A0A087YFW2_POEFO Loading...

Protein FAM180A-like

AlphaFold DB , UniProt , Accession A0A087YFW2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 168 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.8	Low	71	Confident	216 Å²	216	138.6 Å²	138.6	100%	1.064	67%	0.667	S	S	*	*				0	-14.6	0	-78.7	176.1	-171.6	0	0	115	R3	M1-R3 PolarHBondContact O-N 3.22Å
2	A	56.2	Low	72.2	Confident	72 Å²	72	135.3 Å²	135.3	60%	0.595	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-30.6	-177.6	0	0	0	0	0	115.3	R4 W5	A2-R4 VanDerWaalsContact C-N 3.31Å; A2-R4 PolarHBondContact O-N 2.94Å; A2-W5 PolarHBondContact O-N 3.47Å
3	R	58.2	Low	73.1	Confident	233 Å²	233	136.5 Å²	136.5	88%	0.879	66%	0.656	S	S	*	*	H	α-helix	trans	-63.6	-24.7	-176.2	-100.9	176.5	164.2	-178.5	-5.3	115.6	M1	M1-R3 PolarHBondContact O-N 3.22Å
4	R	60	Low	73.6	Confident	205 Å²	205	133.9 Å²	133.9	77%	0.774	65%	0.646	S	S	*	*	H	α-helix	trans	-74.9	-28.7	-176.8	-70	175.4	80.2	172.1	3.2	113	A2 L8	A2-R4 VanDerWaalsContact C-N 3.31Å; A2-R4 PolarHBondContact O-N 2.94Å; R4-L8 PolarHBondContact O-N 3.38Å
5	W	61.3	Low	73.5	Confident	183 Å²	183	128.9 Å²	128.9	69%	0.693	63%	0.631	S	S	*	*	H	α-helix	trans	-76.9	-34	-177.5	-64.5	80.8	0	0	0	112.3	A2 A7 L8 L9	A2-W5 PolarHBondContact O-N 3.47Å; W5-A7 VanDerWaalsContact C-N 3.31Å; W5-A7 PolarHBondContact O-N 3.01Å; W5-L8 PolarHBondContact O-N 3.37Å; W5-L9 WeakPolarHBondContact O-CG 3.43Å; W5-L9 PolarHBondContact O-N 3.28Å
6	W	75.4	Confident	73.2	Confident	196 Å²	196	124.8 Å²	124.8	74%	0.742	62%	0.618	S	S	*	*	H	α-helix	trans	-63.8	-36.3	174.2	-72.3	86.2	0	0	0	112.4	A10	W6-A10 WeakPolarHBondContact O-CB 3.42Å; W6-A10 PolarHBondContact O-N 3.01Å
7	A	82.2	Confident	72.8	Confident	57 Å²	57	122.2 Å²	122.2	47%	0.471	61%	0.607	S	S	.	*	H	α-helix	trans	-65.7	-42.1	175.3	0	0	0	0	0	111.8	W5 A10 V11	W5-A7 VanDerWaalsContact C-N 3.31Å; W5-A7 PolarHBondContact O-N 3.01Å; A7-A10 PolarHBondContact O-N 3.43Å; A7-V11 WeakPolarHBondContact O-CB 3.44Å; A7-V11 VanDerWaalsContact O-CG2 3.23Å; A7-V11 WeakPolarHBondContact O-CG2 3.38Å; A7-V11 PolarHBondContact O-N 3.21Å
8	L	80.4	Confident	72.2	Confident	114 Å²	114	122.4 Å²	122.4	60%	0.597	61%	0.606	S	S	*	*	H	α-helix	trans	-66.2	-43.1	176.6	-68.8	173.1	0	0	0	111.8	R4 W5 V11 V12	R4-L8 PolarHBondContact O-N 3.38Å; W5-L8 PolarHBondContact O-N 3.37Å; L8-V11 PolarHBondContact O-N 3.43Å; L8-V12 VanDerWaalsContact O-CG2 3.31Å; L8-V12 WeakPolarHBondContact O-CG2 3.33Å; L8-V12 PolarHBondContact O-N 2.92Å
9	L	82.3	Confident	71.2	Confident	116 Å²	116	118.2 Å²	118.2	61%	0.607	59%	0.593	S	S	*	*	H	α-helix	trans	-64.3	-40.5	175.9	-71	172	0	0	0	111.9	W5 V12 Y13	W5-L9 WeakPolarHBondContact O-CG 3.43Å; W5-L9 PolarHBondContact O-N 3.28Å; L9-V12 PolarHBondContact O-N 3.01Å; L9-Y13 VanDerWaalsContact O-CB 3.23Å; L9-Y13 WeakPolarHBondContact O-CB 3.38Å; L9-Y13 PolarHBondContact O-N 3.27Å
10	A	83.8	Confident	70.1	Confident	47 Å²	47	114.8 Å²	114.8	39%	0.388	58%	0.583	S	S	.	*	H	α-helix	trans	-64	-41.6	174.9	0	0	0	0	0	111.8	W6 A7 Y13 L14	W6-A10 WeakPolarHBondContact O-CB 3.42Å; W6-A10 PolarHBondContact O-N 3.01Å; A7-A10 PolarHBondContact O-N 3.43Å; A10-Y13 PolarHBondContact O-N 3.46Å; A10-L14 VanDerWaalsContact O-CB 3.3Å; A10-L14 WeakPolarHBondContact O-CB 3.24Å; A10-L14 VanDerWaalsContact O-CG 3.22Å; A10-L14 WeakPolarHBondContact O-CG 3.48Å; A10-L14 PolarHBondContact O-N 3.22Å
11	V	86.3	Confident	69.1	Low	86 Å²	86	112.5 Å²	112.5	52%	0.521	58%	0.582	S	S	.	*	H	α-helix	trans	-64.9	-44.1	176.2	168.9	0	0	0	0	111.2	A7 L8 L14 S15	A7-V11 WeakPolarHBondContact O-CB 3.44Å; A7-V11 VanDerWaalsContact O-CG2 3.23Å; A7-V11 WeakPolarHBondContact O-CG2 3.38Å; A7-V11 PolarHBondContact O-N 3.21Å; L8-V11 PolarHBondContact O-N 3.43Å; V11-L14 PolarHBondContact O-N 2.84Å; V11-S15 VanDerWaalsContact O-CB 3.24Å; V11-S15 WeakPolarHBondContact O-CB 3.49Å; V11-S15 PolarHBondContact O-N 2.94Å; V11-S15 PolarHBondContact O-OG 3.15Å
12	V	85.9	Confident	68.9	Low	98 Å²	98	111.8 Å²	111.8	59%	0.594	57%	0.568	S	S	*	*	H	α-helix	trans	-64.2	-42.1	177.2	171.6	0	0	0	0	111	L8 L9 S15 S16	L8-V12 VanDerWaalsContact O-CG2 3.31Å; L8-V12 WeakPolarHBondContact O-CG2 3.33Å; L8-V12 PolarHBondContact O-N 2.92Å; L9-V12 PolarHBondContact O-N 3.01Å; V12-S15 PolarHBondContact O-N 2.95Å; V12-S16 WeakPolarHBondContact O-CB 3.47Å; V12-S16 PolarHBondContact O-N 3.1Å; V12-S16 PolarHBondContact O-OG 3.33Å
13	Y	83.4	Confident	68.4	Low	152 Å²	152	115.9 Å²	115.9	60%	0.596	57%	0.574	S	S	*	*	H	α-helix	trans	-66.3	-41.7	177.1	-177	-105.6	0	0	0	112.8	L9 A10 S15 S16 L17	L9-Y13 VanDerWaalsContact O-CB 3.23Å; L9-Y13 WeakPolarHBondContact O-CB 3.38Å; L9-Y13 PolarHBondContact O-N 3.27Å; A10-Y13 PolarHBondContact O-N 3.46Å; Y13-S15 VanDerWaalsContact C-N 3.35Å; Y13-S16 PolarHBondContact O-N 2.96Å; Y13-S16 PolarHBondContact O-OG 2.84Å; Y13-L17 HydrophobicContact CD1-CD1 3.8Å; Y13-L17 HydrophobicContact CE1-CD1 3.39Å; Y13-L17 HydrophobicContact CE1-CG 4.32Å; Y13-L17 WeakPolarHBondContact O-CB 3.42Å; Y13-L17 WeakPolarHBondContact O-CG 3.46Å; Y13-L17 PolarHBondContact O-N 3.4Å
14	L	80.4	Confident	67.5	Low	99 Å²	99	112 Å²	112	52%	0.518	57%	0.565	S	S	.	*	H	α-helix	trans	-68.3	-36.2	174.9	-73	167.1	0	0	0	111.5	A10 V11 L17 Q18	A10-L14 VanDerWaalsContact O-CB 3.3Å; A10-L14 WeakPolarHBondContact O-CB 3.24Å; A10-L14 VanDerWaalsContact O-CG 3.22Å; A10-L14 WeakPolarHBondContact O-CG 3.48Å; A10-L14 PolarHBondContact O-N 3.22Å; V11-L14 PolarHBondContact O-N 2.84Å; L14-L17 PolarHBondContact O-N 3.2Å; L14-Q18 WeakPolarHBondContact O-CB 3.49Å; L14-Q18 VanDerWaalsContact O-CG 3.3Å; L14-Q18 WeakPolarHBondContact O-CG 3.28Å; L14-Q18 PolarHBondContact O-N 3.43Å
15	S	71.7	Confident	67.1	Low	60 Å²	60	113.8 Å²	113.8	42%	0.42	57%	0.572	S	S	.	*	H	α-helix	trans	-67.9	-37.6	175.9	-57.5	0	0	0	0	111.7	V11 V12 Y13 Q18 A19	V11-S15 VanDerWaalsContact O-CB 3.24Å; V11-S15 WeakPolarHBondContact O-CB 3.49Å; V11-S15 PolarHBondContact O-N 2.94Å; V11-S15 PolarHBondContact O-OG 3.15Å; V12-S15 PolarHBondContact O-N 2.95Å; Y13-S15 VanDerWaalsContact C-N 3.35Å; S15-Q18 PolarHBondContact O-N 2.85Å; S15-A19 VanDerWaalsContact O-CB 3.23Å; S15-A19 WeakPolarHBondContact O-CB 3.47Å; S15-A19 PolarHBondContact O-N 2.85Å
16	S	69.4	Low	66.8	Low	62 Å²	62	112.6 Å²	112.6	43%	0.434	57%	0.572	S	S	.	*	H	α-helix	trans	-72.2	-34.4	175.9	69.8	0	0	0	0	112.1	V12 Y13 A19 A20	V12-S16 WeakPolarHBondContact O-CB 3.47Å; V12-S16 PolarHBondContact O-N 3.1Å; V12-S16 PolarHBondContact O-OG 3.33Å; Y13-S16 PolarHBondContact O-N 2.96Å; Y13-S16 PolarHBondContact O-OG 2.84Å; S16-A19 PolarHBondContact O-N 3.15Å; S16-A20 WeakPolarHBondContact O-CB 3.43Å; S16-A20 PolarHBondContact O-N 3.42Å
17	L	66.1	Low	66.5	Low	82 Å²	82	106.3 Å²	106.3	43%	0.429	56%	0.562	S	S	.	*	H	α-helix	trans	-66.7	-41.9	170.1	-76.9	169.7	0	0	0	112.2	Y13 L14 A20 A21	Y13-L17 HydrophobicContact CD1-CD1 3.8Å; Y13-L17 HydrophobicContact CE1-CD1 3.39Å; Y13-L17 HydrophobicContact CE1-CG 4.32Å; Y13-L17 WeakPolarHBondContact O-CB 3.42Å; Y13-L17 WeakPolarHBondContact O-CG 3.46Å; Y13-L17 PolarHBondContact O-N 3.4Å; L14-L17 PolarHBondContact O-N 3.2Å; L17-A20 PolarHBondContact O-N 3.04Å; L17-A21 WeakPolarHBondContact O-CB 3.42Å; L17-A21 PolarHBondContact O-N 3.28Å
18	Q	62	Low	66.5	Low	125 Å²	125	105.3 Å²	105.3	58%	0.584	55%	0.548	S	S	*	.	H	α-helix	trans	-68.2	-36.7	175	-75.4	-178.3	-4.8	0	0	112.1	L14 S15 R22	L14-Q18 WeakPolarHBondContact O-CB 3.49Å; L14-Q18 VanDerWaalsContact O-CG 3.3Å; L14-Q18 WeakPolarHBondContact O-CG 3.28Å; L14-Q18 PolarHBondContact O-N 3.43Å; S15-Q18 PolarHBondContact O-N 2.85Å; Q18-R22 VanDerWaalsContact O-CB 3.27Å; Q18-R22 WeakPolarHBondContact O-CB 3.35Å; Q18-R22 WeakPolarHBondContact O-CG 3.31Å; Q18-R22 PolarHBondContact O-N 3.33Å
19	A	53.9	Low	66.5	Low	43 Å²	43	100 Å²	100	36%	0.355	52%	0.521	S	S	.	.	H	α-helix	trans	-64.7	-49.3	171.5	0	0	0	0	0	110.3	S15 S16 A21 R22 H23	S15-A19 VanDerWaalsContact O-CB 3.23Å; S15-A19 WeakPolarHBondContact O-CB 3.47Å; S15-A19 PolarHBondContact O-N 2.85Å; S16-A19 PolarHBondContact O-N 3.15Å; A19-A21 VanDerWaalsContact C-N 3.32Å; A19-A21 PolarHBondContact O-N 3.41Å; A19-R22 CarbonylContact O-C 3.57Å; A19-R22 PolarHBondContact O-N 3.46Å; A19-H23 WeakPolarHBondContact O-CB 3.46Å; A19-H23 PolarHBondContact O-CD2 3.45Å; A19-H23 PolarHBondContact O-N 3.23Å
20	A	47.8	Very low	66.1	Low	49 Å²	49	98.1 Å²	98.1	41%	0.405	52%	0.515	S	S	.	.	H	α-helix	trans	-60.2	-39.6	176.6	0	0	0	0	0	112.2	S16 L17 H23 H24	S16-A20 WeakPolarHBondContact O-CB 3.43Å; S16-A20 PolarHBondContact O-N 3.42Å; L17-A20 PolarHBondContact O-N 3.04Å; A20-H23 PolarHBondContact O-N 3.43Å; A20-H24 WeakPolarHBondContact O-CB 3.48Å; A20-H24 PolarHBondContact O-N 2.93Å
21	A	50.1	Low	65.2	Low	67 Å²	67	98.4 Å²	98.4	55%	0.554	51%	0.514	S	S	*	.	H	α-helix	trans	-70.6	-35.1	175.3	0	0	0	0	0	112.7	L17 A19 H23	L17-A21 WeakPolarHBondContact O-CB 3.42Å; L17-A21 PolarHBondContact O-N 3.28Å; A19-A21 VanDerWaalsContact C-N 3.32Å; A19-A21 PolarHBondContact O-N 3.41Å; A21-H23 VanDerWaalsContact C-N 3.34Å
22	R	49.6	Very low	64	Low	202 Å²	202	94.4 Å²	94.4	76%	0.762	49%	0.49	S	S	*	.	H	α-helix	trans	-72.2	-26.9	171.4	-81.3	178.1	171.4	177.9	-1.1	112.9	Q18 A19	Q18-R22 VanDerWaalsContact O-CB 3.27Å; Q18-R22 WeakPolarHBondContact O-CB 3.35Å; Q18-R22 WeakPolarHBondContact O-CG 3.31Å; Q18-R22 PolarHBondContact O-N 3.33Å; A19-R22 CarbonylContact O-C 3.57Å; A19-R22 PolarHBondContact O-N 3.46Å
23	H	45.3	Very low	62.7	Low	158 Å²	158	95.9 Å²	95.9	73%	0.731	49%	0.488	S	S	*	.	H	α-helix	trans	-81.3	-28.4	174.7	-83.8	-75.5	0	0	0	112.2	A19 A20 A21 R25	A19-H23 WeakPolarHBondContact O-CB 3.46Å; A19-H23 PolarHBondContact O-CD2 3.45Å; A19-H23 PolarHBondContact O-N 3.23Å; A20-H23 PolarHBondContact O-N 3.43Å; A21-H23 VanDerWaalsContact C-N 3.34Å; H23-R25 PolarHBondContact O-N 3Å
24	H	40.6	Very low	61.3	Low	150 Å²	150	90.4 Å²	90.4	69%	0.694	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	110	169.8	-96.4	-76.8	0	0	0	110.6	A20	A20-H24 WeakPolarHBondContact O-CB 3.48Å; A20-H24 PolarHBondContact O-N 2.93Å
25	R	50.4	Low	59.9	Low	244 Å²	244	92.3 Å²	92.3	92%	0.921	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.4	42.1	172.7	-51.6	178.8	174.2	-172.7	-1.9	116.8	H23	H23-R25 PolarHBondContact O-N 3Å
26	K	56.7	Low	58.7	Low	157 Å²	157	99.2 Å²	99.2	68%	0.683	50%	0.501	S	S	*	.			trans	-81.4	117.4	147	-73.9	-174.3	-179.7	-179.6	0	107.9
27	A	67.3	Low	57.8	Low	64 Å²	64	106.4 Å²	106.4	53%	0.529	52%	0.519	S	S	.	.			trans	-49.2	144.4	171.5	0	0	0	0	0	110.1	Y29 K111	A27-Y29 VanDerWaalsContact C-N 3.33Å; A27-Y29 WeakPolarHBondContact CB-O 3.5Å; A27-K111 PolarHBondContact O-NZ 2.81Å
28	L	82.2	Confident	57.1	Low	36 Å²	36	106.8 Å²	106.8	19%	0.188	54%	0.542	C	S	.	.	S	Bend	trans	-61.9	-49.1	179	-77.5	171.8	0	0	0	109.3	L108 K111 L112 L119 D123	L28-L108 HydrophobicContact CB-CD1 4.25Å; L28-L108 HydrophobicContact CD2-CD1 4.36Å; L28-K111 HydrophobicContact CD2-CB 3.55Å; L28-K111 HydrophobicContact CD2-CD 4.04Å; L28-K111 HydrophobicContact CD2-CG 4.49Å; L28-L112 HydrophobicContact CD1-CD2 3.94Å; L28-L112 HydrophobicContact CD2-CD2 3.98Å; L28-L119 HydrophobicContact CD1-CD2 3.35Å; L28-D123 HydrophobicContact CD1-CB 4.09Å
29	Y	81.5	Confident	56.4	Low	4 Å²	4	103.8 Å²	103.8	2%	0.016	54%	0.539	C	S	.	.	S	Bend	trans	-108.8	149.9	172.9	-67.8	-88.5	0	0	0	111.4	A27 V97 L98 P99 L108 D123 R126 T127 T130	A27-Y29 VanDerWaalsContact C-N 3.33Å; A27-Y29 WeakPolarHBondContact CB-O 3.5Å; Y29-V97 HydrophobicContact CD1-CG1 4.3Å; Y29-V97 HydrophobicContact CG-CG1 4.44Å; Y29-L98 HydrophobicContact CE1-CD2 4.37Å; Y29-P99 HydrophobicContact CE1-CG 4.24Å; Y29-L108 HydrophobicContact CD2-CD1 4.42Å; Y29-L108 HydrophobicContact CE1-CD1 4.38Å; Y29-L108 HydrophobicContact CE1-CD2 3.88Å; Y29-L108 HydrophobicContact CE2-CD1 3.86Å; Y29-L108 HydrophobicContact CE2-CD2 4.41Å; Y29-L108 WeakPolarHBondContact OH-CD2 3.19Å; Y29-D123 HydrophobicContact CD2-CB 4.43Å; Y29-R126 HydrophobicContact CD1-CB 3.85Å; Y29-R126 HydrophobicContact CD1-CG 4.47Å; Y29-R126 HydrophobicContact CD2-CB 3.69Å; Y29-R126 HydrophobicContact CD2-CG 4.44Å; Y29-R126 HydrophobicContact CE1-CB 3.73Å; Y29-R126 HydrophobicContact CE2-CB 3.58Å; Y29-R126 HydrophobicContact CG-CB 3.82Å; Y29-R126 HydrophobicContact CG-CG 4.3Å; Y29-R126 PolarHBondContact OH-O 3.19Å; Y29-T127 WeakPolarHBondContact OH-CA 2.7Å; Y29-T127 PolarHBondContact OH-N 3.25Å; Y29-T127 PolarHBondContact OH-OG1 2.94Å; Y29-T130 WeakPolarHBondContact CE1-OG1 3.47Å; Y29-T130 PolarHBondContact OH-OG1 3.17Å
