD2-CB 4.02Å; Y108-A145 HydrophobicContact CE2-CB 4.23Å; Y108-A145 VanDerWaalsContact OH-CA 3.26Å; Y108-A145 WeakPolarHBondContact OH-CA 3.39Å; Y108-A145 WeakPolarHBondContact OH-CB 3.32Å; Y108-A145 PolarHBondContact OH-N 2.85Å; L142-A145 WeakPolarHBondContact O-CB 3.44Å; L142-A145 PolarHBondContact O-N 3.27Å; A145-V147 VanDerWaalsContact C-N 3.31Å; A145-V147 PolarHBondContact O-N 3.18Å; A145-W148 PolarHBondContact O-N 3.06Å; A145-Y149 VanDerWaalsContact O-CB 3.23Å; A145-Y149 WeakPolarHBondContact O-CB 3.1Å; A145-Y149 PolarHBondContact O-N 3.46Å
146	P	95.3	Very high	94.2	Very high	91 Å²	91	44.3 Å²	44.3	59%	0.591	24%	0.24	S	C	*	.	H	α-helix	trans	-62.8	-38	176.4	-22.1	34.7	0	0	0	112.7	E143 Y144 A150	E143-P146 WeakPolarHBondContact O-CD 3.31Å; Y144-P146 VanDerWaalsContact C-CD 3.48Å; P146-A150 WeakPolarHBondContact O-CB 3.28Å; P146-A150 PolarHBondContact O-N 3.02Å
147	V	95	Very high	94.2	Very high	64 Å²	64	41.8 Å²	41.8	39%	0.388	23%	0.231	S	C	.	.	H	α-helix	trans	-67	-49.8	179.5	178.5	0	0	0	0	110	F50 Y144 A145 Y149 A150 A151	F50-V147 HydrophobicContact CD2-CG1 3.98Å; F50-V147 HydrophobicContact CE2-CG1 3.83Å; F50-V147 HydrophobicContact CE2-CG2 4.31Å; Y144-V147 WeakPolarHBondContact O-CB 3.2Å; Y144-V147 PolarHBondContact O-N 2.83Å; A145-V147 VanDerWaalsContact C-N 3.31Å; A145-V147 PolarHBondContact O-N 3.18Å; V147-Y149 VanDerWaalsContact C-N 3.35Å; V147-Y149 PolarHBondContact O-N 3.09Å; V147-A150 PolarHBondContact O-N 2.94Å; V147-A151 VanDerWaalsContact O-CB 3.28Å; V147-A151 WeakPolarHBondContact O-CB 3.34Å; V147-A151 PolarHBondContact O-N 2.93Å
148	W	95.4	Very high	94.2	Very high	44 Å²	44	43.7 Å²	43.7	17%	0.167	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-41.3	178.1	-77	130	0	0	0	112.6	Y76 L104 A107 Y108 E111 Y144 A145 A151 G152	Y76-W148 AromaticContact CE1-CH2 3.67Å; Y76-W148 HydrophobicContact CE1-CH2 3.67Å; Y76-W148 AromaticContact CE1-CZ3 3.98Å; Y76-W148 HydrophobicContact CE1-CZ3 3.98Å; L104-W148 HydrophobicContact CD1-CB 3.45Å; L104-W148 VanDerWaalsContact CD1-CB 3.45Å; L104-W148 HydrophobicContact CD1-CG 4.4Å; A107-W148 HydrophobicContact CB-CD2 4.25Å; A107-W148 HydrophobicContact CB-CE3 4.1Å; A107-W148 HydrophobicContact CB-CG 4.47Å; Y108-W148 AromaticContact CE1-CD1 3.65Å; Y108-W148 AromaticContact CE1-NE1 3.97Å; E111-W148 PolarHBondContact OE2-NE1 2.91Å; E111-W148 VanDerWaalsContact OE2-NE1 3.17Å; Y144-W148 PolarHBondContact O-N 2.86Å; A145-W148 PolarHBondContact O-N 3.06Å; W148-A151 PolarHBondContact O-N 3.3Å; W148-G152 PolarHBondContact O-N 3.36Å
