A0A087XUI2_POEFO Loading...

Protein phosphatase 1 regulatory inhibitor subunit 14D

AlphaFold DB , UniProt , Accession A0A087XUI2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 123 aa.

						>A0A087XUI2_POEFO|A0A087XUI2
VAAMASEPGTQSRVMFQAPDKTEDPAHRKLGKLTVKYNRKDLQRRLDIEEWIDGQLHLLFDCEEEEIPELEIDIDELLELPDEGQRTRLEELLQECGKPKEEFINGLLYRIKGLRKMSGPLKK
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	V	41.5	Very low	48.7	Very low	203 Å²	203	136.9 Å²	136.9	100%	1.23	87%	0.866	S	S	*	*				0	111.1	0	26.6	0	0	0	0	107.3
2	A	44.3	Very low	49.5	Very low	100 Å²	100	135.4 Å²	135.4	83%	0.826	86%	0.863	S	S	*	*			trans	-92.1	144.9	-179.3	0	0	0	0	0	110.1
3	A	40.2	Very low	51	Low	102 Å²	102	140.5 Å²	140.5	84%	0.843	86%	0.856	S	S	*	*			trans	-162.1	95.8	151.1	0	0	0	0	0	108.9
4	M	48.8	Very low	51.9	Low	194 Å²	194	139.1 Å²	139.1	96%	0.956	85%	0.846	S	S	*	*			trans	-85.9	117.5	158.5	-59.8	-159.7	101.9	0	0	106.6
5	A	45.8	Very low	52.9	Low	105 Å²	105	140.3 Å²	140.3	87%	0.868	84%	0.842	S	S	*	*			trans	-96.2	107.2	172.4	0	0	0	0	0	108.5
6	S	49.6	Very low	53.1	Low	117 Å²	117	144 Å²	144	82%	0.818	84%	0.844	S	S	*	*			trans	-72.2	141.6	171.9	-177	0	0	0	0	110.6
7	E	52.8	Low	53.5	Low	174 Å²	174	146.9 Å²	146.9	81%	0.813	85%	0.847	S	S	*	*			trans	-59.5	168.5	177.9	-57.8	178.2	100	0	0	113.3
8	P	48	Very low	53.6	Low	130 Å²	130	143.5 Å²	143.5	84%	0.844	84%	0.839	S	S	*	*				-136.7	144.2	114	33.9	-20.1	0	0	0	114.2
9	G	50.2	Low	53.4	Low	61 Å²	61	142.6 Å²	142.6	63%	0.629	84%	0.838	S	S	*	*			trans	-57.5	147.3	-172.1	0	0	0	0	0	115.1	Q11	G9-Q11 PolarHBondContact O-N 3.05Å
10	T	55.8	Low	53.2	Low	140 Å²	140	142.9 Å²	142.9	86%	0.859	84%	0.836	S	S	*	*			trans	-59.7	93.3	168.9	52.9	0	0	0	0	109.4	S12	T10-S12 PolarHBondContact O-N 2.77Å; T10-S12 VanDerWaalsContact O-N 3.09Å
11	Q	58.4	Low	52.8	Low	180 Å²	180	145.6 Å²	145.6	84%	0.841	84%	0.838	S	S	*	*			trans	-69.7	105.5	164.7	-69.6	-171.2	-8.7	0	0	107.6	G9 R13	G9-Q11 PolarHBondContact O-N 3.05Å; Q11-R13 VanDerWaalsContact C-N 3.32Å; Q11-R13 PolarHBondContact O-N 3.01Å
12	S	58.5	Low	53.1	Low	119 Å²	119	141.4 Å²	141.4	83%	0.832	81%	0.813	S	S	*	*			trans	-57.3	93.8	169.4	-74.5	0	0	0	0	109.6	T10 V14	T10-S12 PolarHBondContact O-N 2.77Å; T10-S12 VanDerWaalsContact O-N 3.09Å; S12-V14 PolarHBondContact O-N 3.42Å
13	R	68.8	Low	53.1	Low	202 Å²	202	145.5 Å²	145.5	76%	0.762	82%	0.815	S	S	*	*			trans	-84.5	108.1	173.2	-179.2	174.1	-73	-132.8	-1.8	108.2	Q11 M15	Q11-R13 VanDerWaalsContact C-N 3.32Å; Q11-R13 PolarHBondContact O-N 3.01Å; R13-M15 PolarHBondContact O-N 3.4Å
14	V	64.6	Low	53.2	Low	120 Å²	120	147.1 Å²	147.1	73%	0.727	81%	0.809	S	S	*	*			trans	-67	112	170.9	-72.4	0	0	0	0	109.4	S12	S12-V14 PolarHBondContact O-N 3.42Å
15	M	65.8	Low	52.8	Low	158 Å²	158	143.4 Å²	143.4	78%	0.778	80%	0.8	S	S	*	*			trans	-95.6	117.3	171.8	-61.8	-123.5	-162.7	0	0	107.9	R13 Q17	R13-M15 PolarHBondContact O-N 3.4Å; M15-Q17 PolarHBondContact O-N 2.75Å
16	F	56.7	Low	53	Low	199 Å²	199	141.8 Å²	141.8	87%	0.873	79%	0.786	S	S	*	*			trans	-74.2	108.7	171.2	-70.4	-88.7	0	0	0	108.5	A18	F16-A18 PolarHBondContact O-N 3.22Å
17	Q	59.2	Low	53.1	Low	194 Å²	194	143.8 Å²	143.8	91%	0.907	78%	0.782	S	S	*	*			trans	-85.2	108.1	178.8	-157.8	158.9	90	0	0	108.7	M15	M15-Q17 PolarHBondContact O-N 2.75Å
18	A	55.1	Low	53.3	Low	85 Å²	85	147 Å²	147	70%	0.702	79%	0.787	S	S	*	*			trans	-82.9	139.5	169	0	0	0	0	0	109.2	F16 D20	F16-A18 PolarHBondContact O-N 3.22Å; A18-D20 PolarHBondContact O-N 2.67Å
19	P	51.5	Low	53.8	Low	126 Å²	126	149.6 Å²	149.6	82%	0.818	79%	0.785	S	S	*	*			trans	-68.8	128.2	-176.1	26.3	-32.2	0	0	0	111.3	K21	P19-K21 PolarHBondContact O-N 3.25Å
20	D	49.3	Very low	54.2	Low	149 Å²	149	155 Å²	155	80%	0.797	80%	0.799	S	S	*	*			trans	-63	112.7	172	-175.4	-103.6	0	0	0	110.1	A18	A18-D20 PolarHBondContact O-N 2.67Å
21	K	44.8	Very low	54.4	Low	199 Å²	199	151 Å²	151	87%	0.865	79%	0.786	S	S	*	*			trans	-133.5	118.9	157.4	-84.9	-169.3	174.2	-177.9	0	108.5	P19	P19-K21 PolarHBondContact O-N 3.25Å
22	T	46.6	Very low	54.5	Low	116 Å²	116	152.1 Å²	152.1	71%	0.712	79%	0.787	S	S	*	*			trans	-39.9	149	171.5	-32.5	0	0	0	0	113.6
23	E	45	Very low	54.2	Low	185 Å²	185	154 Å²	154	86%	0.864	79%	0.787	S	S	*	*	S	Bend	trans	97.4	112.9	162	-54.6	-175.8	80.5	0	0	117.5
24	D	41.2	Very low	53.9	Low	136 Å²	136	150 Å²	150	73%	0.727	79%	0.785	S	S	*	*			trans	58.5	102	165.4	-137.8	-90.9	0	0	0	118.4	A26	D24-A26 PolarHBondContact O-N 2.81Å; D24-A26 PolarHBondContact OD1-N 3.38Å
25	P	41.3	Very low	54	Low	116 Å²	116	146.8 Å²	146.8	75%	0.753	77%	0.766	S	S	*	*			trans	-80.3	58.3	166.2	36.7	-32.9	0	0	0	109.1	H27	P25-H27 VanDerWaalsContact C-N 3.26Å; P25-H27 PolarHBondContact O-CD2 2.89Å; P25-H27 PolarHBondContact O-N 3.22Å
26	A	49.9	Very low	54.3	Low	71 Å²	71	148.8 Å²	148.8	59%	0.587	77%	0.771	S	S	*	*			trans	-58.9	102.5	157.7	0	0	0	0	0	105.7	D24 R28	D24-A26 PolarHBondContact O-N 2.81Å; D24-A26 PolarHBondContact OD1-N 3.38Å; A26-R28 PolarHBondContact O-N 2.84Å
27	H	52.2	Low	55.3	Low	159 Å²	159	145.8 Å²	145.8	74%	0.736	75%	0.754	S	S	*	*			trans	-40.9	104.2	-172.5	-55.9	160.4	0	0	0	109.8	P25 K29	P25-H27 VanDerWaalsContact C-N 3.26Å; P25-H27 PolarHBondContact O-CD2 2.89Å; P25-H27 PolarHBondContact O-N 3.22Å; H27-K29 HydrophobicContact CB-CG 4.49Å; H27-K29 PolarHBondContact O-N 3.27Å
28	R	56.4	Low	56.4	Low	241 Å²	241	140.4 Å²	140.4	91%	0.909	73%	0.732	S	S	*	*			trans	-63.6	85.9	162.2	-77.2	-169.9	-99.6	-170.6	-5.7	104.6	A26 L30	A26-R28 PolarHBondContact O-N 2.84Å; R28-L30 VanDerWaalsContact C-N 3.26Å; R28-L30 PolarHBondContact O-N 3.38Å
29	K	57.7	Low	57.8	Low	186 Å²	186	146.2 Å²	146.2	81%	0.809	74%	0.736	S	S	*	*			trans	-56.5	101	173.8	-66.1	-175.8	-177.4	-172.8	0	103.6	H27 G31	H27-K29 HydrophobicContact CB-CG 4.49Å; H27-K29 PolarHBondContact O-N 3.27Å; K29-G31 PolarHBondContact O-N 3.47Å
30	L	60.2	Low	59.5	Low	174 Å²	174	148.2 Å²	148.2	91%	0.911	73%	0.732	S	S	*	*			trans	-54.6	94.3	164.2	-76.2	162	0	0	0	104.3	R28 K32	R28-L30 VanDerWaalsContact C-N 3.26Å; R28-L30 PolarHBondContact O-N 3.38Å; L30-K32 PolarHBondContact O-N 3.17Å
31	G	58.5	Low	61.1	Low	57 Å²	57	142.1 Å²	142.1	59%	0.588	70%	0.699	S	S	*	*			trans	-52.8	138.5	176.5	0	0	0	0	0	106.2	K29 L33	K29-G31 PolarHBondContact O-N 3.47Å; G31-L33 PolarHBondContact O-N 3.38Å
32	K	60.8	Low	63	Low	202 Å²	202	136 Å²	136	88%	0.878	68%	0.675	S	S	*	*			trans	-61	89.9	174.8	-71.7	163.8	177.9	172.5	0	107.3	L30 T34	L30-K32 PolarHBondContact O-N 3.17Å; K32-T34 PolarHBondContact O-N 2.89Å