30	P	74.7	Confident	56.1	Low	75 Å²	75	112.3 Å²	112.3	49%	0.487	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-63.8	152.2	168.2	29.8	-33.4	0	0	0	110.3	V97	P30-V97 WeakPolarHBondContact CD-O 3.04Å; P30-V97 WeakPolarHBondContact CG-O 3.19Å
31	S	63.5	Low	56.4	Low	54 Å²	54	113.8 Å²	113.8	38%	0.378	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-76.2	127.3	168.6	-56.2	0	0	0	0	108.9	F33	S31-F33 WeakPolarHBondContact O-CD2 3.37Å
32	A	61.4	Low	56.8	Low	1 Å²	1	114.6 Å²	114.6	1%	0.008	57%	0.566	C	S	.	*	P	Polyproline II helix	trans	-70.1	133.7	165.6	0	0	0	0	0	109.4	N44 P45 V92 D96 V97	A32-N44 PolarHBondContact O-N 3.39Å; A32-P45 HydrophobicContact CB-CG 3.76Å; A32-V92 HydrophobicContact CB-CG1 4.02Å; A32-D96 HydrophobicContact CB-CB 3.88Å; A32-V97 HydrophobicContact CB-CG2 3.22Å
33	F	58.2	Low	57.5	Low	129 Å²	129	110.8 Å²	110.8	57%	0.566	56%	0.559	S	S	*	*	B	Isolated β-bridge	trans	-114.8	104.6	169.9	-68.1	-82	0	0	0	108	S31 I35	S31-F33 WeakPolarHBondContact O-CD2 3.37Å; F33-I35 HydrophobicContact CB-CD1 4.34Å; F33-I35 HydrophobicContact CB-CG1 4.38Å; F33-I35 PolarHBondContact O-N 3.02Å
34	L	54.3	Low	58.7	Low	38 Å²	38	105.3 Å²	105.3	20%	0.199	54%	0.535	C	S	.	.			trans	-73.2	77.1	170.8	-77.6	177.3	0	0	0	110.6	L42 V92	L34-L42 HydrophobicContact CD1-CB 3.86Å; L34-L42 HydrophobicContact CD1-CD1 3.73Å; L34-L42 HydrophobicContact CD1-CG 3.95Å; L34-V92 HydrophobicContact CD1-CG1 4.09Å; L34-V92 HydrophobicContact CD1-CG2 3.91Å; L34-V92 HydrophobicContact CD2-CB 4.08Å; L34-V92 HydrophobicContact CD2-CG1 3.53Å; L34-V92 HydrophobicContact CD2-CG2 3.33Å; L34-V92 HydrophobicContact CG-CG1 3.71Å; L34-V92 HydrophobicContact CG-CG2 4.04Å
35	I	50.6	Low	60.7	Low	139 Å²	139	98.4 Å²	98.4	71%	0.713	50%	0.504	S	S	*	.			trans	-106.1	-13.8	171.9	-62.7	175.6	0	0	0	110.7	F33	F33-I35 HydrophobicContact CB-CD1 4.34Å; F33-I35 HydrophobicContact CB-CG1 4.38Å; F33-I35 PolarHBondContact O-N 3.02Å
36	K	47.8	Very low	62.4	Low	205 Å²	205	87.3 Å²	87.3	89%	0.891	46%	0.463	S	S	*	.	S	Bend	trans	-90.6	-2.8	-163	-128.6	-179	178.3	-174.4	0	117.1
37	R	50.2	Low	63.9	Low	212 Å²	212	80.1 Å²	80.1	80%	0.8	43%	0.432	S	S	*	.	S	Bend	trans	-148.9	68.2	177.9	-91.7	-174.7	178.6	159.6	-0.3	113	A39	R37-A39 PolarHBondContact O-N 3.09Å
38	G	50.2	Low	64.9	Low	90 Å²	90	77.9 Å²	77.9	93%	0.928	41%	0.411	S	S	*	.	S	Bend	trans	56	8	159.6	0	0	0	0	0	118.8
39	A	48.8	Very low	65.1	Low	63 Å²	63	82.8 Å²	82.8	52%	0.521	43%	0.433	S	S	.	.	S	Bend	trans	-120.2	131.9	-177.5	0	0	0	0	0	108.4	R37	R37-A39 PolarHBondContact O-N 3.09Å
40	Y	48.1	Very low	65.3	Low	222 Å²	222	84.8 Å²	84.8	87%	0.871	45%	0.447	S	S	*	.			trans	-46.8	147.1	-176.1	-62.3	-91.4	0	0	0	113.8	L42	Y40-L42 PolarHBondContact O-N 3.29Å
41	S	53.6	Low	66	Low	80 Å²	80	87.1 Å²	87.1	56%	0.559	45%	0.452	S	S	*	.			trans	-57.2	102.2	-173.1	59.5	0	0	0	0	113.4	I43	S41-I43 PolarHBondContact O-N 3.11Å
42	L	57.5	Low	67.2	Low	83 Å²	83	90.3 Å²	90.3	44%	0.435	46%	0.461	S	S	.	.			trans	-79	102.2	157.3	-63.6	176.8	0	0	0	107.3	L34 Y40 N44 P45	L34-L42 HydrophobicContact CD1-CB 3.86Å; L34-L42 HydrophobicContact CD1-CD1 3.73Å; L34-L42 HydrophobicContact CD1-CG 3.95Å; Y40-L42 PolarHBondContact O-N 3.29Å; L42-N44 PolarHBondContact O-N 3.03Å; L42-P45 HydrophobicContact CB-CB 4.44Å
43	I	64.1	Low	68.5	Low	122 Å²	122	92 Å²	92	63%	0.626	47%	0.469	S	S	*	.	B	Isolated β-bridge	trans	-74	114.7	167.6	-58.5	175.5	0	0	0	105.6	S41	S41-I43 PolarHBondContact O-N 3.11Å
44	N	71.9	Confident	69.9	Low	43 Å²	43	88.1 Å²	88.1	23%	0.23	46%	0.462	C	S	.	.	S	Bend	trans	66.1	61.6	170.6	-157.4	26.6	0	0	0	113.7	A32 L42 Q122 R126	A32-N44 PolarHBondContact O-N 3.39Å; L42-N44 PolarHBondContact O-N 3.03Å; N44-Q122 PolarHBondContact ND2-OE1 2.99Å; N44-R126 PolarHBondContact OD1-NH1 3.34Å; N44-R126 PolarHBondContact OD1-NH2 3.38Å
45	P	82.1	Confident	71.6	Confident	6 Å²	6	91.3 Å²	91.3	4%	0.039	47%	0.474	C	S	.	.			trans	-58.1	144.1	-179.1	26	-34.2	0	0	0	111.8	A32 L42 T89 V92 I93 R126	A32-P45 HydrophobicContact CB-CG 3.76Å; L42-P45 HydrophobicContact CB-CB 4.44Å; P45-T89 HydrophobicContact CB-CG2 3.83Å; P45-V92 HydrophobicContact CG-CG1 3.89Å; P45-I93 HydrophobicContact CB-CG1 4.14Å; P45-I93 HydrophobicContact CG-CG1 4.06Å; P45-R126 PolarHBondContact O-NH2 2.64Å
46	T	85	Confident	73.5	Confident	11 Å²	11	85.8 Å²	85.8	7%	0.067	45%	0.446	C	S	.	.			trans	-134	135.7	175.1	-47.2	0	0	0	0	105.7	L48 H49 T89 Q122 E125	T46-L48 WeakPolarHBondContact CG2-O 3.34Å; T46-H49 PolarHBondContact O-NE2 3.4Å; T46-T89 WeakPolarHBondContact O-CG2 3.43Å; T46-Q122 HydrophobicContact CG2-CG 4.13Å; T46-Q122 WeakPolarHBondContact OG1-CG 3.49Å; T46-Q122 PolarHBondContact OG1-NE2 3.01Å; T46-E125 WeakPolarHBondContact CA-OE2 3.16Å; T46-E125 WeakPolarHBondContact CG2-OE2 3.16Å
47	F	88.4	Confident	75.6	Confident	6 Å²	6	76.7 Å²	76.7	3%	0.026	41%	0.407	C	S	.	.	S	Bend	trans	-95.4	-41	179.3	171.3	-87	0	0	0	110.6	H49 D53 L56 L57 S86 V87 T89 L90 I93 E125	F47-H49 PolarHBondContact O-N 3.42Å; F47-D53 HydrophobicContact CE1-CB 4.37Å; F47-D53 WeakPolarHBondContact CE1-O 3.39Å; F47-L56 HydrophobicContact CE2-CD2 4.35Å; F47-L56 HydrophobicContact CZ-CB 4.36Å; F47-L56 HydrophobicContact CZ-CD2 3.85Å; F47-L56 HydrophobicContact CZ-CG 4.02Å; F47-L57 HydrophobicContact CD1-CB 4.43Å; F47-L57 HydrophobicContact CE1-CB 3.78Å; F47-L57 HydrophobicContact CE1-CD1 4.46Å; F47-S86 VanDerWaalsContact CD2-O 3.28Å; F47-S86 WeakPolarHBondContact CD2-O 3.46Å; F47-S86 WeakPolarHBondContact CE2-O 3.37Å; F47-V87 HydrophobicContact CE2-CG2 4.48Å; F47-T89 HydrophobicContact CB-CG2 4.5Å; F47-L90 HydrophobicContact CD2-CB 3.72Å; F47-L90 HydrophobicContact CE2-CB 4.08Å; F47-L90 HydrophobicContact CG-CB 4.25Å; F47-L90 HydrophobicContact CG-CD1 4.39Å; F47-I93 HydrophobicContact CB-CD1 3.81Å; F47-E125 VanDerWaalsContact CA-OE1 3.25Å; F47-E125 WeakPolarHBondContact CA-OE1 3.47Å; F47-E125 WeakPolarHBondContact CB-OE1 3.43Å; F47-E125 PolarHBondContact N-OE1 2.66Å; F47-E125 PolarHBondContact N-OE2 2.69Å
48	L	88	Confident	77.5	Confident	16 Å²	16	72.9 Å²	72.9	8%	0.084	40%	0.396	C	S	.	.			trans	-79.3	112	178.9	-61.7	175.1	0	0	0	110.4	T46 D53 A54 L57 W121 E125	T46-L48 WeakPolarHBondContact CG2-O 3.34Å; L48-D53 HydrophobicContact CD2-CB 4.18Å; L48-A54 HydrophobicContact CD2-CB 4.15Å; L48-L57 HydrophobicContact CD1-CD2 4.26Å; L48-L57 HydrophobicContact CD2-CB 4.25Å; L48-L57 HydrophobicContact CD2-CD2 4.05Å; L48-L57 HydrophobicContact CG-CD2 4.42Å; L48-W121 HydrophobicContact CB-CZ2 3.75Å; L48-W121 HydrophobicContact CD1-CZ2 4.38Å; L48-W121 PolarHBondContact O-NE1 3.12Å; L48-E125 HydrophobicContact CD1-CB 4.15Å; L48-E125 HydrophobicContact CD1-CG 3.96Å; L48-E125 HydrophobicContact CG-CG 4.25Å; L48-E125 WeakPolarHBondContact CG-OE1 3.5Å; L48-E125 PolarHBondContact N-OE1 3.13Å
49	H	86.5	Confident	79.6	Confident	139 Å²	139	73.4 Å²	73.4	64%	0.644	37%	0.374	S	S	*	.	S	Bend	trans	-124.1	-24.2	169.9	-65.8	-71.6	0	0	0	112.8	T46 F47 D53	T46-H49 PolarHBondContact O-NE2 3.4Å; F47-H49 PolarHBondContact O-N 3.42Å; H49-D53 WeakPolarHBondContact CA-OD2 3.31Å; H49-D53 WeakPolarHBondContact CB-OD2 3.32Å; H49-D53 PolarHBondContact N-OD2 3.24Å
50	S	87.1	Confident	81.6	Confident	46 Å²	46	70.4 Å²	70.4	32%	0.322	35%	0.35	S	S	.	.	S	Bend	trans	-137.8	179	178.8	79.1	0	0	0	0	113.2	E52 D53 A54	S50-E52 VanDerWaalsContact C-N 3.29Å; S50-E52 WeakPolarHBondContact CB-OE2 3.49Å; S50-E52 PolarHBondContact OG-N 2.93Å; S50-E52 PolarHBondContact OG-OE2 3.19Å; S50-D53 PolarHBondContact N-OD2 2.96Å; S50-D53 PolarHBondContact O-N 3.39Å; S50-D53 PolarHBondContact OG-N 3.42Å; S50-A54 PolarHBondContact O-N 3.46Å
51	E	88	Confident	83.7	Confident	125 Å²	125	62.6 Å²	62.6	58%	0.584	32%	0.323	S	S	*	.	H	α-helix	trans	-65.1	-35.3	172.7	-170.3	-171.8	142.7	0	0	111.4	D53 A54 K55	E51-D53 VanDerWaalsContact C-N 3.33Å; E51-D53 PolarHBondContact O-N 3.04Å; E51-A54 WeakPolarHBondContact O-CB 3.48Å; E51-A54 PolarHBondContact O-N 3.45Å; E51-K55 WeakPolarHBondContact O-CG 3.41Å; E51-K55 PolarHBondContact O-N 2.92Å; E51-K55 WeakPolarHBondContact OE1-CE 3.43Å; E51-K55 IonicContact OE1-NZ 2.69Å; E51-K55 PolarHBondContact OE1-NZ 2.98Å
52	E	89.4	Confident	85.5	Confident	121 Å²	121	64.6 Å²	64.6	57%	0.565	33%	0.327	S	S	*	.	H	α-helix	trans	-62.5	-40.7	175.7	-62.3	72.4	-156.5	0	0	111.4	S50 A54 K55 L56	S50-E52 VanDerWaalsContact C-N 3.29Å; S50-E52 WeakPolarHBondContact CB-OE2 3.49Å; S50-E52 PolarHBondContact OG-N 2.93Å; S50-E52 PolarHBondContact OG-OE2 3.19Å; E52-A54 VanDerWaalsContact C-N 3.3Å; E52-A54 PolarHBondContact O-N 3.28Å; E52-K55 PolarHBondContact O-N 3.21Å; E52-L56 WeakPolarHBondContact O-CB 3.32Å; E52-L56 PolarHBondContact O-N 3.13Å
53	D	88.8	Confident	87.2	Confident	35 Å²	35	62.2 Å²	62.2	19%	0.187	32%	0.318	C	S	.	.	H	α-helix	trans	-64.2	-37.9	174.6	-61.8	-36.6	0	0	0	111.3	F47 L48 H49 S50 E51 L56 L57	F47-D53 HydrophobicContact CE1-CB 4.37Å; F47-D53 WeakPolarHBondContact CE1-O 3.39Å; L48-D53 HydrophobicContact CD2-CB 4.18Å; H49-D53 WeakPolarHBondContact CA-OD2 3.31Å; H49-D53 WeakPolarHBondContact CB-OD2 3.32Å; H49-D53 PolarHBondContact N-OD2 3.24Å; S50-D53 PolarHBondContact N-OD2 2.96Å; S50-D53 PolarHBondContact O-N 3.39Å; S50-D53 PolarHBondContact OG-N 3.42Å; E51-D53 VanDerWaalsContact C-N 3.33Å; E51-D53 PolarHBondContact O-N 3.04Å; D53-L56 PolarHBondContact O-N 3.44Å; D53-L57 PolarHBondContact O-N 2.88Å
54	A	88.5	Confident	88.4	Confident	49 Å²	49	58 Å²	58	41%	0.405	31%	0.305	S	S	.	.	H	α-helix	trans	-65.1	-40.6	175.9	0	0	0	0	0	112.1	L48 S50 E51 E52 L57 F58	L48-A54 HydrophobicContact CD2-CB 4.15Å; S50-A54 PolarHBondContact O-N 3.46Å; E51-A54 WeakPolarHBondContact O-CB 3.48Å; E51-A54 PolarHBondContact O-N 3.45Å; E52-A54 VanDerWaalsContact C-N 3.3Å; E52-A54 PolarHBondContact O-N 3.28Å; A54-L57 PolarHBondContact O-N 3.31Å; A54-F58 PolarHBondContact O-N 3.34Å
55	K	88.8	Confident	89.4	Confident	105 Å²	105	56 Å²	56	46%	0.457	30%	0.295	S	S	.	.	H	α-helix	trans	-62.1	-45.2	172.8	-71.9	171.3	-175.9	160.9	0	111	E51 E52 L57 F58 E59	E51-K55 WeakPolarHBondContact O-CG 3.41Å; E51-K55 PolarHBondContact O-N 2.92Å; E51-K55 WeakPolarHBondContact OE1-CE 3.43Å; E51-K55 IonicContact OE1-NZ 2.69Å; E51-K55 PolarHBondContact OE1-NZ 2.98Å; E52-K55 PolarHBondContact O-N 3.21Å; K55-L57 PolarHBondContact O-N 2.83Å; K55-F58 WeakPolarHBondContact O-CB 3.42Å; K55-F58 PolarHBondContact O-N 3.03Å; K55-F58 VanDerWaalsContact O-N 3.14Å; K55-E59 WeakPolarHBondContact O-CG 3.23Å; K55-E59 PolarHBondContact O-N 3.15Å
56	L	91.5	Very high	89.9	Confident	23 Å²	23	59.6 Å²	59.6	12%	0.12	31%	0.311	C	S	.	.	H	α-helix	trans	-62.6	-42.3	177.5	-178.8	60.9	0	0	0	112	F47 E52 D53 F58 E59 V60 L81 L84 S86 V87	F47-L56 HydrophobicContact CE2-CD2 4.35Å; F47-L56 HydrophobicContact CZ-CB 4.36Å; F47-L56 HydrophobicContact CZ-CD2 3.85Å; F47-L56 HydrophobicContact CZ-CG 4.02Å; E52-L56 WeakPolarHBondContact O-CB 3.32Å; E52-L56 PolarHBondContact O-N 3.13Å; D53-L56 PolarHBondContact O-N 3.44Å; L56-F58 VanDerWaalsContact C-N 3.27Å; L56-F58 PolarHBondContact O-N 2.77Å; L56-E59 PolarHBondContact O-N 2.88Å; L56-V60 HydrophobicContact CD1-CG2 4.28Å; L56-V60 HydrophobicContact CG-CG2 4.46Å; L56-V60 WeakPolarHBondContact O-CB 3.47Å; L56-V60 VanDerWaalsContact O-CG2 3.27Å; L56-V60 WeakPolarHBondContact O-CG2 3.24Å; L56-V60 PolarHBondContact O-N 3.4Å; L56-L81 HydrophobicContact CD1-CD2 4.01Å; L56-L84 HydrophobicContact CD1-CD1 3.66Å; L56-L84 HydrophobicContact CD2-CD1 4.22Å; L56-S86 WeakPolarHBondContact CD2-OG 3.36Å; L56-V87 HydrophobicContact CD2-CG2 4.39Å
57	L	91.1	Very high	90.1	Very high	14 Å²	14	59.2 Å²	59.2	7%	0.073	31%	0.308	C	S	.	.	H	α-helix	trans	-59.3	-42.4	174.5	-177.5	58.6	0	0	0	111.1	F47 L48 D53 A54 K55 V60 L61 L90 L129	F47-L57 HydrophobicContact CD1-CB 4.43Å; F47-L57 HydrophobicContact CE1-CB 3.78Å; F47-L57 HydrophobicContact CE1-CD1 4.46Å; L48-L57 HydrophobicContact CD1-CD2 4.26Å; L48-L57 HydrophobicContact CD2-CB 4.25Å; L48-L57 HydrophobicContact CD2-CD2 4.05Å; L48-L57 HydrophobicContact CG-CD2 4.42Å; D53-L57 PolarHBondContact O-N 2.88Å; A54-L57 PolarHBondContact O-N 3.31Å; K55-L57 PolarHBondContact O-N 2.83Å; L57-V60 PolarHBondContact O-N 3.28Å; L57-L61 HydrophobicContact CD1-CD1 4.42Å; L57-L61 HydrophobicContact CD1-CG 4.41Å; L57-L61 HydrophobicContact CG-CD1 4.1Å; L57-L61 WeakPolarHBondContact O-CB 3.4Å; L57-L61 VanDerWaalsContact O-CG 3.23Å; L57-L61 WeakPolarHBondContact O-CG 2.95Å; L57-L61 PolarHBondContact O-N 3.38Å; L57-L90 HydrophobicContact CD1-CD1 4.18Å; L57-L90 HydrophobicContact CD1-CD2 3.89Å; L57-L129 HydrophobicContact CD1-CD2 4.13Å; L57-L129 HydrophobicContact CD2-CD2 4.46Å