149	Y	96.6	Very high	94.3	Very high	59 Å²	59	44.9 Å²	44.9	23%	0.231	24%	0.243	C	C	.	.	H	α-helix	trans	-60.3	-49	175.2	-179.6	-84.7	0	0	0	111.5	F97 G100 L101 A145 V147 G152 L153	F97-Y149 VanDerWaalsContact CA-OH 3.29Å; F97-Y149 WeakPolarHBondContact CA-OH 3.36Å; F97-Y149 WeakPolarHBondContact CD1-OH 3.3Å; F97-Y149 PolarHBondContact O-OH 3.5Å; G100-Y149 VanDerWaalsContact CA-CE2 3.44Å; G100-Y149 WeakPolarHBondContact O-CD2 3.23Å; L101-Y149 VanDerWaalsContact N-CE2 3.3Å; A145-Y149 VanDerWaalsContact O-CB 3.23Å; A145-Y149 WeakPolarHBondContact O-CB 3.1Å; A145-Y149 PolarHBondContact O-N 3.46Å; V147-Y149 VanDerWaalsContact C-N 3.35Å; V147-Y149 PolarHBondContact O-N 3.09Å; Y149-G152 PolarHBondContact O-N 2.79Å; Y149-L153 HydrophobicContact CD1-CD1 4.03Å; Y149-L153 HydrophobicContact CE1-CD1 3.36Å; Y149-L153 HydrophobicContact CE1-CG 4.2Å; Y149-L153 PolarHBondContact O-N 3.34Å; Y149-L153 VanDerWaalsContact O-N 3.14Å
150	A	96.1	Very high	94	Very high	44 Å²	44	45.1 Å²	45.1	36%	0.364	25%	0.245	S	C	.	.	H	α-helix	trans	-64	-45.7	178.3	0	0	0	0	0	111.7	P146 V147 G152 L153 L154	P146-A150 WeakPolarHBondContact O-CB 3.28Å; P146-A150 PolarHBondContact O-N 3.02Å; V147-A150 PolarHBondContact O-N 2.94Å; A150-G152 VanDerWaalsContact C-N 3.31Å; A150-G152 PolarHBondContact O-N 3.24Å; A150-L153 PolarHBondContact O-N 3.38Å; A150-L154 WeakPolarHBondContact O-CB 3.44Å; A150-L154 VanDerWaalsContact O-CG 3.29Å; A150-L154 WeakPolarHBondContact O-CG 3.22Å; A150-L154 PolarHBondContact O-N 2.59Å
151	A	95.2	Very high	93.7	Very high	19 Å²	19	46.4 Å²	46.4	16%	0.157	25%	0.25	C	C	.	.	H	α-helix	trans	-59.9	-40.6	177.8	0	0	0	0	0	112	M46 V147 W148 L154 T155	M46-A151 HydrophobicContact CE-CB 4.48Å; V147-A151 VanDerWaalsContact O-CB 3.28Å; V147-A151 WeakPolarHBondContact O-CB 3.34Å; V147-A151 PolarHBondContact O-N 2.93Å; W148-A151 PolarHBondContact O-N 3.3Å; A151-L154 PolarHBondContact O-N 3.49Å; A151-T155 VanDerWaalsContact O-CB 3.29Å; A151-T155 WeakPolarHBondContact O-CB 3.3Å; A151-T155 PolarHBondContact O-N 3.43Å; A151-T155 PolarHBondContact O-OG1 2.52Å
152	G	95.6	Very high	93.4	Very high	15 Å²	15	50 Å²	50	16%	0.155	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-46.4	174.9	0	0	0	0	0	112.5	W148 Y149 A150 E156	W148-G152 PolarHBondContact O-N 3.36Å; Y149-G152 PolarHBondContact O-N 2.79Å; A150-G152 VanDerWaalsContact C-N 3.31Å; A150-G152 PolarHBondContact O-N 3.24Å; G152-E156 WeakPolarHBondContact O-CB 3.42Å; G152-E156 PolarHBondContact O-N 2.9Å