33	L	53.6	Low	64.9	Low	158 Å²	158	135.9 Å²	135.9	83%	0.827	67%	0.667	S	S	*	*			trans	-76.9	-8.6	176.7	-170.1	64	0	0	0	110.5	G31 V35	G31-L33 PolarHBondContact O-N 3.38Å; L33-V35 PolarHBondContact O-N 3.42Å
34	T	62.3	Low	67	Low	118 Å²	118	134.2 Å²	134.2	72%	0.724	65%	0.652	S	S	*	*	S	Bend	trans	-82.2	108.2	175.5	49.5	0	0	0	0	109.5	K32 K36	K32-T34 PolarHBondContact O-N 2.89Å; T34-K36 PolarHBondContact O-N 3.45Å
35	V	66.2	Low	69.1	Low	53 Å²	53	129.2 Å²	129.2	32%	0.321	62%	0.623	S	S	.	*			trans	-56.6	128	162.9	175.6	0	0	0	0	107.9	L33 Y37 M117	L33-V35 PolarHBondContact O-N 3.42Å; V35-Y37 HydrophobicContact CB-CE2 4.29Å; V35-Y37 HydrophobicContact CG1-CE1 4.15Å; V35-Y37 VanDerWaalsContact O-CD2 3.31Å; V35-Y37 WeakPolarHBondContact O-CD2 3.28Å; V35-Y37 WeakPolarHBondContact O-CE2 3.34Å; V35-Y37 PolarHBondContact O-N 3Å; V35-M117 WeakPolarHBondContact CG1-O 3.45Å
36	K	71.2	Confident	71.3	Confident	201 Å²	201	128.2 Å²	128.2	87%	0.874	61%	0.611	S	S	*	*			trans	-84.2	108.2	179.8	-174.8	-178.8	176.9	-179.9	0	109.2	T34	T34-K36 PolarHBondContact O-N 3.45Å
37	Y	77.8	Confident	73.2	Confident	135 Å²	135	128.3 Å²	128.3	53%	0.529	60%	0.602	S	S	.	*			trans	-81.5	145.8	173.8	-57	-81.1	0	0	0	111.8	V35 L42 M117	V35-Y37 HydrophobicContact CB-CE2 4.29Å; V35-Y37 HydrophobicContact CG1-CE1 4.15Å; V35-Y37 VanDerWaalsContact O-CD2 3.31Å; V35-Y37 WeakPolarHBondContact O-CD2 3.28Å; V35-Y37 WeakPolarHBondContact O-CE2 3.34Å; V35-Y37 PolarHBondContact O-N 3Å; Y37-L42 HydrophobicContact CD1-CD2 4.36Å; Y37-L42 HydrophobicContact CG-CD1 4.37Å; Y37-M117 HydrophobicContact CD1-CB 4.06Å; Y37-M117 HydrophobicContact CD1-CG 4.41Å; Y37-M117 HydrophobicContact CD1-SD 3.91Å; Y37-M117 HydrophobicContact CE1-CB 3.97Å; Y37-M117 HydrophobicContact CE1-SD 4.44Å
38	N	82.8	Confident	75	Confident	82 Å²	82	120.9 Å²	120.9	44%	0.439	57%	0.568	S	S	.	*			trans	-94.5	124.9	171.3	-174.6	-49.9	0	0	0	109.2	K40 D41 L42	N38-K40 PolarHBondContact O-N 3.25Å; N38-K40 WeakPolarHBondContact OD1-CB 3.47Å; N38-K40 PolarHBondContact OD1-N 2.96Å; N38-D41 HydrophobicContact CB-CB 3.88Å; N38-D41 WeakPolarHBondContact O-CB 3.49Å; N38-D41 PolarHBondContact O-N 2.79Å; N38-L42 PolarHBondContact O-N 2.98Å
39	R	85.5	Confident	76.5	Confident	206 Å²	206	113.5 Å²	113.5	78%	0.777	54%	0.543	S	S	*	.	H	α-helix	trans	-54	-38.6	-179.6	-175.9	179.1	177.3	100	2.2	113.2	D41 Q43	R39-D41 VanDerWaalsContact C-N 3.33Å; R39-Q43 WeakPolarHBondContact O-CB 2.99Å; R39-Q43 PolarHBondContact O-N 2.98Å
40	K	85.7	Confident	77.9	Confident	169 Å²	169	111.8 Å²	111.8	74%	0.735	54%	0.538	S	S	*	.	H	α-helix	trans	-70.5	-33.2	179.5	-64.1	-173.4	175	-174.6	0	112.2	N38 R44	N38-K40 PolarHBondContact O-N 3.25Å; N38-K40 WeakPolarHBondContact OD1-CB 3.47Å; N38-K40 PolarHBondContact OD1-N 2.96Å; K40-R44 WeakPolarHBondContact O-CG 3.42Å; K40-R44 PolarHBondContact O-N 3.44Å
41	D	83.1	Confident	79.4	Confident	20 Å²	20	106.3 Å²	106.3	11%	0.107	51%	0.505	C	S	.	.	H	α-helix	trans	-73.8	-44.2	179.2	-161.1	-121.2	0	0	0	110.1	N38 R39 Q43 R44 R45 M117	N38-D41 HydrophobicContact CB-CB 3.88Å; N38-D41 WeakPolarHBondContact O-CB 3.49Å; N38-D41 PolarHBondContact O-N 2.79Å; R39-D41 VanDerWaalsContact C-N 3.33Å; D41-Q43 VanDerWaalsContact C-N 3.3Å; D41-Q43 PolarHBondContact O-N 3.16Å; D41-R44 WeakPolarHBondContact O-CB 3.29Å; D41-R44 PolarHBondContact O-N 2.65Å; D41-R44 VanDerWaalsContact O-N 3.13Å; D41-R45 PolarHBondContact O-N 3.29Å; D41-M117 HydrophobicContact CB-CE 4.14Å; D41-M117 VanDerWaalsContact O-CE 3.27Å; D41-M117 WeakPolarHBondContact O-CE 3.13Å; D41-M117 WeakPolarHBondContact OD1-CE 3.44Å; D41-M117 WeakPolarHBondContact OD1-CG 3.37Å
42	L	84.5	Confident	80.7	Confident	72 Å²	72	104.2 Å²	104.2	38%	0.377	48%	0.481	S	S	.	.	H	α-helix	trans	-55.6	-45.3	169.9	-75.4	169.2	0	0	0	111.6	Y37 N38 R44 R45 L46 M117	Y37-L42 HydrophobicContact CD1-CD2 4.36Å; Y37-L42 HydrophobicContact CG-CD1 4.37Å; N38-L42 PolarHBondContact O-N 2.98Å; L42-R44 VanDerWaalsContact C-N 3.33Å; L42-R44 PolarHBondContact O-N 3.04Å; L42-R45 PolarHBondContact O-N 3.44Å; L42-L46 WeakPolarHBondContact O-CG 3.44Å; L42-L46 PolarHBondContact O-N 3.33Å; L42-M117 HydrophobicContact CD2-CE 4.02Å; L42-M117 HydrophobicContact CD2-SD 3.5Å; L42-M117 VanDerWaalsContact CD2-SD 3.5Å; L42-M117 HydrophobicContact CG-CE 4.28Å; L42-M117 HydrophobicContact CG-SD 4.07Å
43	Q	87.8	Confident	81.8	Confident	112 Å²	112	100 Å²	100	52%	0.523	47%	0.468	S	S	.	.	H	α-helix	trans	-62.9	-40.2	177.3	-168.2	65	63.2	0	0	112.3	R39 D41 R45 L46 D47	R39-Q43 WeakPolarHBondContact O-CB 2.99Å; R39-Q43 PolarHBondContact O-N 2.98Å; D41-Q43 VanDerWaalsContact C-N 3.3Å; D41-Q43 PolarHBondContact O-N 3.16Å; Q43-R45 VanDerWaalsContact C-N 3.35Å; Q43-L46 PolarHBondContact O-N 3.46Å; Q43-D47 WeakPolarHBondContact O-CB 3.47Å; Q43-D47 PolarHBondContact O-N 2.96Å
44	R	87.5	Confident	83.3	Confident	151 Å²	151	93.9 Å²	93.9	57%	0.57	44%	0.443	S	S	*	.	H	α-helix	trans	-64.6	-40.1	174.6	-79.8	-173.2	-178.5	-173.4	-1.8	111.9	K40 D41 L42 D47 I48 L114	K40-R44 WeakPolarHBondContact O-CG 3.42Å; K40-R44 PolarHBondContact O-N 3.44Å; D41-R44 WeakPolarHBondContact O-CB 3.29Å; D41-R44 PolarHBondContact O-N 2.65Å; D41-R44 VanDerWaalsContact O-N 3.13Å; L42-R44 VanDerWaalsContact C-N 3.33Å; L42-R44 PolarHBondContact O-N 3.04Å; R44-D47 PolarHBondContact O-N 3.42Å; R44-I48 VanDerWaalsContact O-CG1 3.23Å; R44-I48 WeakPolarHBondContact O-CG1 3.41Å; R44-I48 PolarHBondContact O-N 3.2Å; R44-L114 HydrophobicContact CB-CD1 3.7Å
45	R	86.5	Confident	84.3	Confident	30 Å²	30	90.9 Å²	90.9	11%	0.113	42%	0.421	C	S	.	.	H	α-helix	trans	-61.1	-46.6	176.6	179.3	58.1	170.4	-112.2	-5.8	111.2	D41 L42 Q43 D47 I48 E49 I74 D75 M117	D41-R45 PolarHBondContact O-N 3.29Å; L42-R45 PolarHBondContact O-N 3.44Å; Q43-R45 VanDerWaalsContact C-N 3.35Å; R45-D47 PolarHBondContact O-N 3.47Å; R45-I48 WeakPolarHBondContact O-CB 3.29Å; R45-I48 PolarHBondContact O-N 3.37Å; R45-E49 WeakPolarHBondContact CD-OE1 3.46Å; R45-E49 WeakPolarHBondContact CG-OE1 3.43Å; R45-E49 IonicContact CZ-OE1 2.79Å; R45-E49 IonicContact NE-OE1 3.58Å; R45-E49 PolarHBondContact NE-OE1 2.88Å; R45-E49 IonicContact NH2-OE1 2.93Å; R45-E49 WeakPolarHBondContact O-CG 3.43Å; R45-E49 PolarHBondContact O-N 3.4Å; R45-I74 VanDerWaalsContact NE-CD1 3.26Å; R45-I74 VanDerWaalsContact NH1-CB 3.33Å; R45-D75 IonicContact CZ-OD2 3.86Å; R45-D75 VanDerWaalsContact CZ-OD2 3.27Å; R45-D75 IonicContact NH1-OD1 2.73Å; R45-D75 IonicContact NH1-OD2 3.73Å; R45-D75 PolarHBondContact NH1-OD2 2.91Å; R45-D75 IonicContact NH2-OD2 2.88Å; R45-D75 PolarHBondContact NH2-OD2 2.9Å; R45-M117 HydrophobicContact CB-CE 3.55Å; R45-M117 HydrophobicContact CG-CE 4.18Å