58	F	90.5	Very high	89.8	Confident	131 Å²	131	61.1 Å²	61.1	58%	0.575	32%	0.317	S	S	*	.	H	α-helix	trans	-64	-43.1	177.8	179.3	-106.7	0	0	0	112.3	A54 K55 L56 L61 L62	A54-F58 PolarHBondContact O-N 3.34Å; K55-F58 WeakPolarHBondContact O-CB 3.42Å; K55-F58 PolarHBondContact O-N 3.03Å; K55-F58 VanDerWaalsContact O-N 3.14Å; L56-F58 VanDerWaalsContact C-N 3.27Å; L56-F58 PolarHBondContact O-N 2.77Å; F58-L61 PolarHBondContact O-N 3.27Å; F58-L62 HydrophobicContact CD1-CD1 3.7Å; F58-L62 HydrophobicContact CE1-CD1 3.17Å; F58-L62 HydrophobicContact CE1-CG 4.13Å; F58-L62 HydrophobicContact CE2-CD1 4.26Å; F58-L62 HydrophobicContact CE2-CG 4.38Å; F58-L62 HydrophobicContact CG-CD1 4.44Å; F58-L62 HydrophobicContact CZ-CD1 3.49Å; F58-L62 VanDerWaalsContact CZ-CD1 3.49Å; F58-L62 HydrophobicContact CZ-CG 4.04Å; F58-L62 WeakPolarHBondContact O-CB 3.13Å; F58-L62 PolarHBondContact O-N 3.3Å
59	E	93.6	Very high	89.1	Confident	101 Å²	101	61.7 Å²	61.7	47%	0.472	33%	0.327	S	S	.	.	H	α-helix	trans	-60.8	-46.3	174.1	-73.1	174	-168.5	0	0	111.8	K55 L56 L61 L62 A63	K55-E59 WeakPolarHBondContact O-CG 3.23Å; K55-E59 PolarHBondContact O-N 3.15Å; L56-E59 PolarHBondContact O-N 2.88Å; E59-L61 VanDerWaalsContact C-N 3.33Å; E59-L61 PolarHBondContact O-N 3.33Å; E59-L62 WeakPolarHBondContact O-CB 3.43Å; E59-L62 PolarHBondContact O-N 2.94Å; E59-A63 WeakPolarHBondContact O-CB 3.33Å; E59-A63 PolarHBondContact O-N 2.92Å
60	V	92.1	Very high	88	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59.1	-44.1	176.1	169.3	0	0	0	0	111.1	L56 L57 A63 M65 I76 L81 V87 L90	L56-V60 HydrophobicContact CD1-CG2 4.28Å; L56-V60 HydrophobicContact CG-CG2 4.46Å; L56-V60 WeakPolarHBondContact O-CB 3.47Å; L56-V60 VanDerWaalsContact O-CG2 3.27Å; L56-V60 WeakPolarHBondContact O-CG2 3.24Å; L56-V60 PolarHBondContact O-N 3.4Å; L57-V60 PolarHBondContact O-N 3.28Å; V60-A63 PolarHBondContact O-N 2.66Å; V60-M65 HydrophobicContact CG1-CB 3.63Å; V60-M65 HydrophobicContact CG1-CG 3.68Å; V60-M65 HydrophobicContact CG1-SD 3.74Å; V60-M65 WeakPolarHBondContact O-CB 3.4Å; V60-M65 PolarHBondContact O-N 3.4Å; V60-I76 HydrophobicContact CG1-CD1 3.69Å; V60-I76 HydrophobicContact CG1-CG1 3.97Å; V60-L81 HydrophobicContact CG2-CB 4.42Å; V60-L81 HydrophobicContact CG2-CD1 4.31Å; V60-V87 HydrophobicContact CG2-CG2 4.06Å; V60-L90 HydrophobicContact CG1-CD2 4.14Å
61	L	90.9	Very high	86.8	Confident	58 Å²	58	67.9 Å²	67.9	30%	0.304	35%	0.351	S	S	.	.	H	α-helix	trans	-63.9	-42.8	175.8	-70.9	169.8	0	0	0	112.2	L57 F58 E59 A63 G64 M65 V132	L57-L61 HydrophobicContact CD1-CD1 4.42Å; L57-L61 HydrophobicContact CD1-CG 4.41Å; L57-L61 HydrophobicContact CG-CD1 4.1Å; L57-L61 WeakPolarHBondContact O-CB 3.4Å; L57-L61 VanDerWaalsContact O-CG 3.23Å; L57-L61 WeakPolarHBondContact O-CG 2.95Å; L57-L61 PolarHBondContact O-N 3.38Å; F58-L61 PolarHBondContact O-N 3.27Å; E59-L61 VanDerWaalsContact C-N 3.33Å; E59-L61 PolarHBondContact O-N 3.33Å; L61-A63 VanDerWaalsContact C-N 3.32Å; L61-A63 PolarHBondContact O-N 2.99Å; L61-G64 PolarHBondContact O-N 3.4Å; L61-G64 VanDerWaalsContact O-N 3.15Å; L61-M65 HydrophobicContact CD2-CE 3.59Å; L61-M65 HydrophobicContact CD2-SD 3.9Å; L61-V132 HydrophobicContact CD2-CG1 3.73Å; L61-V132 HydrophobicContact CD2-CG2 4.24Å
62	L	92	Very high	85.5	Confident	123 Å²	123	70.1 Å²	70.1	64%	0.644	35%	0.354	S	S	*	.	H	α-helix	trans	-63.4	-36.2	176.4	-89.9	171.3	0	0	0	112.7	F58 E59 G64	F58-L62 HydrophobicContact CD1-CD1 3.7Å; F58-L62 HydrophobicContact CE1-CD1 3.17Å; F58-L62 HydrophobicContact CE1-CG 4.13Å; F58-L62 HydrophobicContact CE2-CD1 4.26Å; F58-L62 HydrophobicContact CE2-CG 4.38Å; F58-L62 HydrophobicContact CG-CD1 4.44Å; F58-L62 HydrophobicContact CZ-CD1 3.49Å; F58-L62 VanDerWaalsContact CZ-CD1 3.49Å; F58-L62 HydrophobicContact CZ-CG 4.04Å; F58-L62 WeakPolarHBondContact O-CB 3.13Å; F58-L62 PolarHBondContact O-N 3.3Å; E59-L62 WeakPolarHBondContact O-CB 3.43Å; E59-L62 PolarHBondContact O-N 2.94Å; L62-G64 PolarHBondContact O-N 3.45Å
63	A	92.9	Very high	84.7	Confident	32 Å²	32	67.2 Å²	67.2	26%	0.264	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	2.2	175.7	0	0	0	0	0	113.6	E59 V60 L61 P77 D78 L81	E59-A63 WeakPolarHBondContact O-CB 3.33Å; E59-A63 PolarHBondContact O-N 2.92Å; V60-A63 PolarHBondContact O-N 2.66Å; L61-A63 VanDerWaalsContact C-N 3.32Å; L61-A63 PolarHBondContact O-N 2.99Å; A63-P77 WeakPolarHBondContact O-CD 3.3Å; A63-D78 HydrophobicContact CB-CB 3.99Å; A63-L81 HydrophobicContact CB-CD1 3.6Å
64	G	89.8	Confident	84.6	Confident	33 Å²	33	66.5 Å²	66.5	34%	0.34	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	28.9	174.8	0	0	0	0	0	113.7	L61 L62 Q66 P77	L61-G64 PolarHBondContact O-N 3.4Å; L61-G64 VanDerWaalsContact O-N 3.15Å; L62-G64 PolarHBondContact O-N 3.45Å; G64-Q66 PolarHBondContact O-N 2.67Å; G64-P77 WeakPolarHBondContact O-CD 3.39Å
65	M	93	Very high	84.7	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.015	34%	0.341	C	S	.	.			trans	-52.9	128.4	174.2	-179.7	-144.9	90.8	0	0	111.6	V60 L61 I67 L74 L75 I76 L90 V132 Q136	V60-M65 HydrophobicContact CG1-CB 3.63Å; V60-M65 HydrophobicContact CG1-CG 3.68Å; V60-M65 HydrophobicContact CG1-SD 3.74Å; V60-M65 WeakPolarHBondContact O-CB 3.4Å; V60-M65 PolarHBondContact O-N 3.4Å; L61-M65 HydrophobicContact CD2-CE 3.59Å; L61-M65 HydrophobicContact CD2-SD 3.9Å; M65-I67 HydrophobicContact CE-CD1 3.81Å; M65-I67 HydrophobicContact CE-CG1 3.4Å; M65-I67 VanDerWaalsContact CE-CG1 3.4Å; M65-L74 HydrophobicContact CE-CD1 4Å; M65-L74 HydrophobicContact CG-CD1 3.56Å; M65-L74 HydrophobicContact CG-CG 4.24Å; M65-L74 HydrophobicContact SD-CD1 3.73Å; M65-L75 CarbonylContact C-O 3.48Å; M65-L75 VanDerWaalsContact CA-O 3.23Å; M65-L75 WeakPolarHBondContact CA-O 3.33Å; M65-I76 HydrophobicContact CB-CG1 4.18Å; M65-I76 HydrophobicContact CG-CG1 3.84Å; M65-L90 HydrophobicContact SD-CD2 4.08Å; M65-V132 HydrophobicContact CE-CG1 3.95Å; M65-Q136 PolarHBondContact O-NE2 2.99Å
66	Q	92	Very high	84.9	Confident	80 Å²	80	63.5 Å²	63.5	37%	0.374	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129	176	-65.8	-174.4	44.2	0	0	111.4	G64 L75	G64-Q66 PolarHBondContact O-N 2.67Å; Q66-L75 HydrophobicContact CB-CB 4.42Å; Q66-L75 PolarHBondContact N-O 3.38Å; Q66-L75 PolarHBondContact O-N 2.71Å
67	I	90.1	Very high	84.9	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.015	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	107.5	171.3	-53.8	-177.5	0	0	0	107.2	M65 L74 C94 L98 V132 Y133	M65-I67 HydrophobicContact CE-CD1 3.81Å; M65-I67 HydrophobicContact CE-CG1 3.4Å; M65-I67 VanDerWaalsContact CE-CG1 3.4Å; I67-L74 HydrophobicContact CG1-CD1 4.02Å; I67-C94 HydrophobicContact CG2-CB 4.47Å; I67-L98 HydrophobicContact CD1-CD1 4.11Å; I67-V132 HydrophobicContact CD1-CB 4.5Å; I67-V132 HydrophobicContact CD1-CG1 4.24Å; I67-Y133 HydrophobicContact CB-CD2 3.78Å; I67-Y133 HydrophobicContact CB-CG 4.43Å; I67-Y133 HydrophobicContact CG2-CD2 3.48Å; I67-Y133 VanDerWaalsContact CG2-CD2 3.48Å; I67-Y133 HydrophobicContact CG2-CE2 4.23Å; I67-Y133 HydrophobicContact CG2-CG 4.05Å; I67-Y133 WeakPolarHBondContact O-CD2 3.41Å
68	Q	82.1	Confident	85.1	Confident	46 Å²	46	68.7 Å²	68.7	22%	0.215	36%	0.356	C	S	.	.			trans	-82.1	164.4	178.9	-57.9	-173.4	38.6	0	0	111.5	R72 K100	Q68-R72 HydrophobicContact CB-CB 3.66Å; Q68-R72 HydrophobicContact CG-CB 4.35Å; Q68-K100 PolarHBondContact O-NZ 3.03Å; Q68-K100 VanDerWaalsContact O-NZ 3.12Å
69	G	71.6	Confident	85.2	Confident	28 Å²	28	70.5 Å²	70.5	29%	0.289	37%	0.366	S	S	.	.			trans	-68.7	-161.1	-178.8	0	0	0	0	0	114	E71 R72	G69-E71 PolarHBondContact O-N 3.12Å; G69-R72 PolarHBondContact O-N 3.36Å
70	E	64.5	Low	85.2	Confident	127 Å²	127	73.2 Å²	73.2	59%	0.593	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.8	-165.1	-53.1	-143.7	125.5	0	0	116.3	K100 K101	E70-K100 HydrophobicContact CG-CB 4.06Å; E70-K101 WeakPolarHBondContact OE1-CE 3.44Å; E70-K101 WeakPolarHBondContact OE1-CG 3.46Å; E70-K101 IonicContact OE1-NZ 3.86Å; E70-K101 WeakPolarHBondContact OE2-CE 3.43Å; E70-K101 IonicContact OE2-NZ 3.69Å
71	E	61.2	Low	85.3	Confident	188 Å²	188	74.3 Å²	74.3	88%	0.879	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	-4.1	-169.7	-63.3	-177.4	172	0	0	114.4	G69	G69-E71 PolarHBondContact O-N 3.12Å
72	R	61.7	Low	85.4	Confident	172 Å²	172	73.7 Å²	73.7	65%	0.649	39%	0.388	S	S	*	.	S	Bend	trans	-137.9	151.4	-168.2	-76.5	-171.1	-173.4	-172.8	1.8	115.2	Q68 G69	Q68-R72 HydrophobicContact CB-CB 3.66Å; Q68-R72 HydrophobicContact CG-CB 4.35Å; G69-R72 PolarHBondContact O-N 3.36Å
73	P	71.6	Confident	85.2	Confident	61 Å²	61	71.9 Å²	71.9	40%	0.396	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-72.3	168.1	-169.7	29.8	-37.1	0	0	0	113.8	L75 E95	P73-L75 PolarHBondContact O-N 2.96Å; P73-E95 WeakPolarHBondContact CA-OE1 3.38Å; P73-E95 WeakPolarHBondContact CB-OE1 3.3Å
74	L	87.4	Confident	85.2	Confident	19 Å²	19	73.3 Å²	73.3	10%	0.099	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	119.7	156.9	-175.7	67	0	0	0	108.9	M65 I67 I76 L90 E91 C94 E95	M65-L74 HydrophobicContact CE-CD1 4Å; M65-L74 HydrophobicContact CG-CD1 3.56Å; M65-L74 HydrophobicContact CG-CG 4.24Å; M65-L74 HydrophobicContact SD-CD1 3.73Å; I67-L74 HydrophobicContact CG1-CD1 4.02Å; L74-I76 HydrophobicContact CD2-CD1 4.01Å; L74-I76 HydrophobicContact CD2-CG1 4.49Å; L74-I76 HydrophobicContact CG-CD1 4.36Å; L74-I76 HydrophobicContact CG-CG1 4.31Å; L74-L90 HydrophobicContact CD2-CB 4.23Å; L74-L90 HydrophobicContact CD2-CD2 4.07Å; L74-L90 HydrophobicContact CD2-CG 3.83Å; L74-E91 HydrophobicContact CB-CG 4.38Å; L74-E91 HydrophobicContact CD2-CB 4.3Å; L74-C94 HydrophobicContact CB-CB 4.37Å; L74-C94 HydrophobicContact CD1-CB 4.13Å; L74-E95 PolarHBondContact N-OE1 3.08Å
75	L	91.1	Very high	85	Confident	74 Å²	74	82.1 Å²	82.1	39%	0.387	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	123.8	175.6	176	68.7	0	0	0	109.2	M65 Q66 P73	M65-L75 CarbonylContact C-O 3.48Å; M65-L75 VanDerWaalsContact CA-O 3.23Å; M65-L75 WeakPolarHBondContact CA-O 3.33Å; Q66-L75 HydrophobicContact CB-CB 4.42Å; Q66-L75 PolarHBondContact N-O 3.38Å; Q66-L75 PolarHBondContact O-N 2.71Å; P73-L75 PolarHBondContact O-N 2.96Å
76	I	92.4	Very high	84.5	Confident	18 Å²	18	84 Å²	84	9%	0.092	43%	0.425	C	S	.	.			trans	-121.2	110.1	170.9	-62.8	169.3	0	0	0	106.1	V60 M65 L74 D78 L81 A82 V87	V60-I76 HydrophobicContact CG1-CD1 3.69Å; V60-I76 HydrophobicContact CG1-CG1 3.97Å; M65-I76 HydrophobicContact CB-CG1 4.18Å; M65-I76 HydrophobicContact CG-CG1 3.84Å; L74-I76 HydrophobicContact CD2-CD1 4.01Å; L74-I76 HydrophobicContact CD2-CG1 4.49Å; L74-I76 HydrophobicContact CG-CD1 4.36Å; L74-I76 HydrophobicContact CG-CG1 4.31Å; I76-D78 HydrophobicContact CG2-CB 4.36Å; I76-D78 PolarHBondContact O-N 3.24Å; I76-L81 HydrophobicContact CG2-CB 4.01Å; I76-A82 HydrophobicContact CB-CB 4.13Å; I76-A82 HydrophobicContact CG2-CB 4.28Å; I76-V87 HydrophobicContact CD1-CG1 3.21Å
77	P	91.7	Very high	84.3	Confident	84 Å²	84	80.5 Å²	80.5	55%	0.545	41%	0.409	S	S	.	.	S	Bend	trans	-62.2	-29.9	-177.6	-25.8	35.1	0	0	0	114	A63 G64 E79	A63-P77 WeakPolarHBondContact O-CD 3.3Å; G64-P77 WeakPolarHBondContact O-CD 3.39Å; P77-E79 PolarHBondContact O-N 2.88Å
78	D	94.9	Very high	84.1	Confident	62 Å²	62	86.2 Å²	86.2	33%	0.332	43%	0.434	S	S	.	.			trans	-78.4	115.1	178.5	-172.3	-57.2	0	0	0	110.7	A63 I76 E80 L81 A82	A63-D78 HydrophobicContact CB-CB 3.99Å; I76-D78 HydrophobicContact CG2-CB 4.36Å; I76-D78 PolarHBondContact O-N 3.24Å; D78-E80 WeakPolarHBondContact OD1-CA 3.48Å; D78-E80 WeakPolarHBondContact OD1-CB 3.5Å; D78-E80 PolarHBondContact OD1-N 3.44Å; D78-L81 HydrophobicContact CB-CB 4.09Å; D78-L81 HydrophobicContact CB-CD1 3.98Å; D78-L81 HydrophobicContact CB-CG 4.14Å; D78-L81 PolarHBondContact OD1-N 2.93Å; D78-A82 VanDerWaalsContact O-CB 3.25Å; D78-A82 WeakPolarHBondContact O-CB 3.46Å; D78-A82 PolarHBondContact O-N 3.42Å
79	E	92.9	Very high	84.3	Confident	169 Å²	169	85.5 Å²	85.5	79%	0.79	43%	0.433	S	S	*	.	H	α-helix	trans	-69	-32.6	-176.4	-170.9	172.2	-170.2	0	0	112.5	P77 S83	P77-E79 PolarHBondContact O-N 2.88Å; E79-S83 WeakPolarHBondContact O-CB 3.29Å; E79-S83 PolarHBondContact O-N 3.18Å; E79-S83 VanDerWaalsContact O-N 3.08Å