153	L	95.6	Very high	93.1	Very high	27 Å²	27	45.3 Å²	45.3	14%	0.141	25%	0.245	C	C	.	.	H	α-helix	trans	-65.7	-44.6	177.1	-70	-175.5	0	0	0	112.8	I96 Y103 Y149 A150 E156 I157	I96-L153 HydrophobicContact CD1-CD2 4.33Å; I96-L153 HydrophobicContact CG1-CD1 4.48Å; I96-L153 HydrophobicContact CG1-CD2 3.62Å; Y103-L153 HydrophobicContact CD2-CD2 4.48Å; Y103-L153 HydrophobicContact CE2-CD2 4.5Å; Y149-L153 HydrophobicContact CD1-CD1 4.03Å; Y149-L153 HydrophobicContact CE1-CD1 3.36Å; Y149-L153 HydrophobicContact CE1-CG 4.2Å; Y149-L153 PolarHBondContact O-N 3.34Å; Y149-L153 VanDerWaalsContact O-N 3.14Å; A150-L153 PolarHBondContact O-N 3.38Å; L153-E156 WeakPolarHBondContact O-CB 3.37Å; L153-E156 PolarHBondContact O-N 3.26Å; L153-I157 VanDerWaalsContact O-CG1 3.26Å; L153-I157 WeakPolarHBondContact O-CG1 3.38Å; L153-I157 PolarHBondContact O-N 2.94Å
154	L	94.5	Very high	92.5	Very high	79 Å²	79	43.4 Å²	43.4	41%	0.414	24%	0.237	S	C	.	.	H	α-helix	trans	-60.5	-47.3	177.2	-70.8	169.3	0	0	0	110.5	A150 A151 E156 I157 F158	A150-L154 WeakPolarHBondContact O-CB 3.44Å; A150-L154 VanDerWaalsContact O-CG 3.29Å; A150-L154 WeakPolarHBondContact O-CG 3.22Å; A150-L154 PolarHBondContact O-N 2.59Å; A151-L154 PolarHBondContact O-N 3.49Å; L154-E156 VanDerWaalsContact C-N 3.28Å; L154-E156 PolarHBondContact O-N 3.31Å; L154-I157 PolarHBondContact O-N 3.26Å; L154-I157 VanDerWaalsContact O-N 3.15Å; L154-F158 HydrophobicContact CB-CD2 4.34Å; L154-F158 HydrophobicContact CD2-CD2 4.31Å; L154-F158 HydrophobicContact CD2-CE2 3.75Å; L154-F158 VanDerWaalsContact O-CD2 3.22Å; L154-F158 WeakPolarHBondContact O-CD2 3.13Å; L154-F158 PolarHBondContact O-N 3.3Å
155	T	94.7	Very high	92	Very high	8 Å²	8	50.2 Å²	50.2	5%	0.049	26%	0.263	C	S	.	.	H	α-helix	trans	-64.4	-36.1	179.7	-54.7	0	0	0	0	111.7	H42 L80 A151 L159 V160	H42-T155 PolarHBondContact NE2-OG1 2.95Å; H42-T155 VanDerWaalsContact NE2-OG1 3.15Å; L80-T155 HydrophobicContact CD1-CG2 4.1Å; L80-T155 HydrophobicContact CD2-CG2 3.46Å; L80-T155 VanDerWaalsContact CD2-CG2 3.46Å; L80-T155 HydrophobicContact CG-CG2 4.42Å; A151-T155 VanDerWaalsContact O-CB 3.29Å; A151-T155 WeakPolarHBondContact O-CB 3.3Å; A151-T155 PolarHBondContact O-N 3.43Å; A151-T155 PolarHBondContact O-OG1 2.52Å; T155-L159 HydrophobicContact CG2-CB 4.03Å; T155-L159 HydrophobicContact CG2-CD2 4.09Å; T155-L159 WeakPolarHBondContact O-CA 3.31Å; T155-L159 VanDerWaalsContact O-CB 3.23Å; T155-L159 WeakPolarHBondContact O-CB 3.44Å; T155-L159 PolarHBondContact O-N 3.17Å; T155-V160 HydrophobicContact CG2-CG2 4.48Å; T155-V160 PolarHBondContact O-N 3.22Å