46	L	87.5	Confident	84.9	Confident	95 Å²	95	89.5 Å²	89.5	50%	0.497	41%	0.412	S	S	.	.	H	α-helix	trans	-61.3	-42.4	175.4	-69.2	171	0	0	0	112.6	L42 Q43 I48 E49 E50	L42-L46 WeakPolarHBondContact O-CG 3.44Å; L42-L46 PolarHBondContact O-N 3.33Å; Q43-L46 PolarHBondContact O-N 3.46Å; L46-I48 PolarHBondContact O-N 2.89Å; L46-E49 PolarHBondContact O-N 3.04Å; L46-E50 WeakPolarHBondContact O-CB 3.44Å; L46-E50 PolarHBondContact O-N 3.25Å
47	D	89.8	Confident	85.2	Confident	73 Å²	73	86.5 Å²	86.5	39%	0.39	40%	0.4	S	S	.	.	H	α-helix	trans	-60	-36.9	175.8	-173.8	-102	0	0	0	111.8	Q43 R44 R45 W51 R110	Q43-D47 WeakPolarHBondContact O-CB 3.47Å; Q43-D47 PolarHBondContact O-N 2.96Å; R44-D47 PolarHBondContact O-N 3.42Å; R45-D47 PolarHBondContact O-N 3.47Å; D47-W51 VanDerWaalsContact O-CB 3.24Å; D47-W51 WeakPolarHBondContact O-CB 3.07Å; D47-W51 PolarHBondContact O-N 2.81Å; D47-R110 IonicContact OD1-NH1 2.92Å; D47-R110 PolarHBondContact OD1-NH1 3.39Å
48	I	89.3	Confident	85.3	Confident	4 Å²	4	85.1 Å²	85.1	2%	0.021	40%	0.402	C	S	.	.	H	α-helix	trans	-71.2	-45	176	-64.6	171.6	0	0	0	110.8	R44 R45 L46 W51 I52 I74 L107 R110 I111 L114	R44-I48 VanDerWaalsContact O-CG1 3.23Å; R44-I48 WeakPolarHBondContact O-CG1 3.41Å; R44-I48 PolarHBondContact O-N 3.2Å; R45-I48 WeakPolarHBondContact O-CB 3.29Å; R45-I48 PolarHBondContact O-N 3.37Å; L46-I48 PolarHBondContact O-N 2.89Å; I48-W51 PolarHBondContact O-N 2.93Å; I48-I52 HydrophobicContact CG2-CD1 3.88Å; I48-I52 HydrophobicContact CG2-CG1 4.31Å; I48-I52 VanDerWaalsContact O-CG1 3.25Å; I48-I52 WeakPolarHBondContact O-CG1 3.3Å; I48-I52 PolarHBondContact O-N 3.18Å; I48-I74 HydrophobicContact CB-CD1 4.34Å; I48-I74 HydrophobicContact CG2-CD1 3.69Å; I48-I74 HydrophobicContact CG2-CG1 4.38Å; I48-L107 HydrophobicContact CG2-CD1 3.79Å; I48-R110 HydrophobicContact CD1-CB 4.25Å; I48-R110 WeakPolarHBondContact CD1-O 3.39Å; I48-R110 HydrophobicContact CG1-CB 4.07Å; I48-I111 HydrophobicContact CD1-CG2 4.26Å; I48-I111 HydrophobicContact CG2-CG2 4.27Å; I48-L114 HydrophobicContact CD1-CD1 3.79Å; I48-L114 HydrophobicContact CD1-CD2 4.17Å; I48-L114 HydrophobicContact CD1-CG 4.4Å
49	E	87.6	Confident	84.8	Confident	85 Å²	85	82 Å²	82	40%	0.397	39%	0.385	S	S	.	.	H	α-helix	trans	-61	-45.7	178	-73.8	170.5	-170.3	0	0	111.5	R45 L46 W51 I52 D53 I74	R45-E49 WeakPolarHBondContact CD-OE1 3.46Å; R45-E49 WeakPolarHBondContact CG-OE1 3.43Å; R45-E49 IonicContact CZ-OE1 2.79Å; R45-E49 IonicContact NE-OE1 3.58Å; R45-E49 PolarHBondContact NE-OE1 2.88Å; R45-E49 IonicContact NH2-OE1 2.93Å; R45-E49 WeakPolarHBondContact O-CG 3.43Å; R45-E49 PolarHBondContact O-N 3.4Å; L46-E49 PolarHBondContact O-N 3.04Å; E49-W51 VanDerWaalsContact C-N 3.32Å; E49-W51 PolarHBondContact O-N 3.36Å; E49-I52 PolarHBondContact O-N 3.04Å; E49-D53 PolarHBondContact O-N 3.35Å; E49-I74 HydrophobicContact CG-CD1 3.91Å
50	E	88.5	Confident	84	Confident	151 Å²	151	73.3 Å²	73.3	71%	0.706	35%	0.353	S	S	*	.	H	α-helix	trans	-63.1	-38.9	175.3	-174	176.7	90.4	0	0	111.8	L46 G54	L46-E50 WeakPolarHBondContact O-CB 3.44Å; L46-E50 PolarHBondContact O-N 3.25Å; E50-G54 PolarHBondContact O-N 2.81Å
51	W	90.6	Very high	82.8	Confident	58 Å²	58	71.7 Å²	71.7	22%	0.22	35%	0.352	C	S	.	.	H	α-helix	trans	-66.8	-40.8	174.8	177.1	80.9	0	0	0	112.2	D47 I48 E49 G54 Q55 F103 L107	D47-W51 VanDerWaalsContact O-CB 3.24Å; D47-W51 WeakPolarHBondContact O-CB 3.07Å; D47-W51 PolarHBondContact O-N 2.81Å; I48-W51 PolarHBondContact O-N 2.93Å; E49-W51 VanDerWaalsContact C-N 3.32Å; E49-W51 PolarHBondContact O-N 3.36Å; W51-G54 PolarHBondContact O-N 3.44Å; W51-Q55 HydrophobicContact CD2-CG 3.89Å; W51-Q55 HydrophobicContact CE3-CG 4.37Å; W51-Q55 HydrophobicContact CG-CG 4.39Å; W51-Q55 HydrophobicContact CH2-CG 4Å; W51-Q55 HydrophobicContact CZ2-CG 3.5Å; W51-Q55 HydrophobicContact CZ3-CG 4.39Å; W51-Q55 WeakPolarHBondContact O-CB 3.12Å; W51-Q55 VanDerWaalsContact O-CG 3.29Å; W51-Q55 WeakPolarHBondContact O-CG 3.25Å; W51-Q55 PolarHBondContact O-N 2.93Å; W51-F103 AromaticContact CH2-CD2 3.89Å; W51-F103 HydrophobicContact CH2-CD2 3.89Å; W51-F103 HydrophobicContact CH2-CE2 4.18Å; W51-F103 WeakPolarHBondContact CH2-O 3.24Å; W51-F103 HydrophobicContact CZ3-CD2 4.1Å; W51-F103 AromaticContact CZ3-CE2 3.9Å; W51-F103 HydrophobicContact CZ3-CE2 3.9Å; W51-L107 HydrophobicContact CE3-CD1 4.48Å; W51-L107 HydrophobicContact CH2-CB 4.1Å; W51-L107 VanDerWaalsContact CH2-N 3.27Å; W51-L107 HydrophobicContact CZ3-CB 3.7Å; W51-L107 HydrophobicContact CZ3-CD1 4.04Å; W51-L107 HydrophobicContact CZ3-CG 4.41Å
52	I	86.3	Confident	81.3	Confident	13 Å²	13	73.6 Å²	73.6	7%	0.067	37%	0.367	C	S	.	.	H	α-helix	trans	-58.8	-52.1	175.4	-72.9	166.1	0	0	0	109.4	I48 E49 G54 Q55 L56 I72 I74 F103 L107	I48-I52 HydrophobicContact CG2-CD1 3.88Å; I48-I52 HydrophobicContact CG2-CG1 4.31Å; I48-I52 VanDerWaalsContact O-CG1 3.25Å; I48-I52 WeakPolarHBondContact O-CG1 3.3Å; I48-I52 PolarHBondContact O-N 3.18Å; E49-I52 PolarHBondContact O-N 3.04Å; I52-G54 PolarHBondContact O-N 3.26Å; I52-Q55 PolarHBondContact O-N 3.4Å; I52-L56 HydrophobicContact CG2-CD1 3.64Å; I52-L56 HydrophobicContact CG2-CG 4.06Å; I52-L56 WeakPolarHBondContact O-CB 3.44Å; I52-L56 VanDerWaalsContact O-CG 3.29Å; I52-L56 WeakPolarHBondContact O-CG 3.49Å; I52-L56 PolarHBondContact O-N 3.49Å; I52-I72 HydrophobicContact CD1-CG2 4.37Å; I52-I72 HydrophobicContact CG2-CD1 3.88Å; I52-I74 HydrophobicContact CD1-CD1 3.95Å; I52-I74 HydrophobicContact CD1-CG1 4.14Å; I52-F103 HydrophobicContact CG1-CE2 4.45Å; I52-F103 HydrophobicContact CG1-CZ 4.33Å; I52-F103 HydrophobicContact CG2-CE2 4.41Å; I52-F103 HydrophobicContact CG2-CZ 4.16Å; I52-L107 HydrophobicContact CD1-CD1 3.65Å; I52-L107 HydrophobicContact CD1-CD2 4.34Å; I52-L107 HydrophobicContact CG1-CD1 3.76Å; I52-L107 HydrophobicContact CG1-CD2 4.44Å
53	D	83.4	Confident	79.5	Confident	113 Å²	113	78.7 Å²	78.7	60%	0.604	39%	0.388	S	S	*	.	H	α-helix	trans	-55.7	-49.7	179.4	-175.2	-97.3	0	0	0	111.5	E49 Q55 L56 H57	E49-D53 PolarHBondContact O-N 3.35Å; D53-Q55 PolarHBondContact O-N 2.81Å; D53-L56 PolarHBondContact O-N 3.24Å; D53-H57 WeakPolarHBondContact O-CB 3.37Å; D53-H57 PolarHBondContact O-N 3.32Å
54	G	84.9	Confident	77.7	Confident	31 Å²	31	82.6 Å²	82.6	32%	0.32	41%	0.407	S	S	.	.	H	α-helix	trans	-63.2	-37.5	177.6	0	0	0	0	0	113.6	E50 W51 I52 L58	E50-G54 PolarHBondContact O-N 2.81Å; W51-G54 PolarHBondContact O-N 3.44Å; I52-G54 PolarHBondContact O-N 3.26Å; G54-L58 WeakPolarHBondContact O-CG 3.38Å; G54-L58 PolarHBondContact O-N 2.89Å