80	E	93.9	Very high	85.2	Confident	158 Å²	158	84.2 Å²	84.2	74%	0.738	42%	0.419	S	S	*	.	H	α-helix	trans	-65.7	-50.3	177.4	-62.3	-169.6	168.6	0	0	109.6	D78 A82 S83	D78-E80 WeakPolarHBondContact OD1-CA 3.48Å; D78-E80 WeakPolarHBondContact OD1-CB 3.5Å; D78-E80 PolarHBondContact OD1-N 3.44Å; E80-A82 PolarHBondContact O-N 3.44Å; E80-S83 PolarHBondContact O-N 3.3Å; E80-S83 PolarHBondContact O-OG 3.42Å
81	L	94.5	Very high	86.3	Confident	22 Å²	22	81.1 Å²	81.1	12%	0.115	40%	0.404	C	S	.	.	H	α-helix	trans	-62.9	-42.5	176.8	-66.9	179.5	0	0	0	112.2	L56 V60 A63 I76 D78 S83 L84 V87	L56-L81 HydrophobicContact CD1-CD2 4.01Å; V60-L81 HydrophobicContact CG2-CB 4.42Å; V60-L81 HydrophobicContact CG2-CD1 4.31Å; A63-L81 HydrophobicContact CB-CD1 3.6Å; I76-L81 HydrophobicContact CG2-CB 4.01Å; D78-L81 HydrophobicContact CB-CB 4.09Å; D78-L81 HydrophobicContact CB-CD1 3.98Å; D78-L81 HydrophobicContact CB-CG 4.14Å; D78-L81 PolarHBondContact OD1-N 2.93Å; L81-S83 PolarHBondContact O-N 3.17Å; L81-L84 HydrophobicContact CD2-CD1 3.94Å; L81-L84 WeakPolarHBondContact O-CB 3.21Å; L81-L84 WeakPolarHBondContact O-CG 3.23Å; L81-L84 PolarHBondContact O-N 3.38Å; L81-V87 WeakPolarHBondContact O-CG2 3.17Å
82	A	91.3	Very high	87.4	Confident	46 Å²	46	73 Å²	73	38%	0.38	37%	0.368	S	S	.	.	H	α-helix	trans	-62.8	-28.5	179	0	0	0	0	0	112.8	I76 D78 E80 L84	I76-A82 HydrophobicContact CB-CB 4.13Å; I76-A82 HydrophobicContact CG2-CB 4.28Å; D78-A82 VanDerWaalsContact O-CB 3.25Å; D78-A82 WeakPolarHBondContact O-CB 3.46Å; D78-A82 PolarHBondContact O-N 3.42Å; E80-A82 PolarHBondContact O-N 3.44Å; A82-L84 VanDerWaalsContact C-N 3.3Å; A82-L84 PolarHBondContact O-N 2.85Å
83	S	89.4	Confident	88.7	Confident	84 Å²	84	64.8 Å²	64.8	59%	0.587	34%	0.337	S	S	*	.	H	α-helix	trans	-76.2	-16.4	179.6	79.6	0	0	0	0	113.9	E79 E80 L81 R85	E79-S83 WeakPolarHBondContact O-CB 3.29Å; E79-S83 PolarHBondContact O-N 3.18Å; E79-S83 VanDerWaalsContact O-N 3.08Å; E80-S83 PolarHBondContact O-N 3.3Å; E80-S83 PolarHBondContact O-OG 3.42Å; L81-S83 PolarHBondContact O-N 3.17Å; S83-R85 PolarHBondContact O-N 3.41Å
84	L	91.6	Very high	89.5	Confident	62 Å²	62	61.9 Å²	61.9	33%	0.325	32%	0.318	S	S	.	.			trans	-64	133.8	-174.4	-65.7	176.3	0	0	0	111.9	L56 L81 A82 S86 V87 K88	L56-L84 HydrophobicContact CD1-CD1 3.66Å; L56-L84 HydrophobicContact CD2-CD1 4.22Å; L81-L84 HydrophobicContact CD2-CD1 3.94Å; L81-L84 WeakPolarHBondContact O-CB 3.21Å; L81-L84 WeakPolarHBondContact O-CG 3.23Å; L81-L84 PolarHBondContact O-N 3.38Å; A82-L84 VanDerWaalsContact C-N 3.3Å; A82-L84 PolarHBondContact O-N 2.85Å; L84-S86 VanDerWaalsContact C-N 3.27Å; L84-S86 PolarHBondContact O-N 3.38Å; L84-V87 HydrophobicContact CB-CB 4.2Å; L84-V87 HydrophobicContact CB-CG2 3.87Å; L84-V87 HydrophobicContact CD1-CG2 4.31Å; L84-V87 WeakPolarHBondContact O-CB 3.48Å; L84-V87 PolarHBondContact O-N 3.17Å; L84-V87 VanDerWaalsContact O-N 3.12Å; L84-K88 PolarHBondContact O-N 2.87Å
85	R	85.5	Confident	89.5	Confident	219 Å²	219	64.5 Å²	64.5	83%	0.826	33%	0.33	S	S	*	.	H	α-helix	trans	-62.2	-35.5	178.5	-174	178.7	179.6	-177	0.2	112.4	S83 V87 K88	S83-R85 PolarHBondContact O-N 3.41Å; R85-V87 VanDerWaalsContact C-N 3.29Å; R85-V87 PolarHBondContact O-N 2.9Å; R85-K88 WeakPolarHBondContact O-CB 3.35Å; R85-K88 PolarHBondContact O-N 2.89Å
86	S	82.6	Confident	89.1	Confident	43 Å²	43	65 Å²	65	30%	0.301	33%	0.333	S	S	.	.	H	α-helix	trans	-60.7	-39.2	175.8	44.3	0	0	0	0	111.5	F47 L56 L84 K88 T89	F47-S86 VanDerWaalsContact CD2-O 3.28Å; F47-S86 WeakPolarHBondContact CD2-O 3.46Å; F47-S86 WeakPolarHBondContact CE2-O 3.37Å; L56-S86 WeakPolarHBondContact CD2-OG 3.36Å; L84-S86 VanDerWaalsContact C-N 3.27Å; L84-S86 PolarHBondContact O-N 3.38Å; S86-K88 VanDerWaalsContact C-N 3.28Å; S86-K88 PolarHBondContact O-N 3.49Å; S86-T89 WeakPolarHBondContact O-CB 3.41Å; S86-T89 PolarHBondContact O-N 2.86Å; S86-T89 VanDerWaalsContact O-N 3.13Å
87	V	88.1	Confident	88.9	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.03	33%	0.329	C	S	.	.	H	α-helix	trans	-68.5	-24.5	-179.5	173.1	0	0	0	0	112.8	F47 L56 V60 I76 L81 L84 R85 T89 L90 E91	F47-V87 HydrophobicContact CE2-CG2 4.48Å; L56-V87 HydrophobicContact CD2-CG2 4.39Å; V60-V87 HydrophobicContact CG2-CG2 4.06Å; I76-V87 HydrophobicContact CD1-CG1 3.21Å; L81-V87 WeakPolarHBondContact O-CG2 3.17Å; L84-V87 HydrophobicContact CB-CB 4.2Å; L84-V87 HydrophobicContact CB-CG2 3.87Å; L84-V87 HydrophobicContact CD1-CG2 4.31Å; L84-V87 WeakPolarHBondContact O-CB 3.48Å; L84-V87 PolarHBondContact O-N 3.17Å; L84-V87 VanDerWaalsContact O-N 3.12Å; R85-V87 VanDerWaalsContact C-N 3.29Å; R85-V87 PolarHBondContact O-N 2.9Å; V87-T89 PolarHBondContact O-N 3.31Å; V87-L90 WeakPolarHBondContact O-CA 3.5Å; V87-L90 VanDerWaalsContact O-CB 3.3Å; V87-L90 WeakPolarHBondContact O-CB 3.11Å; V87-L90 PolarHBondContact O-N 2.91Å; V87-E91 PolarHBondContact O-N 3.42Å
88	K	85.9	Confident	88.8	Confident	123 Å²	123	60.6 Å²	60.6	54%	0.535	31%	0.305	S	S	.	.	H	α-helix	trans	-60.1	-31.2	171.5	-62	-175	178.3	-177.4	0	112.7	L84 R85 S86 L90 V92	L84-K88 PolarHBondContact O-N 2.87Å; R85-K88 WeakPolarHBondContact O-CB 3.35Å; R85-K88 PolarHBondContact O-N 2.89Å; S86-K88 VanDerWaalsContact C-N 3.28Å; S86-K88 PolarHBondContact O-N 3.49Å; K88-L90 VanDerWaalsContact C-N 3.34Å; K88-V92 WeakPolarHBondContact O-CG2 3.1Å; K88-V92 PolarHBondContact O-N 2.9Å
89	T	87.3	Confident	88.6	Confident	32 Å²	32	58.7 Å²	58.7	20%	0.196	30%	0.296	C	S	.	.	H	α-helix	trans	-68.6	-37.5	173.9	-55.6	0	0	0	0	111.1	P45 T46 F47 S86 V87 V92 I93	P45-T89 HydrophobicContact CB-CG2 3.83Å; T46-T89 WeakPolarHBondContact O-CG2 3.43Å; F47-T89 HydrophobicContact CB-CG2 4.5Å; S86-T89 WeakPolarHBondContact O-CB 3.41Å; S86-T89 PolarHBondContact O-N 2.86Å; S86-T89 VanDerWaalsContact O-N 3.13Å; V87-T89 PolarHBondContact O-N 3.31Å; T89-V92 PolarHBondContact O-N 3.43Å; T89-I93 HydrophobicContact CG2-CD1 4.18Å; T89-I93 WeakPolarHBondContact O-CG1 3.48Å; T89-I93 PolarHBondContact O-N 3.36Å
90	L	88.9	Confident	88.4	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.7	-40.2	177	-174.1	62.6	0	0	0	111.7	F47 L57 V60 M65 L74 V87 K88 V92 I93 C94 L129	F47-L90 HydrophobicContact CD2-CB 3.72Å; F47-L90 HydrophobicContact CE2-CB 4.08Å; F47-L90 HydrophobicContact CG-CB 4.25Å; F47-L90 HydrophobicContact CG-CD1 4.39Å; L57-L90 HydrophobicContact CD1-CD1 4.18Å; L57-L90 HydrophobicContact CD1-CD2 3.89Å; V60-L90 HydrophobicContact CG1-CD2 4.14Å; M65-L90 HydrophobicContact SD-CD2 4.08Å; L74-L90 HydrophobicContact CD2-CB 4.23Å; L74-L90 HydrophobicContact CD2-CD2 4.07Å; L74-L90 HydrophobicContact CD2-CG 3.83Å; V87-L90 WeakPolarHBondContact O-CA 3.5Å; V87-L90 VanDerWaalsContact O-CB 3.3Å; V87-L90 WeakPolarHBondContact O-CB 3.11Å; V87-L90 PolarHBondContact O-N 2.91Å; K88-L90 VanDerWaalsContact C-N 3.34Å; L90-V92 VanDerWaalsContact C-N 3.33Å; L90-V92 PolarHBondContact O-N 3.43Å; L90-I93 PolarHBondContact O-N 3.42Å; L90-C94 VanDerWaalsContact O-CB 3.32Å; L90-C94 WeakPolarHBondContact O-CB 3.35Å; L90-C94 PolarHBondContact O-N 2.97Å; L90-C94 PolarHBondContact O-SG 2.79Å; L90-C94 VanDerWaalsContact O-SG 3.36Å; L90-L129 HydrophobicContact CD1-CD1 3.76Å; L90-L129 HydrophobicContact CD1-CD2 3.9Å
91	E	87.9	Confident	88.2	Confident	62 Å²	62	49 Å²	49	29%	0.29	25%	0.249	S	C	.	.	H	α-helix	trans	-53.7	-50.9	173.6	-172.3	-177.8	-179.2	0	0	110.5	L74 V87 I93 C94 E95	L74-E91 HydrophobicContact CB-CG 4.38Å; L74-E91 HydrophobicContact CD2-CB 4.3Å; V87-E91 PolarHBondContact O-N 3.42Å; E91-I93 PolarHBondContact O-N 2.89Å; E91-C94 PolarHBondContact O-N 3.37Å; E91-E95 WeakPolarHBondContact CG-OE1 3.3Å; E91-E95 WeakPolarHBondContact O-CB 3.48Å; E91-E95 VanDerWaalsContact O-CG 3.31Å; E91-E95 WeakPolarHBondContact O-CG 3.22Å; E91-E95 PolarHBondContact O-N 3.42Å
92	V	85.8	Confident	88.1	Confident	17 Å²	17	49.8 Å²	49.8	10%	0.103	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-43.7	178.6	175.1	0	0	0	0	112.4	A32 L34 P45 K88 T89 L90 C94 E95 D96	A32-V92 HydrophobicContact CB-CG1 4.02Å; L34-V92 HydrophobicContact CD1-CG1 4.09Å; L34-V92 HydrophobicContact CD1-CG2 3.91Å; L34-V92 HydrophobicContact CD2-CB 4.08Å; L34-V92 HydrophobicContact CD2-CG1 3.53Å; L34-V92 HydrophobicContact CD2-CG2 3.33Å; L34-V92 HydrophobicContact CG-CG1 3.71Å; L34-V92 HydrophobicContact CG-CG2 4.04Å; P45-V92 HydrophobicContact CG-CG1 3.89Å; K88-V92 WeakPolarHBondContact O-CG2 3.1Å; K88-V92 PolarHBondContact O-N 2.9Å; T89-V92 PolarHBondContact O-N 3.43Å; L90-V92 VanDerWaalsContact C-N 3.33Å; L90-V92 PolarHBondContact O-N 3.43Å; V92-C94 VanDerWaalsContact C-N 3.34Å; V92-E95 PolarHBondContact O-N 3.43Å; V92-D96 HydrophobicContact CG1-CB 4.49Å; V92-D96 WeakPolarHBondContact O-CB 3.4Å; V92-D96 PolarHBondContact O-N 3.05Å
93	I	88.5	Confident	88.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-60.8	-50.1	177.2	-66.9	165.4	0	0	0	109.1	P45 F47 T89 L90 E91 E95 V97 L98 R126 L129	P45-I93 HydrophobicContact CB-CG1 4.14Å; P45-I93 HydrophobicContact CG-CG1 4.06Å; F47-I93 HydrophobicContact CB-CD1 3.81Å; T89-I93 HydrophobicContact CG2-CD1 4.18Å; T89-I93 WeakPolarHBondContact O-CG1 3.48Å; T89-I93 PolarHBondContact O-N 3.36Å; L90-I93 PolarHBondContact O-N 3.42Å; E91-I93 PolarHBondContact O-N 2.89Å; I93-E95 VanDerWaalsContact C-N 3.31Å; I93-E95 PolarHBondContact O-N 3.5Å; I93-V97 HydrophobicContact CG2-CB 4.35Å; I93-V97 WeakPolarHBondContact O-CA 3.23Å; I93-V97 VanDerWaalsContact O-CB 3.24Å; I93-V97 WeakPolarHBondContact O-CB 3.32Å; I93-V97 PolarHBondContact O-N 3.3Å; I93-V97 VanDerWaalsContact O-N 3.08Å; I93-L98 HydrophobicContact CG2-CD2 4.15Å; I93-L98 HydrophobicContact CG2-CG 4.34Å; I93-L98 WeakPolarHBondContact O-CG 3.27Å; I93-L98 PolarHBondContact O-N 3.23Å; I93-L98 VanDerWaalsContact O-N 3.11Å; I93-R126 HydrophobicContact CG2-CG 4.32Å; I93-L129 HydrophobicContact CG2-CD1 3.61Å
94	C	88.7	Confident	88.2	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.007	24%	0.243	C	C	.	.	I	π-helix	trans	-62.7	-35	-178.2	-74.8	0	0	0	0	113.3	I67 L74 L90 E91 V92 L98 K100	I67-C94 HydrophobicContact CG2-CB 4.47Å; L74-C94 HydrophobicContact CB-CB 4.37Å; L74-C94 HydrophobicContact CD1-CB 4.13Å; L90-C94 VanDerWaalsContact O-CB 3.32Å; L90-C94 WeakPolarHBondContact O-CB 3.35Å; L90-C94 PolarHBondContact O-N 2.97Å; L90-C94 PolarHBondContact O-SG 2.79Å; L90-C94 VanDerWaalsContact O-SG 3.36Å; E91-C94 PolarHBondContact O-N 3.37Å; V92-C94 VanDerWaalsContact C-N 3.34Å; C94-L98 HydrophobicContact CB-CD1 4.4Å; C94-K100 WeakPolarHBondContact O-CE 3.42Å; C94-K100 PolarHBondContact O-NZ 2.94Å
95	E	86.4	Confident	88.2	Confident	73 Å²	73	46.4 Å²	46.4	34%	0.341	23%	0.228	S	C	.	.	I	π-helix	trans	-88.4	-49.8	-176.7	-69.8	-179.5	-171.8	0	0	112.9	P73 L74 E91 V92 I93	P73-E95 WeakPolarHBondContact CA-OE1 3.38Å; P73-E95 WeakPolarHBondContact CB-OE1 3.3Å; L74-E95 PolarHBondContact N-OE1 3.08Å; E91-E95 WeakPolarHBondContact CG-OE1 3.3Å; E91-E95 WeakPolarHBondContact O-CB 3.48Å; E91-E95 VanDerWaalsContact O-CG 3.31Å; E91-E95 WeakPolarHBondContact O-CG 3.22Å; E91-E95 PolarHBondContact O-N 3.42Å; V92-E95 PolarHBondContact O-N 3.43Å; I93-E95 VanDerWaalsContact C-N 3.31Å; I93-E95 PolarHBondContact O-N 3.5Å
96	D	83.4	Confident	88.6	Confident	86 Å²	86	41.1 Å²	41.1	46%	0.46	21%	0.208	S	C	.	.	I	π-helix	trans	-99	-17.9	-168	-66.5	-43.6	0	0	0	113.6	A32 V92	A32-D96 HydrophobicContact CB-CB 3.88Å; V92-D96 HydrophobicContact CG1-CB 4.49Å; V92-D96 WeakPolarHBondContact O-CB 3.4Å; V92-D96 PolarHBondContact O-N 3.05Å
97	V	87.2	Confident	89	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.012	22%	0.22	C	C	.	.	I	π-helix	trans	-107.3	-44.2	-175.1	-175.2	0	0	0	0	113	Y29 P30 A32 I93 R126	Y29-V97 HydrophobicContact CD1-CG1 4.3Å; Y29-V97 HydrophobicContact CG-CG1 4.44Å; P30-V97 WeakPolarHBondContact CD-O 3.04Å; P30-V97 WeakPolarHBondContact CG-O 3.19Å; A32-V97 HydrophobicContact CB-CG2 3.22Å; I93-V97 HydrophobicContact CG2-CB 4.35Å; I93-V97 WeakPolarHBondContact O-CA 3.23Å; I93-V97 VanDerWaalsContact O-CB 3.24Å; I93-V97 WeakPolarHBondContact O-CB 3.32Å; I93-V97 PolarHBondContact O-N 3.3Å; I93-V97 VanDerWaalsContact O-N 3.08Å; V97-R126 HydrophobicContact CG1-CG 4.08Å