156	E	93.6	Very high	91.3	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.009	28%	0.281	C	S	.	.	I	π-helix	trans	-60.7	-49.7	172.1	-174.9	-156	106.6	0	0	112.2	Y87 R99 Y103 G152 L153 L154 K161	Y87-E156 HydrophobicContact CD2-CG 3.62Å; Y87-E156 HydrophobicContact CE2-CG 3.89Å; R99-E156 IonicContact CZ-OE1 3.47Å; R99-E156 IonicContact CZ-OE2 3.12Å; R99-E156 IonicContact NE-OE2 2.99Å; R99-E156 PolarHBondContact NE-OE2 2.92Å; R99-E156 IonicContact NH2-OE1 2.6Å; R99-E156 PolarHBondContact NH2-OE1 3.4Å; R99-E156 IonicContact NH2-OE2 2.62Å; R99-E156 PolarHBondContact NH2-OE2 3.37Å; Y103-E156 HydrophobicContact CE2-CB 3.93Å; Y103-E156 HydrophobicContact CE2-CG 4.18Å; Y103-E156 WeakPolarHBondContact CE2-OE2 3.44Å; Y103-E156 VanDerWaalsContact CZ-OE2 3.26Å; Y103-E156 PolarHBondContact OH-OE2 2.91Å; G152-E156 WeakPolarHBondContact O-CB 3.42Å; G152-E156 PolarHBondContact O-N 2.9Å; L153-E156 WeakPolarHBondContact O-CB 3.37Å; L153-E156 PolarHBondContact O-N 3.26Å; L154-E156 VanDerWaalsContact C-N 3.28Å; L154-E156 PolarHBondContact O-N 3.31Å; E156-K161 WeakPolarHBondContact O-CG 3.43Å; E156-K161 PolarHBondContact O-N 3.49Å; E156-K161 VanDerWaalsContact O-N 3.08Å; E156-K161 WeakPolarHBondContact OE1-CE 3.29Å; E156-K161 IonicContact OE1-NZ 2.93Å; E156-K161 PolarHBondContact OE1-NZ 3.2Å
157	I	91.6	Very high	90.6	Very high	69 Å²	69	51.3 Å²	51.3	35%	0.354	26%	0.261	S	S	.	.	I	π-helix	trans	-64.5	-49.5	-175.5	-69.5	164.9	0	0	0	110.8	I96 L153 L154	I96-I157 HydrophobicContact CD1-CD1 4.42Å; L153-I157 VanDerWaalsContact O-CG1 3.26Å; L153-I157 WeakPolarHBondContact O-CG1 3.38Å; L153-I157 PolarHBondContact O-N 2.94Å; L154-I157 PolarHBondContact O-N 3.26Å; L154-I157 VanDerWaalsContact O-N 3.15Å
158	F	90.2	Very high	89.7	Confident	134 Å²	134	53.8 Å²	53.8	59%	0.588	27%	0.271	S	S	*	.	I	π-helix	trans	-86.1	-32.8	-172.2	-70	-66	0	0	0	113.7	L154 N162	L154-F158 HydrophobicContact CB-CD2 4.34Å; L154-F158 HydrophobicContact CD2-CD2 4.31Å; L154-F158 HydrophobicContact CD2-CE2 3.75Å; L154-F158 VanDerWaalsContact O-CD2 3.22Å; L154-F158 WeakPolarHBondContact O-CD2 3.13Å; L154-F158 PolarHBondContact O-N 3.3Å; F158-N162 PolarHBondContact O-ND2 2.94Å
159	L	92.3	Very high	88.7	Confident	25 Å²	25	57.6 Å²	57.6	13%	0.131	29%	0.292	C	S	.	.	