55	Q	83.4	Confident	75.8	Confident	55 Å²	55	84.7 Å²	84.7	26%	0.257	42%	0.423	S	S	.	.	H	α-helix	trans	-72.1	-38.8	175	-70.1	-56.1	-82.2	0	0	112.6	W51 I52 D53 H57 L58 L59 F103	W51-Q55 HydrophobicContact CD2-CG 3.89Å; W51-Q55 HydrophobicContact CE3-CG 4.37Å; W51-Q55 HydrophobicContact CG-CG 4.39Å; W51-Q55 HydrophobicContact CH2-CG 4Å; W51-Q55 HydrophobicContact CZ2-CG 3.5Å; W51-Q55 HydrophobicContact CZ3-CG 4.39Å; W51-Q55 WeakPolarHBondContact O-CB 3.12Å; W51-Q55 VanDerWaalsContact O-CG 3.29Å; W51-Q55 WeakPolarHBondContact O-CG 3.25Å; W51-Q55 PolarHBondContact O-N 2.93Å; I52-Q55 PolarHBondContact O-N 3.4Å; D53-Q55 PolarHBondContact O-N 2.81Å; Q55-H57 VanDerWaalsContact C-N 3.3Å; Q55-L58 PolarHBondContact O-N 3.22Å; Q55-L59 WeakPolarHBondContact O-CB 3.41Å; Q55-L59 WeakPolarHBondContact O-CD1 3.33Å; Q55-L59 PolarHBondContact O-N 3.47Å; Q55-F103 HydrophobicContact CB-CD2 3.48Å; Q55-F103 VanDerWaalsContact CB-CD2 3.48Å; Q55-F103 HydrophobicContact CB-CE2 3.72Å; Q55-F103 HydrophobicContact CG-CD2 4.03Å; Q55-F103 HydrophobicContact CG-CE2 4.42Å
56	L	79.4	Confident	74.1	Confident	24 Å²	24	90.4 Å²	90.4	13%	0.126	45%	0.451	C	S	.	.	H	α-helix	trans	-62.1	-41.5	174.8	-71.8	176.7	0	0	0	110.3	I52 D53 L58 L59 F60 L70 I72 L93 F103	I52-L56 HydrophobicContact CG2-CD1 3.64Å; I52-L56 HydrophobicContact CG2-CG 4.06Å; I52-L56 WeakPolarHBondContact O-CB 3.44Å; I52-L56 VanDerWaalsContact O-CG 3.29Å; I52-L56 WeakPolarHBondContact O-CG 3.49Å; I52-L56 PolarHBondContact O-N 3.49Å; D53-L56 PolarHBondContact O-N 3.24Å; L56-L58 VanDerWaalsContact C-N 3.33Å; L56-L58 PolarHBondContact O-N 2.84Å; L56-L59 PolarHBondContact O-N 3.25Å; L56-F60 HydrophobicContact CD2-CD2 4.38Å; L56-F60 HydrophobicContact CD2-CE2 4.02Å; L56-F60 WeakPolarHBondContact O-CB 3.23Å; L56-F60 WeakPolarHBondContact O-CD2 3.49Å; L56-F60 PolarHBondContact O-N 2.89Å; L56-L70 HydrophobicContact CD1-CD2 4.48Å; L56-L70 HydrophobicContact CD2-CD2 4.03Å; L56-I72 HydrophobicContact CD1-CD1 4.43Å; L56-L93 HydrophobicContact CD2-CD2 3.97Å; L56-F103 HydrophobicContact CD2-CZ 4.37Å
57	H	77.9	Confident	72.4	Confident	137 Å²	137	89.4 Å²	89.4	63%	0.634	45%	0.445	S	S	*	.	H	α-helix	trans	-57.5	-44.3	174.6	-165.3	80.6	0	0	0	112.2	D53 Q55 D61	D53-H57 WeakPolarHBondContact O-CB 3.37Å; D53-H57 PolarHBondContact O-N 3.32Å; Q55-H57 VanDerWaalsContact C-N 3.3Å; H57-D61 PolarHBondContact O-N 2.89Å
58	L	78.6	Confident	71	Confident	106 Å²	106	88.4 Å²	88.4	56%	0.555	44%	0.443	S	S	*	.	H	α-helix	trans	-70	-38.9	176.1	-67.6	167.6	0	0	0	113	G54 Q55 L56 K98	G54-L58 WeakPolarHBondContact O-CG 3.38Å; G54-L58 PolarHBondContact O-N 2.89Å; Q55-L58 PolarHBondContact O-N 3.22Å; L56-L58 VanDerWaalsContact C-N 3.33Å; L56-L58 PolarHBondContact O-N 2.84Å; L58-K98 PolarHBondContact O-NZ 3.4Å
59	L	73.6	Confident	69.8	Low	17 Å²	17	98.2 Å²	98.2	9%	0.089	49%	0.488	C	S	.	.	H	α-helix	trans	-70	-39.7	-179	-109.6	107.8	0	0	0	111.8	Q55 L56 C96 K98 K100 F103	Q55-L59 WeakPolarHBondContact O-CB 3.41Å; Q55-L59 WeakPolarHBondContact O-CD1 3.33Å; Q55-L59 PolarHBondContact O-N 3.47Å; L56-L59 PolarHBondContact O-N 3.25Å; L59-C96 HydrophobicContact CD2-CB 4.42Å; L59-K98 WeakPolarHBondContact O-CD 3.5Å; L59-K98 VanDerWaalsContact O-CE 3.28Å; L59-K98 WeakPolarHBondContact O-CE 3.42Å; L59-K98 PolarHBondContact O-NZ 2.91Å; L59-K100 HydrophobicContact CD2-CB 4.35Å; L59-F103 HydrophobicContact CD1-CB 3.78Å; L59-F103 HydrophobicContact CD1-CD2 4.36Å; L59-F103 HydrophobicContact CD1-CG 4.26Å
60	F	67.4	Low	69	Low	24 Å²	24	95.6 Å²	95.6	11%	0.105	48%	0.477	C	S	.	.	H	α-helix	trans	-80	-45.6	179.4	-78.9	-85.1	0	0	0	111.1	L56 C62 I67 L93 C96 K98	L56-F60 HydrophobicContact CD2-CD2 4.38Å; L56-F60 HydrophobicContact CD2-CE2 4.02Å; L56-F60 WeakPolarHBondContact O-CB 3.23Å; L56-F60 WeakPolarHBondContact O-CD2 3.49Å; L56-F60 PolarHBondContact O-N 2.89Å; F60-C62 PolarHBondContact O-N 3.09Å; F60-I67 HydrophobicContact CB-CD1 4.11Å; F60-I67 HydrophobicContact CB-CG1 3.89Å; F60-I67 HydrophobicContact CD1-CG1 4.43Å; F60-I67 HydrophobicContact CG-CG1 4.18Å; F60-L93 HydrophobicContact CE2-CD2 4.46Å; F60-C96 VanDerWaalsContact CE1-SG 3.6Å; F60-C96 WeakPolarHBondContact CE2-SG 3.41Å; F60-C96 WeakPolarHBondContact CZ-SG 3.48Å; F60-K98 PolarHBondContact O-NZ 3.42Å
61	D	61.6	Low	68.5	Low	134 Å²	134	95.5 Å²	95.5	72%	0.717	48%	0.476	S	S	*	.			trans	40.6	22.5	-177.7	-149.2	-110.8	0	0	0	113.4	H57	H57-D61 PolarHBondContact O-N 2.89Å
62	C	50.8	Low	68.1	Low	61 Å²	61	93.7 Å²	93.7	41%	0.412	47%	0.471	S	S	.	.	S	Bend	trans	-104.3	146.7	-171.8	-115	0	0	0	0	107.2	F60 E64	F60-C62 PolarHBondContact O-N 3.09Å; C62-E64 PolarHBondContact O-N 2.92Å
63	E	46.7	Very low	68	Low	178 Å²	178	96.9 Å²	96.9	83%	0.832	49%	0.488	S	S	*	.			trans	-46.4	138.9	168	-74.7	172.8	81.6	0	0	109.1	E65 E66	E63-E65 PolarHBondContact O-N 3.04Å; E63-E66 PolarHBondContact O-N 3.13Å
64	E	50.8	Low	68.1	Low	195 Å²	195	91.5 Å²	91.5	91%	0.911	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.3	-6.8	-172.9	-168.3	171	79.2	0	0	116	C62	C62-E64 PolarHBondContact O-N 2.92Å
65	E	47.7	Very low	68	Low	194 Å²	194	92.2 Å²	92.2	91%	0.907	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-14.6	-174.4	-155	165.9	106.6	0	0	114.6	E63	E63-E65 PolarHBondContact O-N 3.04Å
66	E	49.5	Very low	68.2	Low	151 Å²	151	93.8 Å²	93.8	71%	0.706	46%	0.463	S	S	*	.	S	Bend	trans	-117.4	5.8	-175.4	-110.4	-178.1	110	0	0	115	E63 P68	E63-E66 PolarHBondContact O-N 3.13Å; E66-P68 WeakPolarHBondContact O-CD 3.32Å
67	I	53	Low	68.6	Low	74 Å²	74	92.9 Å²	92.9	38%	0.379	46%	0.458	S	S	.	.			trans	-83.7	102.6	171.6	-55.5	177.3	0	0	0	106.9	F60	F60-I67 HydrophobicContact CB-CD1 4.11Å; F60-I67 HydrophobicContact CB-CG1 3.89Å; F60-I67 HydrophobicContact CD1-CG1 4.43Å; F60-I67 HydrophobicContact CG-CG1 4.18Å
68	P	60.2	Low	68.9	Low	51 Å²	51	88.5 Å²	88.5	33%	0.331	44%	0.439	S	S	.	.			trans	-56.8	151.6	170.7	25	-33.3	0	0	0	109.1	E66 L70	E66-P68 WeakPolarHBondContact O-CD 3.32Å; P68-L70 PolarHBondContact O-N 3.44Å
69	E	63.1	Low	69.3	Low	210 Å²	210	90.3 Å²	90.3	98%	0.981	45%	0.445	S	S	*	.			trans	-63.3	73.5	171.1	-71.8	175.4	83.9	0	0	109.7	E71	E69-E71 PolarHBondContact O-N 3.46Å