98	L	90.3	Very high	89.2	Confident	7 Å²	7	46.1 Å²	46.1	4%	0.037	22%	0.22	C	C	.	.	S	Bend	trans	-73.4	135.3	-170	-59.6	-174.5	0	0	0	112	Y29 I67 I93 C94 K100 R126 L129	Y29-L98 HydrophobicContact CE1-CD2 4.37Å; I67-L98 HydrophobicContact CD1-CD1 4.11Å; I93-L98 HydrophobicContact CG2-CD2 4.15Å; I93-L98 HydrophobicContact CG2-CG 4.34Å; I93-L98 WeakPolarHBondContact O-CG 3.27Å; I93-L98 PolarHBondContact O-N 3.23Å; I93-L98 VanDerWaalsContact O-N 3.11Å; C94-L98 HydrophobicContact CB-CD1 4.4Å; L98-K100 PolarHBondContact O-N 3.27Å; L98-R126 HydrophobicContact CD2-CB 4.06Å; L98-R126 HydrophobicContact CD2-CG 4.31Å; L98-L129 HydrophobicContact CD1-CB 3.58Å; L98-L129 HydrophobicContact CD2-CB 4.07Å; L98-L129 HydrophobicContact CG-CB 4.46Å
99	P	90.8	Very high	89.5	Confident	21 Å²	21	40.5 Å²	40.5	14%	0.136	20%	0.196	C	C	.	.			trans	-66.4	128.2	173.4	28.1	-33.6	0	0	0	110.7	Y29 D104 I105 L108 T130	Y29-P99 HydrophobicContact CE1-CG 4.24Å; P99-D104 HydrophobicContact CB-CB 3.82Å; P99-I105 HydrophobicContact CB-CG1 3.9Å; P99-I105 HydrophobicContact CG-CG1 3.86Å; P99-L108 HydrophobicContact CG-CD2 4.14Å; P99-T130 HydrophobicContact CG-CG2 4.01Å
100	K	89	Confident	89.7	Confident	26 Å²	26	41.5 Å²	41.5	11%	0.113	21%	0.207	C	C	.	.			trans	-99.6	-28.4	178.7	-56.1	-61.4	-179.3	159.6	0	113.6	Q68 E70 C94 L98 Y133	Q68-K100 PolarHBondContact O-NZ 3.03Å; Q68-K100 VanDerWaalsContact O-NZ 3.12Å; E70-K100 HydrophobicContact CG-CB 4.06Å; C94-K100 WeakPolarHBondContact O-CE 3.42Å; C94-K100 PolarHBondContact O-NZ 2.94Å; L98-K100 PolarHBondContact O-N 3.27Å; K100-Y133 HydrophobicContact CD-CE1 4.18Å; K100-Y133 HydrophobicContact CD-CE2 4.15Å; K100-Y133 PolarHBondContact O-OH 2.87Å; K100-Y133 VanDerWaalsContact O-OH 3.09Å
101	K	89.9	Confident	89.8	Confident	99 Å²	99	44.2 Å²	44.2	43%	0.43	22%	0.219	S	C	.	.	S	Bend	trans	-83.6	137.7	179.1	-54.4	-173.4	179.9	-175.2	0	111	E70 S103 D104 I105	E70-K101 WeakPolarHBondContact OE1-CE 3.44Å; E70-K101 WeakPolarHBondContact OE1-CG 3.46Å; E70-K101 IonicContact OE1-NZ 3.86Å; E70-K101 WeakPolarHBondContact OE2-CE 3.43Å; E70-K101 IonicContact OE2-NZ 3.69Å; K101-S103 PolarHBondContact O-N 2.92Å; K101-D104 HydrophobicContact CB-CB 4.34Å; K101-D104 WeakPolarHBondContact CB-OD2 3.43Å; K101-D104 WeakPolarHBondContact O-CB 3.15Å; K101-D104 PolarHBondContact O-N 2.96Å; K101-I105 WeakPolarHBondContact O-CG1 3.23Å; K101-I105 PolarHBondContact O-N 3.11Å
102	L	91.1	Very high	90	Very high	37 Å²	37	41.5 Å²	41.5	19%	0.194	21%	0.206	C	C	.	.	H	α-helix	trans	-52.7	-39.9	172.8	179.2	61.4	0	0	0	112.1	D104 I105 R106 L149 W150 T153	L102-D104 VanDerWaalsContact C-N 3.31Å; L102-D104 PolarHBondContact O-N 3.36Å; L102-I105 PolarHBondContact O-N 2.86Å; L102-R106 HydrophobicContact CD1-CG 4.13Å; L102-R106 HydrophobicContact CG-CG 4.37Å; L102-R106 WeakPolarHBondContact O-CB 3.4Å; L102-R106 VanDerWaalsContact O-CG 3.31Å; L102-R106 WeakPolarHBondContact O-CG 3.36Å; L102-R106 PolarHBondContact O-N 3.42Å; L102-L149 HydrophobicContact CD2-CB 3.99Å; L102-L149 HydrophobicContact CD2-CD1 4.34Å; L102-W150 HydrophobicContact CB-CZ2 3.87Å; L102-W150 HydrophobicContact CD1-CD2 3.94Å; L102-W150 HydrophobicContact CD1-CE3 4.29Å; L102-W150 HydrophobicContact CD1-CG 4.28Å; L102-W150 HydrophobicContact CD1-CZ2 4.34Å; L102-T153 HydrophobicContact CD1-CG2 4.41Å; L102-T153 WeakPolarHBondContact CD1-OG1 3.44Å
103	S	91	Very high	90.1	Very high	77 Å²	77	44.3 Å²	44.3	54%	0.538	23%	0.231	S	C	.	.	H	α-helix	trans	-61.2	-38.6	176.7	53.2	0	0	0	0	113	K101 R107	K101-S103 PolarHBondContact O-N 2.92Å; S103-R107 WeakPolarHBondContact O-CB 3.43Å; S103-R107 PolarHBondContact O-N 3.36Å
104	D	91.5	Very high	90.1	Very high	44 Å²	44	51.9 Å²	51.9	24%	0.235	27%	0.267	C	S	.	.	H	α-helix	trans	-72.9	-38.9	179.1	-67.4	-40	0	0	0	111.1	P99 K101 L102 R107 L108	P99-D104 HydrophobicContact CB-CB 3.82Å; K101-D104 HydrophobicContact CB-CB 4.34Å; K101-D104 WeakPolarHBondContact CB-OD2 3.43Å; K101-D104 WeakPolarHBondContact O-CB 3.15Å; K101-D104 PolarHBondContact O-N 2.96Å; L102-D104 VanDerWaalsContact C-N 3.31Å; L102-D104 PolarHBondContact O-N 3.36Å; D104-R107 PolarHBondContact O-N 3.48Å; D104-R107 IonicContact OD1-CZ 3.25Å; D104-R107 VanDerWaalsContact OD1-CZ 3.25Å; D104-R107 IonicContact OD1-NH1 3.4Å; D104-R107 PolarHBondContact OD1-NH1 2.84Å; D104-R107 IonicContact OD1-NH2 2.67Å; D104-R107 PolarHBondContact OD1-NH2 2.84Å; D104-L108 WeakPolarHBondContact O-CB 3.36Å; D104-L108 PolarHBondContact O-N 2.87Å
105	I	93.1	Very high	90.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.1	-43.7	175	-57.1	169.5	0	0	0	110.6	P99 K101 L102 R107 L108 M109 T130 Y133 W150 T153 L157	P99-I105 HydrophobicContact CB-CG1 3.9Å; P99-I105 HydrophobicContact CG-CG1 3.86Å; K101-I105 WeakPolarHBondContact O-CG1 3.23Å; K101-I105 PolarHBondContact O-N 3.11Å; L102-I105 PolarHBondContact O-N 2.86Å; I105-R107 VanDerWaalsContact C-N 3.3Å; I105-R107 PolarHBondContact O-N 3.15Å; I105-L108 CarbonylContact O-C 3.57Å; I105-L108 WeakPolarHBondContact O-CA 3.47Å; I105-L108 VanDerWaalsContact O-CB 3.32Å; I105-L108 WeakPolarHBondContact O-CB 3.32Å; I105-L108 PolarHBondContact O-N 3.44Å; I105-L108 VanDerWaalsContact O-N 3.13Å; I105-M109 HydrophobicContact CG2-CE 4.14Å; I105-M109 WeakPolarHBondContact O-CG 3.4Å; I105-M109 PolarHBondContact O-N 2.82Å; I105-T130 HydrophobicContact CG1-CG2 4.3Å; I105-T130 HydrophobicContact CG2-CG2 4.15Å; I105-Y133 HydrophobicContact CD1-CD1 4.2Å; I105-Y133 HydrophobicContact CD1-CE1 4.08Å; I105-W150 HydrophobicContact CD1-CH2 3.49Å; I105-W150 VanDerWaalsContact CD1-CH2 3.49Å; I105-W150 HydrophobicContact CD1-CZ3 3.47Å; I105-W150 VanDerWaalsContact CD1-CZ3 3.47Å; I105-T153 HydrophobicContact CB-CG2 4.16Å; I105-T153 HydrophobicContact CG2-CG2 3.28Å; I105-L157 HydrophobicContact CG2-CD1 4.16Å
106	R	92.7	Very high	90.1	Very high	108 Å²	108	61 Å²	61	41%	0.408	30%	0.298	S	S	.	.	H	α-helix	trans	-61.9	-38.5	175	-70.6	-176.9	82.1	157.8	14.5	112	L102 M109 A110 E152	L102-R106 HydrophobicContact CD1-CG 4.13Å; L102-R106 HydrophobicContact CG-CG 4.37Å; L102-R106 WeakPolarHBondContact O-CB 3.4Å; L102-R106 VanDerWaalsContact O-CG 3.31Å; L102-R106 WeakPolarHBondContact O-CG 3.36Å; L102-R106 PolarHBondContact O-N 3.42Å; R106-M109 WeakPolarHBondContact O-CB 3.31Å; R106-M109 PolarHBondContact O-N 2.84Å; R106-A110 PolarHBondContact O-N 2.81Å; R106-E152 IonicContact NH2-OE2 3.69Å
107	R	91.3	Very high	90.2	Very high	148 Å²	148	67 Å²	67	56%	0.558	31%	0.314	S	S	*	.	H	α-helix	trans	-64.4	-41	173.2	-176.6	176.4	65.5	-144.6	-5.7	111.7	S103 D104 I105 M109 A110 K111	S103-R107 WeakPolarHBondContact O-CB 3.43Å; S103-R107 PolarHBondContact O-N 3.36Å; D104-R107 PolarHBondContact O-N 3.48Å; D104-R107 IonicContact OD1-CZ 3.25Å; D104-R107 VanDerWaalsContact OD1-CZ 3.25Å; D104-R107 IonicContact OD1-NH1 3.4Å; D104-R107 PolarHBondContact OD1-NH1 2.84Å; D104-R107 IonicContact OD1-NH2 2.67Å; D104-R107 PolarHBondContact OD1-NH2 2.84Å; I105-R107 VanDerWaalsContact C-N 3.3Å; I105-R107 PolarHBondContact O-N 3.15Å; R107-M109 VanDerWaalsContact C-N 3.31Å; R107-A110 PolarHBondContact O-N 3.17Å; R107-K111 PolarHBondContact O-N 3.07Å
108	L	93.1	Very high	90.2	Very high	6 Å²	6	71.4 Å²	71.4	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-59.1	-43.8	171.6	169.9	73	0	0	0	110.4	L28 Y29 P99 D104 I105 A110 K111 L112 T130	L28-L108 HydrophobicContact CB-CD1 4.25Å; L28-L108 HydrophobicContact CD2-CD1 4.36Å; Y29-L108 HydrophobicContact CD2-CD1 4.42Å; Y29-L108 HydrophobicContact CE1-CD1 4.38Å; Y29-L108 HydrophobicContact CE1-CD2 3.88Å; Y29-L108 HydrophobicContact CE2-CD1 3.86Å; Y29-L108 HydrophobicContact CE2-CD2 4.41Å; Y29-L108 WeakPolarHBondContact OH-CD2 3.19Å; P99-L108 HydrophobicContact CG-CD2 4.14Å; D104-L108 WeakPolarHBondContact O-CB 3.36Å; D104-L108 PolarHBondContact O-N 2.87Å; I105-L108 CarbonylContact O-C 3.57Å; I105-L108 WeakPolarHBondContact O-CA 3.47Å; I105-L108 VanDerWaalsContact O-CB 3.32Å; I105-L108 WeakPolarHBondContact O-CB 3.32Å; I105-L108 PolarHBondContact O-N 3.44Å; I105-L108 VanDerWaalsContact O-N 3.13Å; L108-A110 VanDerWaalsContact C-N 3.34Å; L108-A110 PolarHBondContact O-N 3.38Å; L108-K111 WeakPolarHBondContact O-CB 3.44Å; L108-K111 PolarHBondContact O-N 2.88Å; L108-L112 HydrophobicContact CD1-CD1 4.27Å; L108-L112 HydrophobicContact CD1-CD2 4.44Å; L108-L112 HydrophobicContact CD1-CG 4.15Å; L108-L112 HydrophobicContact CD2-CD1 4.43Å; L108-L112 HydrophobicContact CG-CD1 3.99Å; L108-L112 HydrophobicContact CG-CG 4.25Å; L108-L112 WeakPolarHBondContact O-CG 3.5Å; L108-L112 PolarHBondContact O-N 3.33Å; L108-T130 HydrophobicContact CD2-CG2 4.21Å
109	M	92.6	Very high	90.2	Very high	5 Å²	5	72.1 Å²	72.1	3%	0.025	35%	0.346	C	S	.	.	H	α-helix	trans	-61.4	-42.9	-179.8	-69.5	-47.1	99.7	0	0	111.9	I105 R106 R107 K111 L112 A113 T153 Q156 L157	I105-M109 HydrophobicContact CG2-CE 4.14Å; I105-M109 WeakPolarHBondContact O-CG 3.4Å; I105-M109 PolarHBondContact O-N 2.82Å; R106-M109 WeakPolarHBondContact O-CB 3.31Å; R106-M109 PolarHBondContact O-N 2.84Å; R107-M109 VanDerWaalsContact C-N 3.31Å; M109-K111 VanDerWaalsContact C-N 3.25Å; M109-K111 PolarHBondContact O-N 3.47Å; M109-L112 HydrophobicContact CE-CD1 3.51Å; M109-L112 PolarHBondContact O-N 3.26Å; M109-L112 VanDerWaalsContact O-N 3.17Å; M109-L112 HydrophobicContact SD-CD1 4.1Å; M109-A113 WeakPolarHBondContact O-CB 3.15Å; M109-A113 PolarHBondContact O-N 3.08Å; M109-T153 HydrophobicContact CG-CG2 4.28Å; M109-Q156 VanDerWaalsContact CB-OE1 3.31Å; M109-Q156 HydrophobicContact CG-CB 4.03Å; M109-Q156 HydrophobicContact SD-CB 3.92Å; M109-L157 HydrophobicContact CE-CD1 4.46Å; M109-L157 HydrophobicContact CE-CD2 3.22Å; M109-L157 HydrophobicContact CE-CG 3.6Å; M109-L157 HydrophobicContact SD-CB 4.42Å; M109-L157 HydrophobicContact SD-CD2 3.86Å; M109-L157 HydrophobicContact SD-CG 3.65Å
110	A	90.8	Very high	90	Very high	52 Å²	52	73.2 Å²	73.2	43%	0.43	36%	0.361	S	S	.	.	H	α-helix	trans	-58.1	-38.8	175	0	0	0	0	0	112.1	R106 R107 L108 Q114	R106-A110 PolarHBondContact O-N 2.81Å; R107-A110 PolarHBondContact O-N 3.17Å; L108-A110 VanDerWaalsContact C-N 3.34Å; L108-A110 PolarHBondContact O-N 3.38Å; A110-Q114 WeakPolarHBondContact O-CG 3.44Å; A110-Q114 PolarHBondContact O-N 3.37Å
111	K	90.8	Very high	89.7	Confident	58 Å²	58	78.9 Å²	78.9	25%	0.252	38%	0.382	S	S	.	.	H	α-helix	trans	-69.3	-43.5	174.9	-63.2	177.7	-177.3	176.4	0	112.1	A27 L28 R107 L108 M109 A113 Q114 R115	A27-K111 PolarHBondContact O-NZ 2.81Å; L28-K111 HydrophobicContact CD2-CB 3.55Å; L28-K111 HydrophobicContact CD2-CD 4.04Å; L28-K111 HydrophobicContact CD2-CG 4.49Å; R107-K111 PolarHBondContact O-N 3.07Å; L108-K111 WeakPolarHBondContact O-CB 3.44Å; L108-K111 PolarHBondContact O-N 2.88Å; M109-K111 VanDerWaalsContact C-N 3.25Å; M109-K111 PolarHBondContact O-N 3.47Å; K111-A113 VanDerWaalsContact C-N 3.34Å; K111-A113 PolarHBondContact O-N 2.65Å; K111-Q114 PolarHBondContact O-N 3.45Å; K111-R115 PolarHBondContact O-N 2.78Å
112	L	91.3	Very high	89.6	Confident	4 Å²	4	77.4 Å²	77.4	2%	0.021	38%	0.377	C	S	.	.	H	α-helix	trans	-64.1	-39	179.1	-66.4	176.4	0	0	0	111.5	L28 L108 M109 Q114 R115 L119 T127 A160	L28-L112 HydrophobicContact CD1-CD2 3.94Å; L28-L112 HydrophobicContact CD2-CD2 3.98Å; L108-L112 HydrophobicContact CD1-CD1 4.27Å; L108-L112 HydrophobicContact CD1-CD2 4.44Å; L108-L112 HydrophobicContact CD1-CG 4.15Å; L108-L112 HydrophobicContact CD2-CD1 4.43Å; L108-L112 HydrophobicContact CG-CD1 3.99Å; L108-L112 HydrophobicContact CG-CG 4.25Å; L108-L112 WeakPolarHBondContact O-CG 3.5Å; L108-L112 PolarHBondContact O-N 3.33Å; M109-L112 HydrophobicContact CE-CD1 3.51Å; M109-L112 PolarHBondContact O-N 3.26Å; M109-L112 VanDerWaalsContact O-N 3.17Å; M109-L112 HydrophobicContact SD-CD1 4.1Å; L112-Q114 VanDerWaalsContact C-N 3.29Å; L112-Q114 PolarHBondContact O-N 2.86Å; L112-R115 WeakPolarHBondContact O-CB 3.36Å; L112-R115 WeakPolarHBondContact O-CD 3.46Å; L112-R115 WeakPolarHBondContact O-CG 3.46Å; L112-R115 PolarHBondContact O-N 3.36Å; L112-L119 HydrophobicContact CD2-CD1 4.23Å; L112-L119 HydrophobicContact CD2-CD2 3.68Å; L112-T127 HydrophobicContact CD1-CG2 3.99Å; L112-A160 HydrophobicContact CB-CB 4.32Å; L112-A160 HydrophobicContact CD1-CB 3.96Å
113	A	89.5	Confident	89.6	Confident	76 Å²	76	77.6 Å²	77.6	63%	0.628	38%	0.378	S	S	*	.	H	α-helix	trans	-62.5	-35.4	177.2	0	0	0	0	0	112.6	M109 K111 R115	M109-A113 WeakPolarHBondContact O-CB 3.15Å; M109-A113 PolarHBondContact O-N 3.08Å; K111-A113 VanDerWaalsContact C-N 3.34Å; K111-A113 PolarHBondContact O-N 2.65Å; A113-R115 VanDerWaalsContact C-N 3.28Å; A113-R115 PolarHBondContact O-N 3.11Å