I	π-helix	trans	-115.5	-61.6	-167.9	-155.4	62.6	0	0	0	112.1	V38 Y39 H42 T155 K161 N162 T163	V38-L159 HydrophobicContact CG1-CD1 3.76Å; V38-L159 HydrophobicContact CG1-CD2 4.44Å; V38-L159 HydrophobicContact CG1-CG 4.4Å; Y39-L159 HydrophobicContact CD1-CD2 3.48Å; Y39-L159 VanDerWaalsContact CD1-CD2 3.48Å; Y39-L159 HydrophobicContact CD1-CG 3.94Å; Y39-L159 HydrophobicContact CE1-CD2 3.91Å; Y39-L159 HydrophobicContact CE1-CG 3.87Å; H42-L159 HydrophobicContact CB-CD2 3.54Å; H42-L159 VanDerWaalsContact CG-CD2 3.47Å; T155-L159 HydrophobicContact CG2-CB 4.03Å; T155-L159 HydrophobicContact CG2-CD2 4.09Å; T155-L159 WeakPolarHBondContact O-CA 3.31Å; T155-L159 VanDerWaalsContact O-CB 3.23Å; T155-L159 WeakPolarHBondContact O-CB 3.44Å; T155-L159 PolarHBondContact O-N 3.17Å; L159-K161 VanDerWaalsContact C-N 3.35Å; L159-K161 PolarHBondContact O-N 2.71Å; L159-N162 PolarHBondContact O-N 3.45Å; L159-N162 VanDerWaalsContact O-N 3.1Å; L159-T163 WeakPolarHBondContact O-CB 3.25Å; L159-T163 PolarHBondContact O-N 3.17Å; L159-T163 PolarHBondContact O-OG1 3.11Å
160	V	88.9	Confident	87.7	Confident	9 Å²	9	59 Å²	59	6%	0.055	31%	0.307	C	S	.	.	I	π-helix	trans	-61.2	-42.9	-171.8	-179.3	0	0	0	0	111.7	E84 Y87 T155 N162 M164	E84-V160 HydrophobicContact CB-CG1 4.04Å; Y87-V160 HydrophobicContact CD1-CG1 3.62Å; Y87-V160 HydrophobicContact CD2-CG1 4.44Å; Y87-V160 HydrophobicContact CE1-CG1 4.28Å; Y87-V160 HydrophobicContact CG-CG1 3.72Å; T155-V160 HydrophobicContact CG2-CG2 4.48Å; T155-V160 PolarHBondContact O-N 3.22Å; V160-N162 VanDerWaalsContact C-N 3.33Å; V160-N162 PolarHBondContact O-N 3.41Å; V160-M164 HydrophobicContact CG1-CG 4.31Å; V160-M164 VanDerWaalsContact O-CB 3.29Å; V160-M164 WeakPolarHBondContact O-CB 3.31Å; V160-M164 VanDerWaalsContact O-CG 3.3Å; V160-M164 WeakPolarHBondContact O-CG 3.2Å; V160-M164 PolarHBondContact O-N 2.81Å
161	K	87.4	Confident	86.5	Confident	53 Å²	53	59 Å²	59	23%	0.23	30%	0.304	C	S	.	.	H	α-helix	trans	-58.2	-44.6	176.5	-82.2	174.4	-169.3	157.1	0	112.4	Y87 E156 L159 R165	Y87-K161 HydrophobicContact CE2-CG 4Å; Y87-K161 WeakPolarHBondContact OH-CG 3.45Å; E156-K161 WeakPolarHBondContact O-CG 3.43Å; E156-K161 PolarHBondContact O-N 3.49Å; E156-K161 VanDerWaalsContact O-N 3.08Å; E156-K161 WeakPolarHBondContact OE1-CE 3.29Å; E156-K161 IonicContact OE1-NZ 2.93Å; E156-K161 PolarHBondContact OE1-NZ 3.2Å; L159-K161 VanDerWaalsContact C-N 3.35Å; L159-K161 PolarHBondContact O-N 2.71Å; K161-R165 VanDerWaalsContact O-CG 3.27Å; K161-R165 WeakPolarHBondContact O-CG 3.5Å; K161-R165 PolarHBondContact O-N 2.87Å