70	L	70.7	Confident	69.9	Low	31 Å²	31	92 Å²	92	16%	0.162	45%	0.454	C	S	.	.			trans	-86.2	93.8	-174.7	-163.3	101.5	0	0	0	108.8	L56 P68 I72 L92 L93	L56-L70 HydrophobicContact CD1-CD2 4.48Å; L56-L70 HydrophobicContact CD2-CD2 4.03Å; P68-L70 PolarHBondContact O-N 3.44Å; L70-I72 HydrophobicContact CD2-CD1 4.08Å; L70-I72 HydrophobicContact CD2-CG1 4.04Å; L70-L92 HydrophobicContact CD1-CB 3.99Å; L70-L92 HydrophobicContact CD1-CD2 3.73Å; L70-L92 WeakPolarHBondContact CD1-O 3.33Å; L70-L92 HydrophobicContact CD2-CB 4.32Å; L70-L92 HydrophobicContact CG-CB 4.42Å; L70-L92 HydrophobicContact CG-CD2 3.92Å; L70-L93 HydrophobicContact CD2-CD2 4.12Å
71	E	77.9	Confident	70.8	Confident	148 Å²	148	95.1 Å²	95.1	69%	0.692	48%	0.477	S	S	*	.			trans	-87.5	121.8	174	-169.1	170	-172.6	0	0	110.1	E69	E69-E71 PolarHBondContact O-N 3.46Å
72	I	83.2	Confident	71.9	Confident	20 Å²	20	93.5 Å²	93.5	10%	0.103	47%	0.468	C	S	.	.			trans	-99.8	101	176.2	-61.3	177	0	0	0	109	I52 L56 L70 I74 L77 L89 F103 L107	I52-I72 HydrophobicContact CD1-CG2 4.37Å; I52-I72 HydrophobicContact CG2-CD1 3.88Å; L56-I72 HydrophobicContact CD1-CD1 4.43Å; L70-I72 HydrophobicContact CD2-CD1 4.08Å; L70-I72 HydrophobicContact CD2-CG1 4.04Å; I72-I74 PolarHBondContact O-N 3.48Å; I72-I74 VanDerWaalsContact O-N 3.08Å; I72-L77 HydrophobicContact CG2-CD1 3.73Å; I72-L89 HydrophobicContact CD1-CD2 4.25Å; I72-L89 HydrophobicContact CG2-CD2 3.92Å; I72-F103 HydrophobicContact CD1-CE1 3.79Å; I72-F103 HydrophobicContact CD1-CZ 3.55Å; I72-L107 HydrophobicContact CG2-CD2 3.94Å
73	D	83.9	Confident	73.6	Confident	80 Å²	80	98.4 Å²	98.4	43%	0.428	49%	0.485	S	S	.	.			trans	-72.9	95.8	176.8	-79.6	-71.6	0	0	0	112.5	D75 E76 L77	D73-D75 PolarHBondContact O-N 2.95Å; D73-E76 HydrophobicContact CB-CB 3.74Å; D73-E76 WeakPolarHBondContact O-CB 3.27Å; D73-E76 PolarHBondContact O-N 3.06Å; D73-E76 VanDerWaalsContact O-N 3.12Å; D73-L77 WeakPolarHBondContact O-CG 3.46Å; D73-L77 PolarHBondContact O-N 3.01Å
74	I	85.7	Confident	75.5	Confident	0 Å²	0	90.9 Å²	90.9	0%	0	46%	0.455	C	S	.	.	H	α-helix	trans	-63.2	-29.9	177.6	-61.7	154.6	0	0	0	111.6	R45 I48 E49 I52 I72 E76 L77 L78 I111 L114	R45-I74 VanDerWaalsContact NE-CD1 3.26Å; R45-I74 VanDerWaalsContact NH1-CB 3.33Å; I48-I74 HydrophobicContact CB-CD1 4.34Å; I48-I74 HydrophobicContact CG2-CD1 3.69Å; I48-I74 HydrophobicContact CG2-CG1 4.38Å; E49-I74 HydrophobicContact CG-CD1 3.91Å; I52-I74 HydrophobicContact CD1-CD1 3.95Å; I52-I74 HydrophobicContact CD1-CG1 4.14Å; I72-I74 PolarHBondContact O-N 3.48Å; I72-I74 VanDerWaalsContact O-N 3.08Å; I74-E76 VanDerWaalsContact C-N 3.35Å; I74-L77 PolarHBondContact O-N 3.32Å; I74-L78 HydrophobicContact CG2-CD1 4.25Å; I74-L78 HydrophobicContact CG2-CG 4.35Å; I74-L78 WeakPolarHBondContact O-CB 3.2Å; I74-L78 VanDerWaalsContact O-CG 3.26Å; I74-L78 WeakPolarHBondContact O-CG 3.41Å; I74-L78 PolarHBondContact O-N 3.38Å; I74-I111 HydrophobicContact CG2-CG2 3.9Å; I74-L114 HydrophobicContact CG2-CD2 3.63Å
75	D	83.6	Confident	77.2	Confident	46 Å²	46	82.4 Å²	82.4	25%	0.246	42%	0.416	C	S	.	.	H	α-helix	trans	-69.9	-30.4	175.6	-74	-80.8	0	0	0	113.2	R45 D73 E79	R45-D75 IonicContact CZ-OD2 3.86Å; R45-D75 VanDerWaalsContact CZ-OD2 3.27Å; R45-D75 IonicContact NH1-OD1 2.73Å; R45-D75 IonicContact NH1-OD2 3.73Å; R45-D75 PolarHBondContact NH1-OD2 2.91Å; R45-D75 IonicContact NH2-OD2 2.88Å; R45-D75 PolarHBondContact NH2-OD2 2.9Å; D73-D75 PolarHBondContact O-N 2.95Å; D75-E79 PolarHBondContact O-N 2.95Å
76	E	86.2	Confident	79.2	Confident	89 Å²	89	78.8 Å²	78.8	42%	0.416	39%	0.394	S	S	.	.	H	α-helix	trans	-70.6	-47.4	170.7	-177.1	178.6	123.9	0	0	110	D73 I74 L78 E79 L80 R88	D73-E76 HydrophobicContact CB-CB 3.74Å; D73-E76 WeakPolarHBondContact O-CB 3.27Å; D73-E76 PolarHBondContact O-N 3.06Å; D73-E76 VanDerWaalsContact O-N 3.12Å; I74-E76 VanDerWaalsContact C-N 3.35Å; E76-L78 VanDerWaalsContact C-N 3.27Å; E76-L78 PolarHBondContact O-N 2.99Å; E76-E79 WeakPolarHBondContact O-CA 3.3Å; E76-E79 WeakPolarHBondContact O-CB 3.43Å; E76-E79 PolarHBondContact O-N 2.89Å; E76-L80 HydrophobicContact CG-CD1 4.15Å; E76-L80 WeakPolarHBondContact O-CG 3.24Å; E76-L80 PolarHBondContact O-N 3.32Å; E76-R88 IonicContact OE1-NE 3.99Å
77	L	87.6	Confident	81	Confident	4 Å²	4	75.1 Å²	75.1	2%	0.021	38%	0.382	C	S	.	.	H	α-helix	trans	-55.9	-44.1	176.1	-65.4	177.3	0	0	0	111	I72 D73 I74 E79 L80 Q85 R88 L89 L107 I111	I72-L77 HydrophobicContact CG2-CD1 3.73Å; D73-L77 WeakPolarHBondContact O-CG 3.46Å; D73-L77 PolarHBondContact O-N 3.01Å; I74-L77 PolarHBondContact O-N 3.32Å; L77-E79 PolarHBondContact O-N 2.9Å; L77-L80 PolarHBondContact O-N 3.4Å; L77-L80 VanDerWaalsContact O-N 3.14Å; L77-Q85 HydrophobicContact CB-CG 4.43Å; L77-Q85 HydrophobicContact CD2-CB 4.3Å; L77-Q85 WeakPolarHBondContact O-CG 3.15Å; L77-Q85 PolarHBondContact O-NE2 2.88Å; L77-R88 HydrophobicContact CD2-CB 4.36Å; L77-L89 HydrophobicContact CD1-CD1 4.43Å; L77-L89 HydrophobicContact CD1-CD2 4.07Å; L77-L89 HydrophobicContact CD1-CG 4.42Å; L77-L89 HydrophobicContact CD2-CD1 4.5Å; L77-L89 HydrophobicContact CD2-CD2 4.35Å; L77-L89 HydrophobicContact CD2-CG 4.08Å; L77-L107 HydrophobicContact CD1-CD2 4.01Å; L77-I111 HydrophobicContact CB-CD1 3.96Å; L77-I111 HydrophobicContact CD1-CD1 4.28Å
78	L	85.6	Confident	82.7	Confident	45 Å²	45	76.8 Å²	76.8	24%	0.236	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.2	176.9	-73.6	176.3	0	0	0	114.5	I74 E76 I111 L114 K116	I74-L78 HydrophobicContact CG2-CD1 4.25Å; I74-L78 HydrophobicContact CG2-CG 4.35Å; I74-L78 WeakPolarHBondContact O-CB 3.2Å; I74-L78 VanDerWaalsContact O-CG 3.26Å; I74-L78 WeakPolarHBondContact O-CG 3.41Å; I74-L78 PolarHBondContact O-N 3.38Å; E76-L78 VanDerWaalsContact C-N 3.27Å; E76-L78 PolarHBondContact O-N 2.99Å; L78-I111 HydrophobicContact CD2-CB 4.42Å; L78-L114 HydrophobicContact CD1-CB 4.37Å; L78-L114 HydrophobicContact CD1-CD2 4.12Å; L78-L114 HydrophobicContact CD2-CB 4.46Å; L78-K116 HydrophobicContact CD1-CB 4.43Å
79	E	86.4	Confident	83.9	Confident	144 Å²	144	74.4 Å²	74.4	67%	0.673	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-22.6	175.4	-170.6	150.6	-99.2	0	0	112.7	D75 E76 L77 K116	D75-E79 PolarHBondContact O-N 2.95Å; E76-E79 WeakPolarHBondContact O-CA 3.3Å; E76-E79 WeakPolarHBondContact O-CB 3.43Å; E76-E79 PolarHBondContact O-N 2.89Å; L77-E79 PolarHBondContact O-N 2.9Å; E79-K116 VanDerWaalsContact CD-NZ 3.29Å; E79-K116 IonicContact OE1-NZ 2.8Å; E79-K116 PolarHBondContact OE1-NZ 2.83Å; E79-K116 IonicContact OE2-NZ 3.27Å