114	Q	88.5	Confident	89.5	Confident	160 Å²	160	75.5 Å²	75.5	75%	0.748	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-7.1	-179.9	-68.5	174.3	11	0	0	113.6	A110 K111 L112	A110-Q114 WeakPolarHBondContact O-CG 3.44Å; A110-Q114 PolarHBondContact O-N 3.37Å; K111-Q114 PolarHBondContact O-N 3.45Å; L112-Q114 VanDerWaalsContact C-N 3.29Å; L112-Q114 PolarHBondContact O-N 2.86Å
115	R	87.8	Confident	89.5	Confident	26 Å²	26	73.5 Å²	73.5	10%	0.098	35%	0.349	C	S	.	.			trans	-68.9	138	-175.7	88	-172.1	-174.4	-134.1	-7	111.2	K111 L112 A113 R117 A160 R163 D164	K111-R115 PolarHBondContact O-N 2.78Å; L112-R115 WeakPolarHBondContact O-CB 3.36Å; L112-R115 WeakPolarHBondContact O-CD 3.46Å; L112-R115 WeakPolarHBondContact O-CG 3.46Å; L112-R115 PolarHBondContact O-N 3.36Å; A113-R115 VanDerWaalsContact C-N 3.28Å; A113-R115 PolarHBondContact O-N 3.11Å; R115-R117 WeakPolarHBondContact CG-O 3.04Å; R115-A160 PolarHBondContact NH1-O 3.47Å; R115-A160 PolarHBondContact NH2-O 3.45Å; R115-R163 PolarHBondContact O-NH1 3.34Å; R115-R163 PolarHBondContact O-NH2 3.04Å; R115-D164 IonicContact CZ-OD1 3.47Å; R115-D164 IonicContact CZ-OD2 3.5Å; R115-D164 IonicContact NE-OD1 3.63Å; R115-D164 IonicContact NE-OD2 3.96Å; R115-D164 IonicContact NH2-OD1 2.69Å; R115-D164 PolarHBondContact NH2-OD1 2.86Å; R115-D164 IonicContact NH2-OD2 3.13Å; R115-D164 PolarHBondContact NH2-OD2 3.44Å; R115-D164 VanDerWaalsContact NH2-OD2 3.13Å
116	R	85.6	Confident	89.5	Confident	240 Å²	240	73.7 Å²	73.7	91%	0.906	35%	0.35	S	S	*	.			trans	-99.6	-20.9	176.4	-63.6	-173.8	-176.8	-178.3	0.5	113.4
117	R	86.4	Confident	89.6	Confident	211 Å²	211	68.6 Å²	68.6	80%	0.796	33%	0.33	S	S	*	.	S	Bend	trans	-113.8	154.9	-177.9	-64.1	-176	179.5	-179.9	-1.4	109.8	R115	R115-R117 WeakPolarHBondContact CG-O 3.04Å
118	P	87.4	Confident	89.7	Confident	94 Å²	94	63.3 Å²	63.3	61%	0.61	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-54.8	154.1	168.4	-23.4	34.1	0	0	0	111.4	D164	P118-D164 WeakPolarHBondContact CA-OD1 3.32Å
119	L	89.5	Confident	89.7	Confident	22 Å²	22	63.1 Å²	63.1	12%	0.115	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-64	143.4	174.3	-66	171.6	0	0	0	110.7	L28 L112 D123 F124 T127 D164	L28-L119 HydrophobicContact CD1-CD2 3.35Å; L112-L119 HydrophobicContact CD2-CD1 4.23Å; L112-L119 HydrophobicContact CD2-CD2 3.68Å; L119-D123 HydrophobicContact CB-CB 4.34Å; L119-D123 HydrophobicContact CD2-CB 4.04Å; L119-F124 HydrophobicContact CB-CB 4Å; L119-F124 HydrophobicContact CD1-CB 4.45Å; L119-F124 HydrophobicContact CD1-CD2 4.43Å; L119-T127 HydrophobicContact CD1-CG2 4.39Å; L119-T127 WeakPolarHBondContact CD1-OG1 3.48Å; L119-D164 WeakPolarHBondContact CB-OD2 3.17Å; L119-D164 WeakPolarHBondContact CD1-OD2 3.5Å; L119-D164 WeakPolarHBondContact CG-OD2 3.43Å; L119-D164 PolarHBondContact N-OD2 3.03Å
120	G	86.6	Confident	89.8	Confident	44 Å²	44	62.9 Å²	62.9	45%	0.454	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-64.3	152.8	161.7	0	0	0	0	0	109.4	Q122 D123 F124	G120-Q122 VanDerWaalsContact C-N 3.26Å; G120-Q122 PolarHBondContact O-N 3.04Å; G120-Q122 VanDerWaalsContact O-N 3.11Å; G120-D123 PolarHBondContact O-N 3.04Å; G120-F124 PolarHBondContact O-N 3.08Å
121	W	84.1	Confident	90	Very high	145 Å²	145	62 Å²	62	55%	0.549	30%	0.3	S	S	.	.	H	α-helix	trans	-49.1	-43.4	-174.2	-175.8	-107.1	0	0	0	114.3	L48 F124 E125	L48-W121 HydrophobicContact CB-CZ2 3.75Å; L48-W121 HydrophobicContact CD1-CZ2 4.38Å; L48-W121 PolarHBondContact O-NE1 3.12Å; W121-F124 WeakPolarHBondContact O-CB 3.48Å; W121-F124 PolarHBondContact O-N 3.21Å; W121-E125 PolarHBondContact O-N 3.27Å
122	Q	87.5	Confident	90.1	Very high	68 Å²	68	60.4 Å²	60.4	32%	0.318	30%	0.295	S	S	.	.	H	α-helix	trans	-65.8	-43	179.1	-55.1	-177.6	-33.8	0	0	113	N44 T46 G120 F124 R126	N44-Q122 PolarHBondContact ND2-OE1 2.99Å; T46-Q122 HydrophobicContact CG2-CG 4.13Å; T46-Q122 WeakPolarHBondContact OG1-CG 3.49Å; T46-Q122 PolarHBondContact OG1-NE2 3.01Å; G120-Q122 VanDerWaalsContact C-N 3.26Å; G120-Q122 PolarHBondContact O-N 3.04Å; G120-Q122 VanDerWaalsContact O-N 3.11Å; Q122-F124 VanDerWaalsContact C-N 3.3Å; Q122-R126 WeakPolarHBondContact O-CB 3.26Å; Q122-R126 VanDerWaalsContact O-CD 3.26Å; Q122-R126 WeakPolarHBondContact O-CD 3.5Å; Q122-R126 WeakPolarHBondContact O-CG 3.2Å; Q122-R126 PolarHBondContact O-N 2.86Å
123	D	90	Very high	90.2	Very high	42 Å²	42	60.6 Å²	60.6	23%	0.225	30%	0.295	C	S	.	.	H	α-helix	trans	-71.9	-30.9	178.1	-71.7	-31.8	0	0	0	110.6	L28 Y29 L119 G120 T127	L28-D123 HydrophobicContact CD1-CB 4.09Å; Y29-D123 HydrophobicContact CD2-CB 4.43Å; L119-D123 HydrophobicContact CB-CB 4.34Å; L119-D123 HydrophobicContact CD2-CB 4.04Å; G120-D123 PolarHBondContact O-N 3.04Å; D123-T127 VanDerWaalsContact O-CB 3.32Å; D123-T127 WeakPolarHBondContact O-CB 3.46Å; D123-T127 PolarHBondContact O-N 3.38Å; D123-T127 PolarHBondContact O-OG1 3.48Å
124	F	90.3	Very high	90.4	Very high	33 Å²	33	57 Å²	57	15%	0.145	27%	0.266	C	S	.	.	H	α-helix	trans	-63.4	-53.2	172.6	-177.6	-93.5	0	0	0	110.9	L119 G120 W121 Q122 R126 T127 V128 V161 D164 L165	L119-F124 HydrophobicContact CB-CB 4Å; L119-F124 HydrophobicContact CD1-CB 4.45Å; L119-F124 HydrophobicContact CD1-CD2 4.43Å; G120-F124 PolarHBondContact O-N 3.08Å; W121-F124 WeakPolarHBondContact O-CB 3.48Å; W121-F124 PolarHBondContact O-N 3.21Å; Q122-F124 VanDerWaalsContact C-N 3.3Å; F124-R126 VanDerWaalsContact C-N 3.33Å; F124-R126 PolarHBondContact O-N 3.44Å; F124-T127 WeakPolarHBondContact O-CA 3.27Å; F124-T127 WeakPolarHBondContact O-CB 3.4Å; F124-T127 PolarHBondContact O-N 2.94Å; F124-V128 HydrophobicContact CD1-CG2 4.21Å; F124-V128 HydrophobicContact CE1-CG2 3.78Å; F124-V128 HydrophobicContact CZ-CG2 4Å; F124-V128 WeakPolarHBondContact O-CG2 3.36Å; F124-V128 PolarHBondContact O-N 3.15Å; F124-V161 HydrophobicContact CE2-CG1 3.93Å; F124-V161 HydrophobicContact CZ-CG1 3.92Å; F124-D164 HydrophobicContact CD2-CB 4.02Å; F124-D164 HydrophobicContact CE2-CB 3.99Å; F124-L165 HydrophobicContact CE2-CD2 4.32Å; F124-L165 HydrophobicContact CE2-CG 4.38Å; F124-L165 HydrophobicContact CZ-CD2 3.8Å; F124-L165 HydrophobicContact CZ-CG 4.17Å
125	E	91.2	Very high	90.6	Very high	2 Å²	2	52 Å²	52	1%	0.009	25%	0.249	C	C	.	.	H	α-helix	trans	-51.3	-51.2	174.5	172.6	-175.3	-129.9	0	0	111.5	T46 F47 L48 W121 T127 V128 L129	T46-E125 WeakPolarHBondContact CA-OE2 3.16Å; T46-E125 WeakPolarHBondContact CG2-OE2 3.16Å; F47-E125 VanDerWaalsContact CA-OE1 3.25Å; F47-E125 WeakPolarHBondContact CA-OE1 3.47Å; F47-E125 WeakPolarHBondContact CB-OE1 3.43Å; F47-E125 PolarHBondContact N-OE1 2.66Å; F47-E125 PolarHBondContact N-OE2 2.69Å; L48-E125 HydrophobicContact CD1-CB 4.15Å; L48-E125 HydrophobicContact CD1-CG 3.96Å; L48-E125 HydrophobicContact CG-CG 4.25Å; L48-E125 WeakPolarHBondContact CG-OE1 3.5Å; L48-E125 PolarHBondContact N-OE1 3.13Å; W121-E125 PolarHBondContact O-N 3.27Å; E125-T127 VanDerWaalsContact C-N 3.27Å; E125-T127 PolarHBondContact O-N 2.9Å; E125-V128 WeakPolarHBondContact O-CB 3.24Å; E125-V128 PolarHBondContact O-N 2.92Å; E125-V128 VanDerWaalsContact O-N 3.15Å; E125-L129 HydrophobicContact CG-CD1 4.12Å; E125-L129 WeakPolarHBondContact O-CG 3.23Å; E125-L129 PolarHBondContact O-N 3.33Å
126	R	93.1	Very high	90.8	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.015	25%	0.253	C	S	.	.	H	α-helix	trans	-63.7	-34	179.6	-68.5	161.8	-173.1	175.8	-3.9	112.6	Y29 N44 P45 I93 V97 L98 Q122 F124 L129 T130	Y29-R126 HydrophobicContact CD1-CB 3.85Å; Y29-R126 HydrophobicContact CD1-CG 4.47Å; Y29-R126 HydrophobicContact CD2-CB 3.69Å; Y29-R126 HydrophobicContact CD2-CG 4.44Å; Y29-R126 HydrophobicContact CE1-CB 3.73Å; Y29-R126 HydrophobicContact CE2-CB 3.58Å; Y29-R126 HydrophobicContact CG-CB 3.82Å; Y29-R126 HydrophobicContact CG-CG 4.3Å; Y29-R126 PolarHBondContact OH-O 3.19Å; N44-R126 PolarHBondContact OD1-NH1 3.34Å; N44-R126 PolarHBondContact OD1-NH2 3.38Å; P45-R126 PolarHBondContact O-NH2 2.64Å; I93-R126 HydrophobicContact CG2-CG 4.32Å; V97-R126 HydrophobicContact CG1-CG 4.08Å; L98-R126 HydrophobicContact CD2-CB 4.06Å; L98-R126 HydrophobicContact CD2-CG 4.31Å; Q122-R126 WeakPolarHBondContact O-CB 3.26Å; Q122-R126 VanDerWaalsContact O-CD 3.26Å; Q122-R126 WeakPolarHBondContact O-CD 3.5Å; Q122-R126 WeakPolarHBondContact O-CG 3.2Å; Q122-R126 PolarHBondContact O-N 2.86Å; F124-R126 VanDerWaalsContact C-N 3.33Å; F124-R126 PolarHBondContact O-N 3.44Å; R126-L129 PolarHBondContact O-N 3.06Å; R126-T130 WeakPolarHBondContact O-CB 3.3Å; R126-T130 PolarHBondContact O-N 3.35Å; R126-T130 PolarHBondContact O-OG1 3.33Å
127	T	94	Very high	91.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.3	-42.1	174.7	-55.6	0	0	0	0	111.1	Y29 L112 L119 D123 F124 E125 T130 L131 L157 V161	Y29-T127 WeakPolarHBondContact OH-CA 2.7Å; Y29-T127 PolarHBondContact OH-N 3.25Å; Y29-T127 PolarHBondContact OH-OG1 2.94Å; L112-T127 HydrophobicContact CD1-CG2 3.99Å; L119-T127 HydrophobicContact CD1-CG2 4.39Å; L119-T127 WeakPolarHBondContact CD1-OG1 3.48Å; D123-T127 VanDerWaalsContact O-CB 3.32Å; D123-T127 WeakPolarHBondContact O-CB 3.46Å; D123-T127 PolarHBondContact O-N 3.38Å; D123-T127 PolarHBondContact O-OG1 3.48Å; F124-T127 WeakPolarHBondContact O-CA 3.27Å; F124-T127 WeakPolarHBondContact O-CB 3.4Å; F124-T127 PolarHBondContact O-N 2.94Å; E125-T127 VanDerWaalsContact C-N 3.27Å; E125-T127 PolarHBondContact O-N 2.9Å; T127-T130 PolarHBondContact O-N 2.89Å; T127-L131 WeakPolarHBondContact O-CB 3.4Å; T127-L131 PolarHBondContact O-N 2.77Å; T127-L157 HydrophobicContact CG2-CD2 3.99Å; T127-V161 HydrophobicContact CG2-CG2 3.82Å
128	V	93.6	Very high	91.3	Very high	38 Å²	38	33.2 Å²	33.2	23%	0.23	18%	0.183	C	C	.	.	H	α-helix	trans	-63.5	-45.6	174.2	173.9	0	0	0	0	111.1	F124 E125 T130 L131 V132 V161	F124-V128 HydrophobicContact CD1-CG2 4.21Å; F124-V128 HydrophobicContact CE1-CG2 3.78Å; F124-V128 HydrophobicContact CZ-CG2 4Å; F124-V128 WeakPolarHBondContact O-CG2 3.36Å; F124-V128 PolarHBondContact O-N 3.15Å; E125-V128 WeakPolarHBondContact O-CB 3.24Å; E125-V128 PolarHBondContact O-N 2.92Å; E125-V128 VanDerWaalsContact O-N 3.15Å; V128-T130 VanDerWaalsContact C-N 3.32Å; V128-T130 PolarHBondContact O-N 3.2Å; V128-L131 WeakPolarHBondContact O-CA 3.46Å; V128-L131 VanDerWaalsContact O-CB 3.29Å; V128-L131 WeakPolarHBondContact O-CB 3.47Å; V128-L131 PolarHBondContact O-N 3.05Å; V128-L131 VanDerWaalsContact O-N 3.11Å; V128-V132 WeakPolarHBondContact O-CG2 3.45Å; V128-V132 PolarHBondContact O-N 2.94Å; V128-V161 HydrophobicContact CG2-CG1 4.13Å; V128-V161 HydrophobicContact CG2-CG2 4.11Å
129	L	93.5	Very high	91.4	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-66.9	-33.5	177.5	-65.5	171.5	0	0	0	112.6	L57 L90 I93 L98 E125 R126 L131 V132 Y133	L57-L129 HydrophobicContact CD1-CD2 4.13Å; L57-L129 HydrophobicContact CD2-CD2 4.46Å; L90-L129 HydrophobicContact CD1-CD1 3.76Å; L90-L129 HydrophobicContact CD1-CD2 3.9Å; I93-L129 HydrophobicContact CG2-CD1 3.61Å; L98-L129 HydrophobicContact CD1-CB 3.58Å; L98-L129 HydrophobicContact CD2-CB 4.07Å; L98-L129 HydrophobicContact CG-CB 4.46Å; E125-L129 HydrophobicContact CG-CD1 4.12Å; E125-L129 WeakPolarHBondContact O-CG 3.23Å; E125-L129 PolarHBondContact O-N 3.33Å; R126-L129 PolarHBondContact O-N 3.06Å; L129-L131 VanDerWaalsContact C-N 3.31Å; L129-V132 PolarHBondContact O-N 3.43Å; L129-Y133 PolarHBondContact O-N 3.38Å
130	T	94.4	Very high	91.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.3	-36.5	171.9	-53.4	0	0	0	0	111.3	Y29 P99 I105 L108 R126 T127 V128 S134 L157	Y29-T130 WeakPolarHBondContact CE1-OG1 3.47Å; Y29-T130 PolarHBondContact OH-OG1 3.17Å; P99-T130 HydrophobicContact CG-CG2 4.01Å; I105-T130 HydrophobicContact CG1-CG2 4.3Å; I105-T130 HydrophobicContact CG2-CG2 4.15Å; L108-T130 HydrophobicContact CD2-CG2 4.21Å; R126-T130 WeakPolarHBondContact O-CB 3.3Å; R126-T130 PolarHBondContact O-N 3.35Å; R126-T130 PolarHBondContact O-OG1 3.33Å; T127-T130 PolarHBondContact O-N 2.89Å; V128-T130 VanDerWaalsContact C-N 3.32Å; V128-T130 PolarHBondContact O-N 3.2Å; T130-S134 WeakPolarHBondContact O-CB 3.46Å; T130-S134 PolarHBondContact O-N 3.41Å; T130-S134 PolarHBondContact O-OG 2.88Å; T130-L157 HydrophobicContact CG2-CD1 4.16Å; T130-L157 HydrophobicContact CG2-CD2 4.07Å