162	N	87.7	Confident	85.4	Confident	75 Å²	75	64.1 Å²	64.1	40%	0.401	33%	0.325	S	S	.	.	H	α-helix	trans	-74.4	-46.8	-175.8	-69.2	-34.9	0	0	0	111.3	F158 L159 V160 M164 R165 L166	F158-N162 PolarHBondContact O-ND2 2.94Å; L159-N162 PolarHBondContact O-N 3.45Å; L159-N162 VanDerWaalsContact O-N 3.1Å; V160-N162 VanDerWaalsContact C-N 3.33Å; V160-N162 PolarHBondContact O-N 3.41Å; N162-M164 VanDerWaalsContact C-N 3.31Å; N162-M164 PolarHBondContact O-N 3.33Å; N162-R165 PolarHBondContact O-N 3.5Å; N162-R165 VanDerWaalsContact O-N 3.15Å; N162-L166 WeakPolarHBondContact O-CG 3.48Å; N162-L166 PolarHBondContact O-N 2.82Å
163	T	87.4	Confident	84.3	Confident	20 Å²	20	71.5 Å²	71.5	12%	0.123	35%	0.349	C	S	.	.	H	α-helix	trans	-61.6	-39.6	179.6	-53.7	0	0	0	0	112	R35 Y39 L159 T167	R35-T163 HydrophobicContact CB-CG2 4.16Å; R35-T163 HydrophobicContact CG-CG2 3.37Å; Y39-T163 HydrophobicContact CE1-CG2 4.29Å; L159-T163 WeakPolarHBondContact O-CB 3.25Å; L159-T163 PolarHBondContact O-N 3.17Å; L159-T163 PolarHBondContact O-OG1 3.11Å; T163-T167 WeakPolarHBondContact O-CB 3.38Å; T163-T167 PolarHBondContact O-N 3.29Å; T163-T167 PolarHBondContact O-OG1 2.9Å
164	M	81.1	Confident	83.1	Confident	40 Å²	40	72.1 Å²	72.1	20%	0.197	36%	0.356	C	S	.	.	H	α-helix	trans	-67.9	-39.6	175.5	-75.9	-67	-141.1	0	0	112.7	E84 A88 V160 N162 T167 L168	E84-M164 HydrophobicContact CB-CE 3.99Å; E84-M164 HydrophobicContact CG-CE 3.68Å; A88-M164 HydrophobicContact CB-CE 4.13Å; V160-M164 HydrophobicContact CG1-CG 4.31Å; V160-M164 VanDerWaalsContact O-CB 3.29Å; V160-M164 WeakPolarHBondContact O-CB 3.31Å; V160-M164 VanDerWaalsContact O-CG 3.3Å; V160-M164 WeakPolarHBondContact O-CG 3.2Å; V160-M164 PolarHBondContact O-N 2.81Å; N162-M164 VanDerWaalsContact C-N 3.31Å; N162-M164 PolarHBondContact O-N 3.33Å; M164-T167 PolarHBondContact O-N 3.22Å; M164-L168 WeakPolarHBondContact O-CG 3.17Å; M164-L168 PolarHBondContact O-N 2.8Å; M164-L168 VanDerWaalsContact O-N 3.09Å
165	R	82.6	Confident	81.8	Confident	156 Å²	156	76.4 Å²	76.4	59%	0.589	37%	0.371	S	S	*	.	H	α-helix	trans	-61.9	-46.5	175.5	-77.5	173.3	177.3	-177.1	-1.3	111.5	K161 N162 T167 L168 M169	K161-R165 VanDerWaalsContact O-CG 3.27Å; K161-R165 WeakPolarHBondContact O-CG 3.5Å; K161-R165 PolarHBondContact O-N 2.87Å; N162-R165 PolarHBondContact O-N 3.5Å; N162-R165 VanDerWaalsContact O-N 3.15Å; R165-T167 VanDerWaalsContact C-N 3.32Å; R165-T167 PolarHBondContact O-N 2.98Å; R165-L168 PolarHBondContact O-N 2.93Å; R165-M169 WeakPolarHBondContact O-CG 3.39Å; R165-M169 PolarHBondContact O-N 2.72Å
166	L	81.1	Confident	80.8	Confident	110 Å²	110	80.6 Å²	80.6	58%	0.576	40%	0.396	S	S	*	.	H	α-helix	trans	-62.2	-39.7	177.9	-68	172.1	0	0	0	112.1	N162 L168 M169 T170	N162-L166 WeakPolarHBondContact O-CG 3.48Å; N162-L166 PolarHBondContact O-N 2.82Å; L166-L168 VanDerWaalsContact C-N 3.34Å; L166-L168 PolarHBondContact O-N 3.25Å; L166-M169 PolarHBondContact O-N 3.49Å; L166-T170 WeakPolarHBondContact O-CG2 3.43Å; L166-T170 PolarHBondContact O-N 2.99Å; L166-T170 PolarHBondContact O-OG1 2.94Å