80	L	86.9	Confident	85	Confident	52 Å²	52	68.9 Å²	68.9	27%	0.272	34%	0.342	S	S	.	.	S	Bend	trans	-87.4	149.8	-179.8	-65.4	169.6	0	0	0	112.2	E76 L77 Q85 R88	E76-L80 HydrophobicContact CG-CD1 4.15Å; E76-L80 WeakPolarHBondContact O-CG 3.24Å; E76-L80 PolarHBondContact O-N 3.32Å; L77-L80 PolarHBondContact O-N 3.4Å; L77-L80 VanDerWaalsContact O-N 3.14Å; L80-Q85 HydrophobicContact CB-CG 3.96Å; L80-Q85 PolarHBondContact O-NE2 3.08Å; L80-R88 HydrophobicContact CD1-CB 4.39Å; L80-R88 HydrophobicContact CD1-CG 3.56Å
81	P	86.3	Confident	85.7	Confident	90 Å²	90	72.3 Å²	72.3	58%	0.584	36%	0.357	S	S	*	.			trans	-69.2	159.3	169.4	30.7	-34.5	0	0	0	111	E83 G84 Q85	P81-E83 PolarHBondContact O-N 2.88Å; P81-G84 WeakPolarHBondContact O-CA 3.48Å; P81-G84 PolarHBondContact O-N 2.96Å; P81-Q85 WeakPolarHBondContact O-CG 3.38Å; P81-Q85 PolarHBondContact O-N 3.21Å
82	D	84.1	Confident	85.8	Confident	100 Å²	100	68 Å²	68	54%	0.535	34%	0.338	S	S	.	.	H	α-helix	trans	-47.1	-39.4	-178.3	-75.3	-109.1	0	0	0	113.9	R86	D82-R86 PolarHBondContact O-N 2.8Å
83	E	85.9	Confident	85.6	Confident	164 Å²	164	67 Å²	67	77%	0.766	33%	0.333	S	S	*	.	H	α-helix	trans	-66.9	-43.3	176.5	-65.1	-159	113.9	0	0	112.3	P81 R86 T87	P81-E83 PolarHBondContact O-N 2.88Å; E83-R86 PolarHBondContact O-N 2.99Å; E83-T87 PolarHBondContact O-N 3.12Å; E83-T87 VanDerWaalsContact O-N 3.11Å; E83-T87 PolarHBondContact O-OG1 3.11Å; E83-T87 VanDerWaalsContact O-OG1 3.12Å
84	G	87.1	Confident	85.2	Confident	21 Å²	21	70.4 Å²	70.4	22%	0.216	35%	0.347	C	S	.	.	H	α-helix	trans	-68.9	-34	178.5	0	0	0	0	0	112.9	P81 T87 R88	P81-G84 WeakPolarHBondContact O-CA 3.48Å; P81-G84 PolarHBondContact O-N 2.96Å; G84-T87 PolarHBondContact O-N 3.26Å; G84-R88 WeakPolarHBondContact O-CB 3.5Å; G84-R88 WeakPolarHBondContact O-CG 3.37Å; G84-R88 PolarHBondContact O-N 3.47Å
85	Q	87.7	Confident	84.4	Confident	17 Å²	17	77.7 Å²	77.7	8%	0.079	38%	0.381	C	S	.	.	H	α-helix	trans	-61.7	-44.9	174.8	-65.3	173.3	-26.4	0	0	111.3	L77 L80 P81 L89 L108	L77-Q85 HydrophobicContact CB-CG 4.43Å; L77-Q85 HydrophobicContact CD2-CB 4.3Å; L77-Q85 WeakPolarHBondContact O-CG 3.15Å; L77-Q85 PolarHBondContact O-NE2 2.88Å; L80-Q85 HydrophobicContact CB-CG 3.96Å; L80-Q85 PolarHBondContact O-NE2 3.08Å; P81-Q85 WeakPolarHBondContact O-CG 3.38Å; P81-Q85 PolarHBondContact O-N 3.21Å; Q85-L89 WeakPolarHBondContact O-CG 3.47Å; Q85-L89 PolarHBondContact O-N 3.34Å; Q85-L89 VanDerWaalsContact O-N 3.11Å; Q85-L108 HydrophobicContact CB-CD2 3.49Å; Q85-L108 VanDerWaalsContact CB-CD2 3.49Å; Q85-L108 HydrophobicContact CG-CD2 4.26Å; Q85-L108 VanDerWaalsContact OE1-CD2 3.25Å
86	R	87.8	Confident	83.6	Confident	117 Å²	117	76.3 Å²	76.3	44%	0.442	37%	0.374	S	S	.	.	H	α-helix	trans	-60.8	-52.5	175.8	-77.9	-176.2	160.5	146.9	-4.5	111.4	D82 E83 R88 L89 E90 I104 N105 L108	D82-R86 PolarHBondContact O-N 2.8Å; E83-R86 PolarHBondContact O-N 2.99Å; R86-R88 VanDerWaalsContact C-N 3.31Å; R86-R88 PolarHBondContact O-N 3.18Å; R86-L89 PolarHBondContact O-N 2.95Å; R86-E90 WeakPolarHBondContact O-CG 3.48Å; R86-E90 PolarHBondContact O-N 3.11Å; R86-I104 HydrophobicContact CG-CG2 3.98Å; R86-N105 PolarHBondContact NH2-OD1 2.95Å; R86-L108 HydrophobicContact CG-CD1 3.46Å; R86-L108 VanDerWaalsContact CG-CD1 3.46Å
87	T	88.9	Confident	82.4	Confident	74 Å²	74	76.3 Å²	76.3	45%	0.454	40%	0.398	S	S	.	.	H	α-helix	trans	-57.7	-44.5	-179.2	-55.3	0	0	0	0	111.7	E83 G84 L89 E90 E91	E83-T87 PolarHBondContact O-N 3.12Å; E83-T87 VanDerWaalsContact O-N 3.11Å; E83-T87 PolarHBondContact O-OG1 3.11Å; E83-T87 VanDerWaalsContact O-OG1 3.12Å; G84-T87 PolarHBondContact O-N 3.26Å; T87-L89 PolarHBondContact O-N 3.46Å; T87-E90 PolarHBondContact O-N 2.79Å; T87-E91 WeakPolarHBondContact O-CG 3.46Å; T87-E91 PolarHBondContact O-N 3.47Å
88	R	87.2	Confident	81.7	Confident	110 Å²	110	80 Å²	80	42%	0.415	41%	0.414	S	S	.	.	H	α-helix	trans	-59.9	-46.9	177.2	-79.5	-71.5	169.8	-139.2	-7.6	112.7	E76 L77 L80 G84 R86 E90 E91 L92	E76-R88 IonicContact OE1-NE 3.99Å; L77-R88 HydrophobicContact CD2-CB 4.36Å; L80-R88 HydrophobicContact CD1-CB 4.39Å; L80-R88 HydrophobicContact CD1-CG 3.56Å; G84-R88 WeakPolarHBondContact O-CB 3.5Å; G84-R88 WeakPolarHBondContact O-CG 3.37Å; G84-R88 PolarHBondContact O-N 3.47Å; R86-R88 VanDerWaalsContact C-N 3.31Å; R86-R88 PolarHBondContact O-N 3.18Å; R88-E90 VanDerWaalsContact C-N 3.31Å; R88-E90 PolarHBondContact O-N 2.84Å; R88-E91 IonicContact CZ-OE2 3.82Å; R88-E91 IonicContact NH1-OE2 3.92Å; R88-E91 PolarHBondContact NH1-OE2 3.19Å; R88-E91 PolarHBondContact O-N 2.9Å; R88-L92 WeakPolarHBondContact O-CB 3.23Å; R88-L92 WeakPolarHBondContact O-CD1 3.43Å; R88-L92 WeakPolarHBondContact O-CG 3.47Å; R88-L92 PolarHBondContact O-N 2.96Å
89	L	87.1	Confident	81.2	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	43%	0.434	C	S	.	.	H	α-helix	trans	-65.6	-35.7	177.5	-68.5	169.7	0	0	0	112	I72 L77 Q85 R86 T87 L93 F103 I104 L107 L108	I72-L89 HydrophobicContact CD1-CD2 4.25Å; I72-L89 HydrophobicContact CG2-CD2 3.92Å; L77-L89 HydrophobicContact CD1-CD1 4.43Å; L77-L89 HydrophobicContact CD1-CD2 4.07Å; L77-L89 HydrophobicContact CD1-CG 4.42Å; L77-L89 HydrophobicContact CD2-CD1 4.5Å; L77-L89 HydrophobicContact CD2-CD2 4.35Å; L77-L89 HydrophobicContact CD2-CG 4.08Å; Q85-L89 WeakPolarHBondContact O-CG 3.47Å; Q85-L89 PolarHBondContact O-N 3.34Å; Q85-L89 VanDerWaalsContact O-N 3.11Å; R86-L89 PolarHBondContact O-N 2.95Å; T87-L89 PolarHBondContact O-N 3.46Å; L89-L93 VanDerWaalsContact O-CB 3.27Å; L89-L93 WeakPolarHBondContact O-CB 3.39Å; L89-L93 WeakPolarHBondContact O-CD1 3.47Å; L89-L93 VanDerWaalsContact O-CG 3.32Å; L89-L93 WeakPolarHBondContact O-CG 3.45Å; L89-L93 PolarHBondContact O-N 2.9Å; L89-F103 HydrophobicContact CD2-CE1 4.37Å; L89-I104 HydrophobicContact CB-CD1 4.4Å; L89-I104 HydrophobicContact CB-CG1 3.85Å; L89-I104 HydrophobicContact CB-CG2 4.47Å; L89-I104 HydrophobicContact CD1-CG1 4.44Å; L89-I104 HydrophobicContact CD1-CG2 4.07Å; L89-L107 HydrophobicContact CD1-CD2 3.81Å; L89-L107 HydrophobicContact CD1-CG 4.38Å; L89-L107 HydrophobicContact CD2-CD2 3.56Å; L89-L107 HydrophobicContact CG-CD2 4.35Å; L89-L108 HydrophobicContact CD1-CD2 4.31Å; L89-L108 HydrophobicContact CD1-CG 4.43Å
90	E	85.2	Confident	81	Confident	94 Å²	94	78 Å²	78	44%	0.439	41%	0.412	S	S	.	.	H	α-helix	trans	-66.7	-38	174.8	-74	-176.6	94.4	0	0	112.9	R86 T87 R88 L93 Q94 K100 I104	R86-E90 WeakPolarHBondContact O-CG 3.48Å; R86-E90 PolarHBondContact O-N 3.11Å; T87-E90 PolarHBondContact O-N 2.79Å; R88-E90 VanDerWaalsContact C-N 3.31Å; R88-E90 PolarHBondContact O-N 2.84Å; E90-L93 CarbonylContact O-C 3.41Å; E90-Q94 WeakPolarHBondContact O-CA 3.45Å; E90-Q94 PolarHBondContact O-N 3.01Å; E90-K100 PolarHBondContact O-NZ 3.2Å; E90-I104 HydrophobicContact CG-CD1 3.56Å