131	L	94.9	Very high	91.7	Very high	35 Å²	35	36.1 Å²	36.1	18%	0.183	20%	0.195	C	C	.	.	H	α-helix	trans	-63.6	-46.3	173.4	173.6	67.2	0	0	0	111.4	T127 V128 L129 S134 S135 L154 L157 V158 V161	T127-L131 WeakPolarHBondContact O-CB 3.4Å; T127-L131 PolarHBondContact O-N 2.77Å; V128-L131 WeakPolarHBondContact O-CA 3.46Å; V128-L131 VanDerWaalsContact O-CB 3.29Å; V128-L131 WeakPolarHBondContact O-CB 3.47Å; V128-L131 PolarHBondContact O-N 3.05Å; V128-L131 VanDerWaalsContact O-N 3.11Å; L129-L131 VanDerWaalsContact C-N 3.31Å; L131-S134 PolarHBondContact O-N 2.9Å; L131-S135 PolarHBondContact O-N 3.42Å; L131-L154 HydrophobicContact CD1-CD1 3.51Å; L131-L154 HydrophobicContact CD1-CG 4.07Å; L131-L157 HydrophobicContact CB-CB 4.27Å; L131-L157 HydrophobicContact CD1-CB 3.77Å; L131-V158 HydrophobicContact CD1-CG2 3.6Å; L131-V158 HydrophobicContact CD2-CG2 4.18Å; L131-V161 HydrophobicContact CD2-CG2 4.38Å
132	V	93.8	Very high	92	Very high	23 Å²	23	35.2 Å²	35.2	14%	0.139	21%	0.211	C	C	.	.	H	α-helix	trans	-58.7	-48.2	174.4	172.9	0	0	0	0	111	L61 M65 I67 V128 L129 S134 S135 Q136	L61-V132 HydrophobicContact CD2-CG1 3.73Å; L61-V132 HydrophobicContact CD2-CG2 4.24Å; M65-V132 HydrophobicContact CE-CG1 3.95Å; I67-V132 HydrophobicContact CD1-CB 4.5Å; I67-V132 HydrophobicContact CD1-CG1 4.24Å; V128-V132 WeakPolarHBondContact O-CG2 3.45Å; V128-V132 PolarHBondContact O-N 2.94Å; L129-V132 PolarHBondContact O-N 3.43Å; V132-S134 VanDerWaalsContact C-N 3.34Å; V132-S134 PolarHBondContact O-N 3.22Å; V132-S135 PolarHBondContact O-N 3.26Å; V132-S135 PolarHBondContact O-OG 3.02Å; V132-Q136 WeakPolarHBondContact O-CG 3.25Å; V132-Q136 PolarHBondContact O-N 3.44Å; V132-Q136 VanDerWaalsContact O-N 3.15Å
133	Y	93.1	Very high	92.4	Very high	8 Å²	8	35.8 Å²	35.8	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-57.8	-46.9	176.6	172	-116.4	0	0	0	112	I67 K100 I105 L129 S135 Q136 I137 W150	I67-Y133 HydrophobicContact CB-CD2 3.78Å; I67-Y133 HydrophobicContact CB-CG 4.43Å; I67-Y133 HydrophobicContact CG2-CD2 3.48Å; I67-Y133 VanDerWaalsContact CG2-CD2 3.48Å; I67-Y133 HydrophobicContact CG2-CE2 4.23Å; I67-Y133 HydrophobicContact CG2-CG 4.05Å; I67-Y133 WeakPolarHBondContact O-CD2 3.41Å; K100-Y133 HydrophobicContact CD-CE1 4.18Å; K100-Y133 HydrophobicContact CD-CE2 4.15Å; K100-Y133 PolarHBondContact O-OH 2.87Å; K100-Y133 VanDerWaalsContact O-OH 3.09Å; I105-Y133 HydrophobicContact CD1-CD1 4.2Å; I105-Y133 HydrophobicContact CD1-CE1 4.08Å; L129-Y133 PolarHBondContact O-N 3.38Å; Y133-S135 VanDerWaalsContact C-N 3.32Å; Y133-S135 PolarHBondContact O-N 3.06Å; Y133-Q136 PolarHBondContact O-N 3.38Å; Y133-I137 HydrophobicContact CD2-CG1 3.97Å; Y133-I137 HydrophobicContact CE1-CG1 4.09Å; Y133-I137 HydrophobicContact CE2-CD1 3.7Å; Y133-I137 HydrophobicContact CE2-CG1 3.45Å; Y133-I137 VanDerWaalsContact CE2-CG1 3.45Å; Y133-I137 WeakPolarHBondContact O-CG1 3.38Å; Y133-I137 PolarHBondContact O-N 3.25Å; Y133-W150 AromaticContact CE1-CH2 3.99Å; Y133-W150 HydrophobicContact CE1-CH2 3.99Å; Y133-W150 HydrophobicContact CE1-CZ3 4.44Å
134	S	92.9	Very high	92.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.3	-35.2	-177.5	-58.2	0	0	0	0	112.4	T130 L131 V132 L138 L157	T130-S134 WeakPolarHBondContact O-CB 3.46Å; T130-S134 PolarHBondContact O-N 3.41Å; T130-S134 PolarHBondContact O-OG 2.88Å; L131-S134 PolarHBondContact O-N 2.9Å; V132-S134 VanDerWaalsContact C-N 3.34Å; V132-S134 PolarHBondContact O-N 3.22Å; S134-L138 WeakPolarHBondContact O-CB 3.43Å; S134-L138 PolarHBondContact O-N 2.92Å; S134-L157 WeakPolarHBondContact OG-CD1 3.42Å
135	S	92.9	Very high	92.8	Very high	57 Å²	57	43.4 Å²	43.4	40%	0.399	25%	0.251	S	S	.	.	H	α-helix	trans	-69.5	-38.5	176.9	70.5	0	0	0	0	111.8	L131 V132 Y133 L138 G139	L131-S135 PolarHBondContact O-N 3.42Å; V132-S135 PolarHBondContact O-N 3.26Å; V132-S135 PolarHBondContact O-OG 3.02Å; Y133-S135 VanDerWaalsContact C-N 3.32Å; Y133-S135 PolarHBondContact O-N 3.06Å; S135-L138 PolarHBondContact O-N 2.96Å; S135-G139 PolarHBondContact O-N 3.08Å
136	Q	91.9	Very high	92.9	Very high	39 Å²	39	48.1 Å²	48.1	18%	0.182	27%	0.273	C	S	.	.	H	α-helix	trans	-64.8	-46.8	175.9	-69.3	174.8	-8.3	0	0	111.6	M65 V132 Y133 L138 G139 Q140	M65-Q136 PolarHBondContact O-NE2 2.99Å; V132-Q136 WeakPolarHBondContact O-CG 3.25Å; V132-Q136 PolarHBondContact O-N 3.44Å; V132-Q136 VanDerWaalsContact O-N 3.15Å; Y133-Q136 PolarHBondContact O-N 3.38Å; Q136-L138 VanDerWaalsContact C-N 3.33Å; Q136-L138 PolarHBondContact O-N 3.36Å; Q136-G139 PolarHBondContact O-N 3.49Å; Q136-Q140 WeakPolarHBondContact O-CG 3.14Å; Q136-Q140 PolarHBondContact O-N 2.88Å
137	I	91.6	Very high	92.9	Very high	24 Å²	24	52 Å²	52	12%	0.123	29%	0.29	C	S	.	.	H	α-helix	trans	-60.3	-43.1	175.9	-69.3	-64.3	0	0	0	111.3	Y133 G139 Q140 I141 W150	Y133-I137 HydrophobicContact CD2-CG1 3.97Å; Y133-I137 HydrophobicContact CE1-CG1 4.09Å; Y133-I137 HydrophobicContact CE2-CD1 3.7Å; Y133-I137 HydrophobicContact CE2-CG1 3.45Å; Y133-I137 VanDerWaalsContact CE2-CG1 3.45Å; Y133-I137 WeakPolarHBondContact O-CG1 3.38Å; Y133-I137 PolarHBondContact O-N 3.25Å; I137-G139 PolarHBondContact O-N 3.49Å; I137-Q140 PolarHBondContact O-N 2.93Å; I137-I141 HydrophobicContact CG2-CD1 3.63Å; I137-I141 HydrophobicContact CG2-CG1 4.1Å; I137-I141 WeakPolarHBondContact O-CG1 3.39Å; I137-I141 PolarHBondContact O-N 2.7Å; I137-I141 VanDerWaalsContact O-N 3.15Å; I137-W150 HydrophobicContact CB-CE3 4.48Å; I137-W150 HydrophobicContact CB-CH2 4.4Å; I137-W150 HydrophobicContact CB-CZ3 4.33Å; I137-W150 HydrophobicContact CG1-CH2 4.44Å; I137-W150 HydrophobicContact CG2-CD2 3.86Å; I137-W150 HydrophobicContact CG2-CE3 4.09Å; I137-W150 HydrophobicContact CG2-CG 4.47Å; I137-W150 HydrophobicContact CG2-CH2 3.97Å; I137-W150 HydrophobicContact CG2-CZ2 3.73Å; I137-W150 HydrophobicContact CG2-CZ3 4.15Å
138	L	91.8	Very high	93	Very high	19 Å²	19	57.1 Å²	57.1	10%	0.099	31%	0.313	C	S	.	.	H	α-helix	trans	-58.9	-33.6	178.7	-174.1	67.8	0	0	0	112.8	S134 S135 Q136 Q140 K147 W150 M151 L154	S134-L138 WeakPolarHBondContact O-CB 3.43Å; S134-L138 PolarHBondContact O-N 2.92Å; S135-L138 PolarHBondContact O-N 2.96Å; Q136-L138 VanDerWaalsContact C-N 3.33Å; Q136-L138 PolarHBondContact O-N 3.36Å; L138-Q140 VanDerWaalsContact C-N 3.27Å; L138-Q140 PolarHBondContact O-N 3.26Å; L138-K147 HydrophobicContact CD1-CB 4.46Å; L138-K147 HydrophobicContact CD1-CG 3.62Å; L138-K147 WeakPolarHBondContact CD1-O 3.25Å; L138-W150 HydrophobicContact CD1-CB 3.82Å; L138-M151 HydrophobicContact CD1-CB 4.41Å; L138-M151 HydrophobicContact CD2-CE 3.71Å; L138-M151 HydrophobicContact CD2-SD 3.86Å; L138-L154 HydrophobicContact CD2-CD2 3.83Å
139	G	88.9	Confident	93.1	Very high	71 Å²	71	57.2 Å²	57.2	73%	0.732	31%	0.312	S	S	*	.	H	α-helix	trans	-70.3	-19.9	174.5	0	0	0	0	0	114.4	S135 Q136 I137	S135-G139 PolarHBondContact O-N 3.08Å; Q136-G139 PolarHBondContact O-N 3.49Å; I137-G139 PolarHBondContact O-N 3.49Å
140	Q	90.2	Very high	93.1	Very high	121 Å²	121	58 Å²	58	57%	0.565	32%	0.316	S	S	*	.	H	α-helix	trans	-98.5	-18.6	-177.1	-63.7	172.9	10.2	0	0	113.2	Q136 I137 L138 S142	Q136-Q140 WeakPolarHBondContact O-CG 3.14Å; Q136-Q140 PolarHBondContact O-N 2.88Å; I137-Q140 PolarHBondContact O-N 2.93Å; L138-Q140 VanDerWaalsContact C-N 3.27Å; L138-Q140 PolarHBondContact O-N 3.26Å; Q140-S142 PolarHBondContact O-N 3.48Å
141	I	91.6	Very high	93.2	Very high	28 Å²	28	62.1 Å²	62.1	14%	0.144	34%	0.336	C	S	.	.			trans	-74.8	123.4	-177.1	-68.7	164.3	0	0	0	111.2	I137 N143 Q146 K147 W150	I137-I141 HydrophobicContact CG2-CD1 3.63Å; I137-I141 HydrophobicContact CG2-CG1 4.1Å; I137-I141 WeakPolarHBondContact O-CG1 3.39Å; I137-I141 PolarHBondContact O-N 2.7Å; I137-I141 VanDerWaalsContact O-N 3.15Å; I141-N143 HydrophobicContact CG2-CB 4.43Å; I141-N143 VanDerWaalsContact CG2-O 3.24Å; I141-N143 WeakPolarHBondContact CG2-O 3.47Å; I141-Q146 HydrophobicContact CG2-CB 3.82Å; I141-K147 HydrophobicContact CG2-CB 4.06Å; I141-W150 HydrophobicContact CD1-CB 4.04Å; I141-W150 HydrophobicContact CD1-CD2 4.21Å; I141-W150 HydrophobicContact CD1-CG 3.54Å
142	S	91.6	Very high	93.2	Very high	126 Å²	126	64.6 Å²	64.6	88%	0.881	35%	0.346	S	S	*	.			trans	-90.4	-27.4	172.6	57.9	0	0	0	0	113.6	Q140 Q144	Q140-S142 PolarHBondContact O-N 3.48Å; S142-Q144 PolarHBondContact O-N 2.93Å
143	N	95.4	Very high	93.2	Very high	81 Å²	81	63.6 Å²	63.6	43%	0.433	34%	0.34	S	S	.	.			trans	-76.4	119.8	-179	-178.1	-69	0	0	0	111.4	I141 H145 Q146 K147	I141-N143 HydrophobicContact CG2-CB 4.43Å; I141-N143 VanDerWaalsContact CG2-O 3.24Å; I141-N143 WeakPolarHBondContact CG2-O 3.47Å; N143-H145 PolarHBondContact O-N 2.92Å; N143-H145 WeakPolarHBondContact OD1-CB 3.38Å; N143-H145 PolarHBondContact OD1-N 3Å; N143-Q146 HydrophobicContact CB-CB 4.19Å; N143-Q146 HydrophobicContact CB-CG 4.26Å; N143-Q146 PolarHBondContact O-N 3.26Å; N143-Q146 PolarHBondContact OD1-N 3.14Å; N143-K147 WeakPolarHBondContact O-CB 3.36Å; N143-K147 PolarHBondContact O-N 3.47Å
144	Q	94	Very high	93.2	Very high	116 Å²	116	64.5 Å²	64.5	54%	0.542	35%	0.345	S	S	.	.	H	α-helix	trans	-59.2	-43.1	-176.1	-178.6	60.5	18.2	0	0	113.5	S142 K147 E148	S142-Q144 PolarHBondContact O-N 2.93Å; Q144-K147 WeakPolarHBondContact O-CB 3.2Å; Q144-K147 PolarHBondContact O-N 3.31Å; Q144-E148 PolarHBondContact NE2-OE1 2.77Å; Q144-E148 WeakPolarHBondContact O-CG 3.43Å; Q144-E148 PolarHBondContact O-N 2.89Å
145	H	94.3	Very high	93.4	Very high	119 Å²	119	67.2 Å²	67.2	55%	0.551	36%	0.362	S	S	*	.	H	α-helix	trans	-65.3	-43.1	-179.8	-178.5	62.6	0	0	0	111.6	N143 K147 E148 L149	N143-H145 PolarHBondContact O-N 2.92Å; N143-H145 WeakPolarHBondContact OD1-CB 3.38Å; N143-H145 PolarHBondContact OD1-N 3Å; H145-K147 VanDerWaalsContact C-N 3.31Å; H145-K147 PolarHBondContact O-N 3.11Å; H145-E148 PolarHBondContact O-N 3.07Å; H145-L149 WeakPolarHBondContact O-CG 3.19Å; H145-L149 PolarHBondContact O-N 3.39Å
146	Q	92.8	Very high	93.4	Very high	101 Å²	101	67.6 Å²	67.6	47%	0.472	36%	0.357	S	S	.	.	H	α-helix	trans	-63.7	-39.8	174	-70.3	-169.2	-43.3	0	0	111.5	I141 N143 E148 L149 W150	I141-Q146 HydrophobicContact CG2-CB 3.82Å; N143-Q146 HydrophobicContact CB-CB 4.19Å; N143-Q146 HydrophobicContact CB-CG 4.26Å; N143-Q146 PolarHBondContact O-N 3.26Å; N143-Q146 PolarHBondContact OD1-N 3.14Å; Q146-E148 VanDerWaalsContact C-N 3.31Å; Q146-E148 PolarHBondContact O-N 3.46Å; Q146-L149 PolarHBondContact O-N 2.86Å; Q146-W150 VanDerWaalsContact O-CD1 3.24Å; Q146-W150 PolarHBondContact O-N 3.43Å
147	K	94.5	Very high	93.5	Very high	86 Å²	86	65.7 Å²	65.7	37%	0.374	35%	0.349	S	S	.	.	H	α-helix	trans	-59	-42.4	178	-168.2	177.3	-176.8	172.8	0	111.7	L138 I141 N143 Q144 H145 W150 M151	L138-K147 HydrophobicContact CD1-CB 4.46Å; L138-K147 HydrophobicContact CD1-CG 3.62Å; L138-K147 WeakPolarHBondContact CD1-O 3.25Å; I141-K147 HydrophobicContact CG2-CB 4.06Å; N143-K147 WeakPolarHBondContact O-CB 3.36Å; N143-K147 PolarHBondContact O-N 3.47Å; Q144-K147 WeakPolarHBondContact O-CB 3.2Å; Q144-K147 PolarHBondContact O-N 3.31Å; H145-K147 VanDerWaalsContact C-N 3.31Å; H145-K147 PolarHBondContact O-N 3.11Å; K147-W150 PolarHBondContact O-N 2.9Å; K147-M151 VanDerWaalsContact O-CB 3.28Å; K147-M151 WeakPolarHBondContact O-CB 3.35Å; K147-M151 PolarHBondContact O-N 3.28Å
148	E	95.9	Very high	93.7	Very high	106 Å²	106	67 Å²	67	50%	0.495	36%	0.358	S	S	.	.	H	α-helix	trans	-62.7	-44.9	175.9	-73.4	165.8	-168.9	0	0	112.2	Q144 H145 Q146 W150 M151 E152	Q144-E148 PolarHBondContact NE2-OE1 2.77Å; Q144-E148 WeakPolarHBondContact O-CG 3.43Å; Q144-E148 PolarHBondContact O-N 2.89Å; H145-E148 PolarHBondContact O-N 3.07Å; Q146-E148 VanDerWaalsContact C-N 3.31Å; Q146-E148 PolarHBondContact O-N 3.46Å; E148-W150 PolarHBondContact O-N 2.71Å; E148-M151 WeakPolarHBondContact O-CB 3.42Å; E148-M151 PolarHBondContact O-N 3.38Å; E148-E152 PolarHBondContact O-N 2.78Å
149	L	94.8	Very high	93.7	Very high	40 Å²	40	74 Å²	74	21%	0.209	38%	0.383	C	S	.	.	H	α-helix	trans	-63.6	-40.1	177.7	-65.6	176.2	0	0	0	112.6	L102 H145 Q146 T153	L102-L149 HydrophobicContact CD2-CB 3.99Å; L102-L149 HydrophobicContact CD2-CD1 4.34Å; H145-L149 WeakPolarHBondContact O-CG 3.19Å; H145-L149 PolarHBondContact O-N 3.39Å; Q146-L149 PolarHBondContact O-N 2.86Å; L149-T153 PolarHBondContact O-N 3.35Å; L149-T153 PolarHBondContact O-OG1 3.19Å