167	T	79.7	Confident	79.3	Confident	25 Å²	25	86.6 Å²	86.6	15%	0.153	44%	0.439	C	S	.	.	H	α-helix	trans	-63	-40.6	176.3	-59.6	0	0	0	0	111.7	R35 T163 M164 R165 T170 S171	R35-T167 PolarHBondContact NH1-OG1 3.47Å; T163-T167 WeakPolarHBondContact O-CB 3.38Å; T163-T167 PolarHBondContact O-N 3.29Å; T163-T167 PolarHBondContact O-OG1 2.9Å; M164-T167 PolarHBondContact O-N 3.22Å; R165-T167 VanDerWaalsContact C-N 3.32Å; R165-T167 PolarHBondContact O-N 2.98Å; T167-T170 WeakPolarHBondContact CA-OG1 3.43Å; T167-T170 PolarHBondContact O-OG1 3.1Å; T167-S171 WeakPolarHBondContact O-CB 3.31Å; T167-S171 PolarHBondContact O-N 2.73Å; T167-S171 VanDerWaalsContact O-N 3.13Å
168	L	75.7	Confident	78.7	Confident	116 Å²	116	87.5 Å²	87.5	61%	0.607	44%	0.443	S	S	*	.	H	α-helix	trans	-69	-41.9	178.4	-69.4	172.2	0	0	0	112.1	M164 R165 L166 S171 H172	M164-L168 WeakPolarHBondContact O-CG 3.17Å; M164-L168 PolarHBondContact O-N 2.8Å; M164-L168 VanDerWaalsContact O-N 3.09Å; R165-L168 PolarHBondContact O-N 2.93Å; L166-L168 VanDerWaalsContact C-N 3.34Å; L166-L168 PolarHBondContact O-N 3.25Å; L168-S171 PolarHBondContact O-N 3.27Å; L168-H172 PolarHBondContact O-N 3.48Å
169	M	75.4	Confident	78.1	Confident	125 Å²	125	85.1 Å²	85.1	62%	0.616	44%	0.436	S	S	*	.	H	α-helix	trans	-62.1	-46.9	177.9	-70.4	171.1	175.1	0	0	111.8	R165 L166 S171 H172 Y173	R165-M169 WeakPolarHBondContact O-CG 3.39Å; R165-M169 PolarHBondContact O-N 2.72Å; L166-M169 PolarHBondContact O-N 3.49Å; M169-S171 VanDerWaalsContact C-N 3.31Å; M169-S171 PolarHBondContact O-N 2.93Å; M169-H172 PolarHBondContact O-N 3.44Å; M169-H172 VanDerWaalsContact O-N 3.15Å; M169-Y173 PolarHBondContact O-N 3.12Å
170	T	74.5	Confident	77.3	Confident	89 Å²	89	88.4 Å²	88.4	55%	0.546	45%	0.453	S	S	.	.	H	α-helix	trans	-63.2	-36.9	177.6	49.9	0	0	0	0	112.2	L166 T167 S174	L166-T170 WeakPolarHBondContact O-CG2 3.43Å; L166-T170 PolarHBondContact O-N 2.99Å; L166-T170 PolarHBondContact O-OG1 2.94Å; T167-T170 WeakPolarHBondContact CA-OG1 3.43Å; T167-T170 PolarHBondContact O-OG1 3.1Å; T170-S174 WeakPolarHBondContact O-CB 3.13Å; T170-S174 PolarHBondContact O-N 3.3Å; T170-S174 VanDerWaalsContact O-N 3.13Å