91	E	85.1	Confident	80.9	Confident	104 Å²	104	82.1 Å²	82.1	49%	0.486	43%	0.43	S	S	.	.	H	α-helix	trans	-65.5	-48.4	174.2	-74.2	-172.3	115.9	0	0	111	T87 R88 L93 Q94	T87-E91 WeakPolarHBondContact O-CG 3.46Å; T87-E91 PolarHBondContact O-N 3.47Å; R88-E91 IonicContact CZ-OE2 3.82Å; R88-E91 IonicContact NH1-OE2 3.92Å; R88-E91 PolarHBondContact NH1-OE2 3.19Å; R88-E91 PolarHBondContact O-N 2.9Å; E91-L93 VanDerWaalsContact C-N 3.3Å; E91-L93 PolarHBondContact O-N 3.43Å; E91-Q94 WeakPolarHBondContact O-CB 3.4Å; E91-Q94 PolarHBondContact O-N 2.73Å; E91-Q94 VanDerWaalsContact O-N 3.16Å
92	L	81.6	Confident	80.9	Confident	56 Å²	56	85 Å²	85	29%	0.293	44%	0.435	S	S	.	.	H	α-helix	trans	-57.9	-43.3	175.7	-80.3	154.5	0	0	0	111.3	L70 R88 Q94	L70-L92 HydrophobicContact CD1-CB 3.99Å; L70-L92 HydrophobicContact CD1-CD2 3.73Å; L70-L92 WeakPolarHBondContact CD1-O 3.33Å; L70-L92 HydrophobicContact CD2-CB 4.32Å; L70-L92 HydrophobicContact CG-CB 4.42Å; L70-L92 HydrophobicContact CG-CD2 3.92Å; R88-L92 WeakPolarHBondContact O-CB 3.23Å; R88-L92 WeakPolarHBondContact O-CD1 3.43Å; R88-L92 WeakPolarHBondContact O-CG 3.47Å; R88-L92 PolarHBondContact O-N 2.96Å; L92-Q94 VanDerWaalsContact C-N 3.32Å; L92-Q94 PolarHBondContact O-N 3.4Å
93	L	79	Confident	81	Confident	0 Å²	0	80.3 Å²	80.3	0%	0	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	20.7	-179.5	-60.5	161.5	0	0	0	112.3	L56 F60 L70 L89 E90 E91 E95 C96 K100 F103 I104	L56-L93 HydrophobicContact CD2-CD2 3.97Å; F60-L93 HydrophobicContact CE2-CD2 4.46Å; L70-L93 HydrophobicContact CD2-CD2 4.12Å; L89-L93 VanDerWaalsContact O-CB 3.27Å; L89-L93 WeakPolarHBondContact O-CB 3.39Å; L89-L93 WeakPolarHBondContact O-CD1 3.47Å; L89-L93 VanDerWaalsContact O-CG 3.32Å; L89-L93 WeakPolarHBondContact O-CG 3.45Å; L89-L93 PolarHBondContact O-N 2.9Å; E90-L93 CarbonylContact O-C 3.41Å; E91-L93 VanDerWaalsContact C-N 3.3Å; E91-L93 PolarHBondContact O-N 3.43Å; L93-E95 PolarHBondContact O-N 3.02Å; L93-C96 HydrophobicContact CB-CB 4.46Å; L93-C96 VanDerWaalsContact CD2-SG 3.59Å; L93-C96 WeakPolarHBondContact O-CB 3.48Å; L93-C96 PolarHBondContact O-N 3.27Å; L93-K100 HydrophobicContact CB-CB 4.11Å; L93-K100 HydrophobicContact CB-CD 3.54Å; L93-K100 HydrophobicContact CB-CG 4.49Å; L93-K100 HydrophobicContact CD1-CB 4Å; L93-K100 WeakPolarHBondContact O-CD 3.24Å; L93-K100 PolarHBondContact O-NZ 2.95Å; L93-F103 HydrophobicContact CD1-CD1 3.34Å; L93-F103 HydrophobicContact CD1-CE1 3.64Å; L93-F103 HydrophobicContact CD1-CG 4.38Å; L93-I104 HydrophobicContact CD1-CG1 4.2Å
94	Q	74.8	Confident	81.1	Confident	151 Å²	151	72.9 Å²	72.9	71%	0.706	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-35.3	177.8	174.7	175.9	-105.8	0	0	111.7	E90 E91 L92 C96	E90-Q94 WeakPolarHBondContact O-CA 3.45Å; E90-Q94 PolarHBondContact O-N 3.01Å; E91-Q94 WeakPolarHBondContact O-CB 3.4Å; E91-Q94 PolarHBondContact O-N 2.73Å; E91-Q94 VanDerWaalsContact O-N 3.16Å; L92-Q94 VanDerWaalsContact C-N 3.32Å; L92-Q94 PolarHBondContact O-N 3.4Å; Q94-C96 PolarHBondContact O-N 3.39Å
95	E	68	Low	81.2	Confident	154 Å²	154	75 Å²	75	72%	0.72	38%	0.382	S	S	*	.	S	Bend	trans	-78.9	-10.6	-177.6	-57.1	-171.4	96.5	0	0	112.1	L93 G97	L93-E95 PolarHBondContact O-N 3.02Å; E95-G97 PolarHBondContact O-N 3.03Å
96	C	68.3	Low	81.3	Confident	16 Å²	16	75.2 Å²	75.2	11%	0.108	39%	0.388	C	S	.	.			trans	-74.7	121.9	174	-64.3	0	0	0	0	111.9	L59 F60 L93 Q94 K98	L59-C96 HydrophobicContact CD2-CB 4.42Å; F60-C96 VanDerWaalsContact CE1-SG 3.6Å; F60-C96 WeakPolarHBondContact CE2-SG 3.41Å; F60-C96 WeakPolarHBondContact CZ-SG 3.48Å; L93-C96 HydrophobicContact CB-CB 4.46Å; L93-C96 VanDerWaalsContact CD2-SG 3.59Å; L93-C96 WeakPolarHBondContact O-CB 3.48Å; L93-C96 PolarHBondContact O-N 3.27Å; Q94-C96 PolarHBondContact O-N 3.39Å; C96-K98 VanDerWaalsContact C-N 3.27Å; C96-K98 PolarHBondContact O-N 2.93Å
97	G	61	Low	81.4	Confident	89 Å²	89	69.6 Å²	69.6	92%	0.918	37%	0.367	S	S	*	.			trans	-78.4	-0.1	172.4	0	0	0	0	0	115.6	E95	E95-G97 PolarHBondContact O-N 3.03Å
98	K	71.1	Confident	81.4	Confident	83 Å²	83	66.9 Å²	66.9	36%	0.361	35%	0.35	S	S	.	.	S	Bend	trans	-102.9	160.7	-176.6	-69.9	-161.7	-161.7	135	0	112.3	L58 L59 F60 C96 K100	L58-K98 PolarHBondContact O-NZ 3.4Å; L59-K98 WeakPolarHBondContact O-CD 3.5Å; L59-K98 VanDerWaalsContact O-CE 3.28Å; L59-K98 WeakPolarHBondContact O-CE 3.42Å; L59-K98 PolarHBondContact O-NZ 2.91Å; F60-K98 PolarHBondContact O-NZ 3.42Å; C96-K98 VanDerWaalsContact C-N 3.27Å; C96-K98 PolarHBondContact O-N 2.93Å; K98-K100 PolarHBondContact O-N 3.29Å
99	P	76.4	Confident	81.5	Confident	101 Å²	101	70.2 Å²	70.2	66%	0.656	36%	0.364	S	S	*	.			trans	-61.5	107.3	175.7	25.1	-35.1	0	0	0	111.4
100	K	81.9	Confident	81.6	Confident	44 Å²	44	75.9 Å²	75.9	19%	0.191	39%	0.385	C	S	.	.			trans	-85.7	-11.7	177.7	56.6	-177.6	169.6	-165.7	0	114.4	L59 E90 L93 K98 E102 F103 I104	L59-K100 HydrophobicContact CD2-CB 4.35Å; E90-K100 PolarHBondContact O-NZ 3.2Å; L93-K100 HydrophobicContact CB-CB 4.11Å; L93-K100 HydrophobicContact CB-CD 3.54Å; L93-K100 HydrophobicContact CB-CG 4.49Å; L93-K100 HydrophobicContact CD1-CB 4Å; L93-K100 WeakPolarHBondContact O-CD 3.24Å; L93-K100 PolarHBondContact O-NZ 2.95Å; K98-K100 PolarHBondContact O-N 3.29Å; K100-E102 VanDerWaalsContact C-N 3.34Å; K100-E102 PolarHBondContact O-N 3.12Å; K100-F103 WeakPolarHBondContact O-CB 3.27Å; K100-F103 PolarHBondContact O-N 3.2Å; K100-I104 HydrophobicContact CB-CD1 4.16Å; K100-I104 HydrophobicContact CD-CD1 4.17Å; K100-I104 HydrophobicContact CG-CD1 3.91Å; K100-I104 VanDerWaalsContact O-CG1 3.23Å; K100-I104 WeakPolarHBondContact O-CG1 3.4Å; K100-I104 PolarHBondContact O-N 3.15Å
101	E	84.8	Confident	81.7	Confident	140 Å²	140	71.5 Å²	71.5	65%	0.654	37%	0.365	S	S	*	.	H	α-helix	trans	-59.9	-41.2	-176.8	-67.4	-179.5	86.6	0	0	112.9	I104 N105	E101-I104 PolarHBondContact O-N 3.14Å; E101-N105 WeakPolarHBondContact O-CB 3.38Å; E101-N105 VanDerWaalsContact O-CG 3.31Å; E101-N105 PolarHBondContact O-N 2.92Å; E101-N105 PolarHBondContact O-ND2 3.19Å
102	E	85.5	Confident	81.5	Confident	151 Å²	151	74.3 Å²	74.3	71%	0.706	38%	0.375	S	S	*	.	H	α-helix	trans	-64.2	-42	178	-68.7	-70.1	90.5	0	0	111.3	K100 G106	K100-E102 VanDerWaalsContact C-N 3.34Å; K100-E102 PolarHBondContact O-N 3.12Å; E102-G106 PolarHBondContact O-N 2.85Å