150	W	94.6	Very high	93.9	Very high	19 Å²	19	71.1 Å²	71.1	7%	0.072	35%	0.352	C	S	.	.	H	α-helix	trans	-70.7	-36.8	175.6	-83.8	96.4	0	0	0	112	L102 I105 Y133 I137 L138 I141 Q146 K147 E148 T153 L154	L102-W150 HydrophobicContact CB-CZ2 3.87Å; L102-W150 HydrophobicContact CD1-CD2 3.94Å; L102-W150 HydrophobicContact CD1-CE3 4.29Å; L102-W150 HydrophobicContact CD1-CG 4.28Å; L102-W150 HydrophobicContact CD1-CZ2 4.34Å; I105-W150 HydrophobicContact CD1-CH2 3.49Å; I105-W150 VanDerWaalsContact CD1-CH2 3.49Å; I105-W150 HydrophobicContact CD1-CZ3 3.47Å; I105-W150 VanDerWaalsContact CD1-CZ3 3.47Å; Y133-W150 AromaticContact CE1-CH2 3.99Å; Y133-W150 HydrophobicContact CE1-CH2 3.99Å; Y133-W150 HydrophobicContact CE1-CZ3 4.44Å; I137-W150 HydrophobicContact CB-CE3 4.48Å; I137-W150 HydrophobicContact CB-CH2 4.4Å; I137-W150 HydrophobicContact CB-CZ3 4.33Å; I137-W150 HydrophobicContact CG1-CH2 4.44Å; I137-W150 HydrophobicContact CG2-CD2 3.86Å; I137-W150 HydrophobicContact CG2-CE3 4.09Å; I137-W150 HydrophobicContact CG2-CG 4.47Å; I137-W150 HydrophobicContact CG2-CH2 3.97Å; I137-W150 HydrophobicContact CG2-CZ2 3.73Å; I137-W150 HydrophobicContact CG2-CZ3 4.15Å; L138-W150 HydrophobicContact CD1-CB 3.82Å; I141-W150 HydrophobicContact CD1-CB 4.04Å; I141-W150 HydrophobicContact CD1-CD2 4.21Å; I141-W150 HydrophobicContact CD1-CG 3.54Å; Q146-W150 VanDerWaalsContact O-CD1 3.24Å; Q146-W150 PolarHBondContact O-N 3.43Å; K147-W150 PolarHBondContact O-N 2.9Å; E148-W150 PolarHBondContact O-N 2.71Å; W150-T153 WeakPolarHBondContact O-CB 3.33Å; W150-T153 PolarHBondContact O-N 3.47Å; W150-L154 WeakPolarHBondContact O-CB 3.46Å; W150-L154 PolarHBondContact O-N 3.33Å
151	M	95.9	Very high	93.9	Very high	85 Å²	85	66 Å²	66	42%	0.419	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-47.5	174.3	-174.6	68.5	77.2	0	0	111.2	L138 K147 E148 T153 L154 V155	L138-M151 HydrophobicContact CD1-CB 4.41Å; L138-M151 HydrophobicContact CD2-CE 3.71Å; L138-M151 HydrophobicContact CD2-SD 3.86Å; K147-M151 VanDerWaalsContact O-CB 3.28Å; K147-M151 WeakPolarHBondContact O-CB 3.35Å; K147-M151 PolarHBondContact O-N 3.28Å; E148-M151 WeakPolarHBondContact O-CB 3.42Å; E148-M151 PolarHBondContact O-N 3.38Å; M151-T153 VanDerWaalsContact C-N 3.25Å; M151-T153 PolarHBondContact O-N 2.65Å; M151-L154 WeakPolarHBondContact O-CB 3.4Å; M151-L154 PolarHBondContact O-N 2.88Å; M151-L154 VanDerWaalsContact O-N 3.15Å; M151-V155 WeakPolarHBondContact O-CG2 3.28Å; M151-V155 PolarHBondContact O-N 2.86Å
152	E	94.7	Very high	93.9	Very high	88 Å²	88	69.7 Å²	69.7	41%	0.411	35%	0.346	S	S	.	.	H	α-helix	trans	-56.2	-44.7	176.1	-169.1	-163	161.8	0	0	110.9	R106 E148 V155 Q156	R106-E152 IonicContact NH2-OE2 3.69Å; E148-E152 PolarHBondContact O-N 2.78Å; E152-V155 PolarHBondContact O-N 3.48Å; E152-Q156 WeakPolarHBondContact O-CG 3.48Å; E152-Q156 PolarHBondContact O-N 3.44Å; E152-Q156 VanDerWaalsContact O-N 3.11Å; E152-Q156 PolarHBondContact OE1-NE2 3.13Å; E152-Q156 VanDerWaalsContact OE1-NE2 3.1Å
153	T	93.1	Very high	93.8	Very high	1 Å²	1	69.4 Å²	69.4	1%	0.006	33%	0.325	C	S	.	.	H	α-helix	trans	-63.6	-41.9	178.2	-56.8	0	0	0	0	111.8	L102 I105 M109 L149 W150 M151 Q156 L157	L102-T153 HydrophobicContact CD1-CG2 4.41Å; L102-T153 WeakPolarHBondContact CD1-OG1 3.44Å; I105-T153 HydrophobicContact CB-CG2 4.16Å; I105-T153 HydrophobicContact CG2-CG2 3.28Å; M109-T153 HydrophobicContact CG-CG2 4.28Å; L149-T153 PolarHBondContact O-N 3.35Å; L149-T153 PolarHBondContact O-OG1 3.19Å; W150-T153 WeakPolarHBondContact O-CB 3.33Å; W150-T153 PolarHBondContact O-N 3.47Å; M151-T153 VanDerWaalsContact C-N 3.25Å; M151-T153 PolarHBondContact O-N 2.65Å; T153-Q156 PolarHBondContact O-N 3.46Å; T153-L157 HydrophobicContact CG2-CD1 4.34Å; T153-L157 PolarHBondContact O-N 3.12Å
154	L	94.4	Very high	93.4	Very high	27 Å²	27	67.4 Å²	67.4	14%	0.141	31%	0.314	C	S	.	.	H	α-helix	trans	-62.6	-45.2	177.3	-167.5	77.8	0	0	0	111.6	L131 L138 W150 M151 Q156 L157 V158	L131-L154 HydrophobicContact CD1-CD1 3.51Å; L131-L154 HydrophobicContact CD1-CG 4.07Å; L138-L154 HydrophobicContact CD2-CD2 3.83Å; W150-L154 WeakPolarHBondContact O-CB 3.46Å; W150-L154 PolarHBondContact O-N 3.33Å; M151-L154 WeakPolarHBondContact O-CB 3.4Å; M151-L154 PolarHBondContact O-N 2.88Å; M151-L154 VanDerWaalsContact O-N 3.15Å; L154-Q156 VanDerWaalsContact C-N 3.29Å; L154-Q156 PolarHBondContact O-N 3.32Å; L154-L157 WeakPolarHBondContact O-CB 3.48Å; L154-L157 PolarHBondContact O-N 3.28Å; L154-V158 WeakPolarHBondContact O-CG2 3.44Å; L154-V158 PolarHBondContact O-N 3.34Å
155	V	95.7	Very high	92.9	Very high	57 Å²	57	67.4 Å²	67.4	35%	0.345	32%	0.318	S	S	.	.	H	α-helix	trans	-60.9	-40.6	176.9	174.4	0	0	0	0	111.1	M151 E152 V158 R159	M151-V155 WeakPolarHBondContact O-CG2 3.28Å; M151-V155 PolarHBondContact O-N 2.86Å; E152-V155 PolarHBondContact O-N 3.48Å; V155-V158 PolarHBondContact O-N 3.25Å; V155-R159 WeakPolarHBondContact O-CG 3.18Å; V155-R159 PolarHBondContact O-N 3.32Å
156	Q	94	Very high	92.1	Very high	65 Å²	65	65.8 Å²	65.8	30%	0.304	32%	0.316	S	S	.	.	H	α-helix	trans	-65.3	-40.1	176.5	-69.1	177.5	23.6	0	0	112.1	M109 E152 T153 L154 R159 A160	M109-Q156 VanDerWaalsContact CB-OE1 3.31Å; M109-Q156 HydrophobicContact CG-CB 4.03Å; M109-Q156 HydrophobicContact SD-CB 3.92Å; E152-Q156 WeakPolarHBondContact O-CG 3.48Å; E152-Q156 PolarHBondContact O-N 3.44Å; E152-Q156 VanDerWaalsContact O-N 3.11Å; E152-Q156 PolarHBondContact OE1-NE2 3.13Å; E152-Q156 VanDerWaalsContact OE1-NE2 3.1Å; T153-Q156 PolarHBondContact O-N 3.46Å; L154-Q156 VanDerWaalsContact C-N 3.29Å; L154-Q156 PolarHBondContact O-N 3.32Å; Q156-R159 PolarHBondContact O-N 3.41Å; Q156-A160 WeakPolarHBondContact O-CB 3.36Å; Q156-A160 PolarHBondContact O-N 2.95Å
157	L	94.7	Very high	90.4	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-60.6	-47.3	173.5	-81.5	161.9	0	0	0	111.8	I105 M109 T127 T130 L131 S134 T153 L154 R159 A160 V161	I105-L157 HydrophobicContact CG2-CD1 4.16Å; M109-L157 HydrophobicContact CE-CD1 4.46Å; M109-L157 HydrophobicContact CE-CD2 3.22Å; M109-L157 HydrophobicContact CE-CG 3.6Å; M109-L157 HydrophobicContact SD-CB 4.42Å; M109-L157 HydrophobicContact SD-CD2 3.86Å; M109-L157 HydrophobicContact SD-CG 3.65Å; T127-L157 HydrophobicContact CG2-CD2 3.99Å; T130-L157 HydrophobicContact CG2-CD1 4.16Å; T130-L157 HydrophobicContact CG2-CD2 4.07Å; L131-L157 HydrophobicContact CB-CB 4.27Å; L131-L157 HydrophobicContact CD1-CB 3.77Å; S134-L157 WeakPolarHBondContact OG-CD1 3.42Å; T153-L157 HydrophobicContact CG2-CD1 4.34Å; T153-L157 PolarHBondContact O-N 3.12Å; L154-L157 WeakPolarHBondContact O-CB 3.48Å; L154-L157 PolarHBondContact O-N 3.28Å; L157-R159 PolarHBondContact O-N 3.26Å; L157-A160 WeakPolarHBondContact O-CB 3.34Å; L157-A160 PolarHBondContact O-N 3.28Å; L157-A160 VanDerWaalsContact O-N 3.17Å; L157-V161 WeakPolarHBondContact O-CG2 3.37Å; L157-V161 PolarHBondContact O-N 2.72Å
158	V	94.4	Very high	88.6	Confident	52 Å²	52	71.7 Å²	71.7	32%	0.315	38%	0.377	S	S	.	.	H	α-helix	trans	-58.6	-47.5	177.3	171.7	0	0	0	0	110.8	L131 L154 V155 A160 V161 Q162	L131-V158 HydrophobicContact CD1-CG2 3.6Å; L131-V158 HydrophobicContact CD2-CG2 4.18Å; L154-V158 WeakPolarHBondContact O-CG2 3.44Å; L154-V158 PolarHBondContact O-N 3.34Å; V155-V158 PolarHBondContact O-N 3.25Å; V158-A160 VanDerWaalsContact C-N 3.29Å; V158-A160 PolarHBondContact O-N 3.18Å; V158-V161 PolarHBondContact O-N 3.04Å; V158-Q162 HydrophobicContact CG1-CG 4.15Å; V158-Q162 WeakPolarHBondContact O-CB 3.44Å; V158-Q162 VanDerWaalsContact O-CG 3.3Å; V158-Q162 WeakPolarHBondContact O-CG 3.48Å; V158-Q162 PolarHBondContact O-N 2.69Å
159	R	93.3	Very high	88.2	Confident	165 Å²	165	70 Å²	70	62%	0.623	37%	0.371	S	S	*	.	H	α-helix	trans	-60.7	-40.1	177.1	-71.3	174.8	-174.3	170.2	3.4	112	V155 Q156 L157 R163	V155-R159 WeakPolarHBondContact O-CG 3.18Å; V155-R159 PolarHBondContact O-N 3.32Å; Q156-R159 PolarHBondContact O-N 3.41Å; L157-R159 PolarHBondContact O-N 3.26Å; R159-R163 WeakPolarHBondContact O-CB 3.1Å; R159-R163 PolarHBondContact O-N 3.41Å
160	A	91.1	Very high	87.9	Confident	10 Å²	10	71.6 Å²	71.6	8%	0.083	38%	0.379	C	S	.	.	H	α-helix	trans	-64.8	-39.9	176.6	0	0	0	0	0	111.7	L112 R115 Q156 L157 V158	L112-A160 HydrophobicContact CB-CB 4.32Å; L112-A160 HydrophobicContact CD1-CB 3.96Å; R115-A160 PolarHBondContact NH1-O 3.47Å; R115-A160 PolarHBondContact NH2-O 3.45Å; Q156-A160 WeakPolarHBondContact O-CB 3.36Å; Q156-A160 PolarHBondContact O-N 2.95Å; L157-A160 WeakPolarHBondContact O-CB 3.34Å; L157-A160 PolarHBondContact O-N 3.28Å; L157-A160 VanDerWaalsContact O-N 3.17Å; V158-A160 VanDerWaalsContact C-N 3.29Å; V158-A160 PolarHBondContact O-N 3.18Å
161	V	91.6	Very high	87.5	Confident	14 Å²	14	74.5 Å²	74.5	9%	0.085	40%	0.396	C	S	.	.	H	α-helix	trans	-69.6	-47.5	175.5	174	0	0	0	0	110.9	F124 T127 V128 L131 L157 V158 R163 D164 L165	F124-V161 HydrophobicContact CE2-CG1 3.93Å; F124-V161 HydrophobicContact CZ-CG1 3.92Å; T127-V161 HydrophobicContact CG2-CG2 3.82Å; V128-V161 HydrophobicContact CG2-CG1 4.13Å; V128-V161 HydrophobicContact CG2-CG2 4.11Å; L131-V161 HydrophobicContact CD2-CG2 4.38Å; L157-V161 WeakPolarHBondContact O-CG2 3.37Å; L157-V161 PolarHBondContact O-N 2.72Å; V158-V161 PolarHBondContact O-N 3.04Å; V161-R163 VanDerWaalsContact C-N 3.29Å; V161-R163 PolarHBondContact O-N 2.99Å; V161-D164 PolarHBondContact O-N 3.49Å; V161-D164 VanDerWaalsContact O-N 3.08Å; V161-L165 HydrophobicContact CG1-CD1 3.92Å; V161-L165 HydrophobicContact CG1-CG 4.43Å; V161-L165 PolarHBondContact O-N 2.81Å
162	Q	91.5	Very high	87	Confident	106 Å²	106	73.9 Å²	73.9	50%	0.495	40%	0.395	S	S	.	.	H	α-helix	trans	-56.9	-40.5	-179.1	-76.9	176.2	-19.3	0	0	113	V158 D164 L165 T166	V158-Q162 HydrophobicContact CG1-CG 4.15Å; V158-Q162 WeakPolarHBondContact O-CB 3.44Å; V158-Q162 VanDerWaalsContact O-CG 3.3Å; V158-Q162 WeakPolarHBondContact O-CG 3.48Å; V158-Q162 PolarHBondContact O-N 2.69Å; Q162-D164 PolarHBondContact O-N 3.01Å; Q162-D164 VanDerWaalsContact O-N 3.12Å; Q162-L165 PolarHBondContact O-N 3.39Å; Q162-T166 PolarHBondContact O-N 2.88Å; Q162-T166 PolarHBondContact O-OG1 3.23Å
163	R	89.9	Confident	86.5	Confident	120 Å²	120	73 Å²	73	45%	0.453	39%	0.394	S	S	.	.	H	α-helix	trans	-56.5	-28.4	178.7	-179.2	175.3	179.9	-168.2	-3.9	113.6	R115 R159 V161 T166	R115-R163 PolarHBondContact O-NH1 3.34Å; R115-R163 PolarHBondContact O-NH2 3.04Å; R159-R163 WeakPolarHBondContact O-CB 3.1Å; R159-R163 PolarHBondContact O-N 3.41Å; V161-R163 VanDerWaalsContact C-N 3.29Å; V161-R163 PolarHBondContact O-N 2.99Å; R163-T166 PolarHBondContact O-OG1 2.65Å
164	D	86.8	Confident	86.1	Confident	38 Å²	38	77.8 Å²	77.8	20%	0.203	42%	0.42	C	S	.	.	H	α-helix	trans	-94.3	-13.3	179.3	-66.2	-6.3	0	0	0	112.8	R115 P118 L119 F124 V161 Q162	R115-D164 IonicContact CZ-OD1 3.47Å; R115-D164 IonicContact CZ-OD2 3.5Å; R115-D164 IonicContact NE-OD1 3.63Å; R115-D164 IonicContact NE-OD2 3.96Å; R115-D164 IonicContact NH2-OD1 2.69Å; R115-D164 PolarHBondContact NH2-OD1 2.86Å; R115-D164 IonicContact NH2-OD2 3.13Å; R115-D164 PolarHBondContact NH2-OD2 3.44Å; R115-D164 VanDerWaalsContact NH2-OD2 3.13Å; P118-D164 WeakPolarHBondContact CA-OD1 3.32Å; L119-D164 WeakPolarHBondContact CB-OD2 3.17Å; L119-D164 WeakPolarHBondContact CD1-OD2 3.5Å; L119-D164 WeakPolarHBondContact CG-OD2 3.43Å; L119-D164 PolarHBondContact N-OD2 3.03Å; F124-D164 HydrophobicContact CD2-CB 4.02Å; F124-D164 HydrophobicContact CE2-CB 3.99Å; V161-D164 PolarHBondContact O-N 3.49Å; V161-D164 VanDerWaalsContact O-N 3.08Å; Q162-D164 PolarHBondContact O-N 3.01Å; Q162-D164 VanDerWaalsContact O-N 3.12Å
165	L	83.7	Confident	85.5	Confident	117 Å²	117	81.4 Å²	81.4	61%	0.613	44%	0.44	S	S	*	.	H	α-helix	trans	-90.3	-26.8	175.8	-66.9	177.2	0	0	0	112.7	F124 V161 Q162	F124-L165 HydrophobicContact CE2-CD2 4.32Å; F124-L165 HydrophobicContact CE2-CG 4.38Å; F124-L165 HydrophobicContact CZ-CD2 3.8Å; F124-L165 HydrophobicContact CZ-CG 4.17Å; V161-L165 HydrophobicContact CG1-CD1 3.92Å; V161-L165 HydrophobicContact CG1-CG 4.43Å; V161-L165 PolarHBondContact O-N 2.81Å; Q162-L165 PolarHBondContact O-N 3.39Å
166	T	76.1	Confident	84.7	Confident	84 Å²	84	83.3 Å²	83.3	52%	0.515	45%	0.447	S	S	.	.	S	Bend	trans	-79.5	129.5	176.9	50.5	0	0	0	0	110.5	Q162 R163 S168	Q162-T166 PolarHBondContact O-N 2.88Å; Q162-T166 PolarHBondContact O-OG1 3.23Å; R163-T166 PolarHBondContact O-OG1 2.65Å; T166-S168 PolarHBondContact O-N 2.69Å
167	P	58.7	Low	83.9	Confident	125 Å²	125	84.8 Å²	84.8	81%	0.812	46%	0.459	S	S	*	.			trans	-59.8	138.5	171.4	25.2	-31.3	0	0	0	109.6
168	S	55.6	Low	83	Confident	187 Å²	187	92.5 Å²	92.5	100%	1.308	50%	0.5	S	S	*	.			trans	-72.3	0	176	-52.5	0	0	0	0	111.7	T166	T166-S168 PolarHBondContact O-N 2.69Å

Retrieved 168 of 168 residues in 36.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).