171	S	71.3	Confident	76.6	Confident	42 Å²	42	93.1 Å²	93.1	29%	0.294	48%	0.476	S	S	.	.	H	α-helix	trans	-68.2	-33	174.3	-176.2	0	0	0	0	113.2	T167 L168 M169 K175	T167-S171 WeakPolarHBondContact O-CB 3.31Å; T167-S171 PolarHBondContact O-N 2.73Å; T167-S171 VanDerWaalsContact O-N 3.13Å; L168-S171 PolarHBondContact O-N 3.27Å; M169-S171 VanDerWaalsContact C-N 3.31Å; M169-S171 PolarHBondContact O-N 2.93Å; S171-K175 WeakPolarHBondContact O-CG 3.32Å
172	H	71.8	Confident	75.9	Confident	128 Å²	128	95.6 Å²	95.6	59%	0.593	49%	0.491	S	S	*	.	H	α-helix	trans	-72	-49	177	-174.4	-78.8	0	0	0	110.9	L168 M169 S174 K175 T176	L168-H172 PolarHBondContact O-N 3.48Å; M169-H172 PolarHBondContact O-N 3.44Å; M169-H172 VanDerWaalsContact O-N 3.15Å; H172-S174 VanDerWaalsContact C-N 3.26Å; H172-S174 PolarHBondContact O-N 3.3Å; H172-K175 WeakPolarHBondContact O-CB 3.32Å; H172-K175 PolarHBondContact O-N 3.26Å; H172-T176 PolarHBondContact O-N 3.25Å; H172-T176 PolarHBondContact O-OG1 2.91Å
173	Y	74	Confident	75.1	Confident	169 Å²	169	96.9 Å²	96.9	66%	0.663	50%	0.497	S	S	*	.	H	α-helix	trans	-55.3	-43.1	178	-174.8	-97.4	0	0	0	111.7	M169 K175 T176 S177	M169-Y173 PolarHBondContact O-N 3.12Å; Y173-K175 PolarHBondContact O-N 2.97Å; Y173-T176 PolarHBondContact O-N 3.41Å; Y173-T176 PolarHBondContact O-OG1 3.22Å; Y173-S177 PolarHBondContact O-N 3.09Å; Y173-S177 PolarHBondContact O-OG 2.84Å
174	S	69.9	Low	74.2	Confident	40 Å²	40	102.4 Å²	102.4	28%	0.28	52%	0.524	S	S	.	.	H	α-helix	trans	-67.6	-14.4	177	178.1	0	0	0	0	115	K27 T170 H172	K27-S174 PolarHBondContact NZ-OG 3.22Å; T170-S174 WeakPolarHBondContact O-CB 3.13Å; T170-S174 PolarHBondContact O-N 3.3Å; T170-S174 VanDerWaalsContact O-N 3.13Å; H172-S174 VanDerWaalsContact C-N 3.26Å; H172-S174 PolarHBondContact O-N 3.3Å
175	K	67.9	Low	73.7	Confident	170 Å²	170	107.2 Å²	107.2	74%	0.739	55%	0.549	S	S	*	.	H	α-helix	trans	-90.1	-21	174.9	-74.9	179	179.7	-177.5	0	112.2	S171 H172 Y173	S171-K175 WeakPolarHBondContact O-CG 3.32Å; H172-K175 WeakPolarHBondContact O-CB 3.32Å; H172-K175 PolarHBondContact O-N 3.26Å; Y173-K175 PolarHBondContact O-N 2.97Å
176	T	73	Confident	73	Confident	95 Å²	95	103.2 Å²	103.2	58%	0.583	55%	0.546	S	S	*	.	H	α-helix	trans	-97.1	-11.4	-177.6	51.7	0	0	0	0	113.5	H172 Y173	H172-T176 PolarHBondContact O-N 3.25Å; H172-T176 PolarHBondContact O-OG1 2.91Å; Y173-T176 PolarHBondContact O-N 3.41Å; Y173-T176 PolarHBondContact O-OG1 3.22Å
177	S	61.4	Low	72.2	Confident	129 Å²	129	102.5 Å²	102.5	90%	0.902	54%	0.543	S	S	*	.			trans	-95	0	169	-55.9	0	0	0	0	110.8	Y173	Y173-S177 PolarHBondContact O-N 3.09Å; Y173-S177 PolarHBondContact O-OG 2.84Å

Retrieved 177 of 177 residues in 54.7 ms (Link to these results)

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