103	F	86.5	Confident	81.3	Confident	1 Å²	1	74.2 Å²	74.2	0%	0.004	39%	0.388	C	S	.	.	H	α-helix	trans	-64.2	-49.3	175	174	-95.9	0	0	0	111.4	W51 I52 Q55 L56 L59 I72 L89 L93 K100 N105 G106 L107	W51-F103 AromaticContact CH2-CD2 3.89Å; W51-F103 HydrophobicContact CH2-CD2 3.89Å; W51-F103 HydrophobicContact CH2-CE2 4.18Å; W51-F103 WeakPolarHBondContact CH2-O 3.24Å; W51-F103 HydrophobicContact CZ3-CD2 4.1Å; W51-F103 AromaticContact CZ3-CE2 3.9Å; W51-F103 HydrophobicContact CZ3-CE2 3.9Å; I52-F103 HydrophobicContact CG1-CE2 4.45Å; I52-F103 HydrophobicContact CG1-CZ 4.33Å; I52-F103 HydrophobicContact CG2-CE2 4.41Å; I52-F103 HydrophobicContact CG2-CZ 4.16Å; Q55-F103 HydrophobicContact CB-CD2 3.48Å; Q55-F103 VanDerWaalsContact CB-CD2 3.48Å; Q55-F103 HydrophobicContact CB-CE2 3.72Å; Q55-F103 HydrophobicContact CG-CD2 4.03Å; Q55-F103 HydrophobicContact CG-CE2 4.42Å; L56-F103 HydrophobicContact CD2-CZ 4.37Å; L59-F103 HydrophobicContact CD1-CB 3.78Å; L59-F103 HydrophobicContact CD1-CD2 4.36Å; L59-F103 HydrophobicContact CD1-CG 4.26Å; I72-F103 HydrophobicContact CD1-CE1 3.79Å; I72-F103 HydrophobicContact CD1-CZ 3.55Å; L89-F103 HydrophobicContact CD2-CE1 4.37Å; L93-F103 HydrophobicContact CD1-CD1 3.34Å; L93-F103 HydrophobicContact CD1-CE1 3.64Å; L93-F103 HydrophobicContact CD1-CG 4.38Å; K100-F103 WeakPolarHBondContact O-CB 3.27Å; K100-F103 PolarHBondContact O-N 3.2Å; F103-N105 PolarHBondContact O-N 3.23Å; F103-G106 PolarHBondContact O-N 3.37Å; F103-L107 HydrophobicContact CE1-CD2 3.96Å; F103-L107 HydrophobicContact CZ-CD2 3.99Å; F103-L107 VanDerWaalsContact O-CB 3.3Å; F103-L107 WeakPolarHBondContact O-CB 3.41Å; F103-L107 PolarHBondContact O-N 2.85Å
104	I	88.3	Confident	81.5	Confident	7 Å²	7	74.8 Å²	74.8	4%	0.036	39%	0.391	C	S	.	.	H	α-helix	trans	-58.9	-51.8	-179.9	-66.9	164.6	0	0	0	109.7	R86 L89 E90 L93 K100 E101 G106 L107 L108	R86-I104 HydrophobicContact CG-CG2 3.98Å; L89-I104 HydrophobicContact CB-CD1 4.4Å; L89-I104 HydrophobicContact CB-CG1 3.85Å; L89-I104 HydrophobicContact CB-CG2 4.47Å; L89-I104 HydrophobicContact CD1-CG1 4.44Å; L89-I104 HydrophobicContact CD1-CG2 4.07Å; E90-I104 HydrophobicContact CG-CD1 3.56Å; L93-I104 HydrophobicContact CD1-CG1 4.2Å; K100-I104 HydrophobicContact CB-CD1 4.16Å; K100-I104 HydrophobicContact CD-CD1 4.17Å; K100-I104 HydrophobicContact CG-CD1 3.91Å; K100-I104 VanDerWaalsContact O-CG1 3.23Å; K100-I104 WeakPolarHBondContact O-CG1 3.4Å; K100-I104 PolarHBondContact O-N 3.15Å; E101-I104 PolarHBondContact O-N 3.14Å; I104-G106 VanDerWaalsContact C-N 3.34Å; I104-G106 PolarHBondContact O-N 3.33Å; I104-L107 PolarHBondContact O-N 3.01Å; I104-L108 HydrophobicContact CG2-CD1 3.78Å; I104-L108 HydrophobicContact CG2-CG 4.3Å; I104-L108 WeakPolarHBondContact O-CB 3.22Å; I104-L108 WeakPolarHBondContact O-CG 3.17Å; I104-L108 PolarHBondContact O-N 2.73Å
105	N	90	Very high	81.6	Confident	66 Å²	66	75.9 Å²	75.9	35%	0.353	39%	0.388	S	S	.	.	H	α-helix	trans	-63.7	-39.9	-179.8	-71.2	-41.5	0	0	0	112.1	R86 E101 F103 Y109	R86-N105 PolarHBondContact NH2-OD1 2.95Å; E101-N105 WeakPolarHBondContact O-CB 3.38Å; E101-N105 VanDerWaalsContact O-CG 3.31Å; E101-N105 PolarHBondContact O-N 2.92Å; E101-N105 PolarHBondContact O-ND2 3.19Å; F103-N105 PolarHBondContact O-N 3.23Å; N105-Y109 VanDerWaalsContact O-CB 3.3Å; N105-Y109 WeakPolarHBondContact O-CB 3.43Å; N105-Y109 PolarHBondContact O-N 3.43Å
106	G	89.9	Confident	81.8	Confident	21 Å²	21	72.5 Å²	72.5	22%	0.216	37%	0.372	C	S	.	.	H	α-helix	trans	-62.3	-45.1	175.6	0	0	0	0	0	112.6	E102 F103 I104 Y109 R110	E102-G106 PolarHBondContact O-N 2.85Å; F103-G106 PolarHBondContact O-N 3.37Å; I104-G106 VanDerWaalsContact C-N 3.34Å; I104-G106 PolarHBondContact O-N 3.33Å; G106-Y109 PolarHBondContact O-N 3.46Å; G106-R110 WeakPolarHBondContact O-CB 3.47Å; G106-R110 VanDerWaalsContact O-CG 3.24Å; G106-R110 WeakPolarHBondContact O-CG 3.48Å; G106-R110 PolarHBondContact O-N 2.83Å
107	L	89.7	Confident	81.7	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-64.7	-49.9	178.8	-177.5	51.9	0	0	0	110.6	I48 W51 I52 I72 L77 L89 F103 I104 Y109 R110 I111	I48-L107 HydrophobicContact CG2-CD1 3.79Å; W51-L107 HydrophobicContact CE3-CD1 4.48Å; W51-L107 HydrophobicContact CH2-CB 4.1Å; W51-L107 VanDerWaalsContact CH2-N 3.27Å; W51-L107 HydrophobicContact CZ3-CB 3.7Å; W51-L107 HydrophobicContact CZ3-CD1 4.04Å; W51-L107 HydrophobicContact CZ3-CG 4.41Å; I52-L107 HydrophobicContact CD1-CD1 3.65Å; I52-L107 HydrophobicContact CD1-CD2 4.34Å; I52-L107 HydrophobicContact CG1-CD1 3.76Å; I52-L107 HydrophobicContact CG1-CD2 4.44Å; I72-L107 HydrophobicContact CG2-CD2 3.94Å; L77-L107 HydrophobicContact CD1-CD2 4.01Å; L89-L107 HydrophobicContact CD1-CD2 3.81Å; L89-L107 HydrophobicContact CD1-CG 4.38Å; L89-L107 HydrophobicContact CD2-CD2 3.56Å; L89-L107 HydrophobicContact CG-CD2 4.35Å; F103-L107 HydrophobicContact CE1-CD2 3.96Å; F103-L107 HydrophobicContact CZ-CD2 3.99Å; F103-L107 VanDerWaalsContact O-CB 3.3Å; F103-L107 WeakPolarHBondContact O-CB 3.41Å; F103-L107 PolarHBondContact O-N 2.85Å; I104-L107 PolarHBondContact O-N 3.01Å; L107-Y109 VanDerWaalsContact C-N 3.27Å; L107-Y109 PolarHBondContact O-N 2.82Å; L107-R110 PolarHBondContact O-N 2.67Å; L107-I111 HydrophobicContact CD1-CG2 3.84Å; L107-I111 HydrophobicContact CG-CG2 4.42Å; L107-I111 WeakPolarHBondContact O-CG1 3.26Å; L107-I111 WeakPolarHBondContact O-CG2 3.47Å; L107-I111 PolarHBondContact O-N 3.34Å
108	L	88.8	Confident	81.7	Confident	16 Å²	16	72.4 Å²	72.4	8%	0.084	35%	0.354	C	S	.	.	H	α-helix	trans	-56.4	-42.7	176.8	-69.1	176.5	0	0	0	111.6	Q85 R86 L89 I104 R110 I111 K112	Q85-L108 HydrophobicContact CB-CD2 3.49Å; Q85-L108 VanDerWaalsContact CB-CD2 3.49Å; Q85-L108 HydrophobicContact CG-CD2 4.26Å; Q85-L108 VanDerWaalsContact OE1-CD2 3.25Å; R86-L108 HydrophobicContact CG-CD1 3.46Å; R86-L108 VanDerWaalsContact CG-CD1 3.46Å; L89-L108 HydrophobicContact CD1-CD2 4.31Å; L89-L108 HydrophobicContact CD1-CG 4.43Å; I104-L108 HydrophobicContact CG2-CD1 3.78Å; I104-L108 HydrophobicContact CG2-CG 4.3Å; I104-L108 WeakPolarHBondContact O-CB 3.22Å; I104-L108 WeakPolarHBondContact O-CG 3.17Å; I104-L108 PolarHBondContact O-N 2.73Å; L108-R110 VanDerWaalsContact C-N 3.35Å; L108-R110 PolarHBondContact O-N 3.39Å; L108-I111 HydrophobicContact CD2-CD1 4.02Å; L108-I111 WeakPolarHBondContact O-CG1 3.31Å; L108-K112 VanDerWaalsContact O-CB 3.24Å; L108-K112 WeakPolarHBondContact O-CB 3.41Å; L108-K112 PolarHBondContact O-N 2.7Å
109	Y	89.6	Confident	80.9	Confident	181 Å²	181	69.4 Å²	69.4	71%	0.71	35%	0.347	S	S	*	.	H	α-helix	trans	-63.2	-41.2	176.5	-177.9	-94	0	0	0	112.3	N105 G106 L107 K112	N105-Y109 VanDerWaalsContact O-CB 3.3Å; N105-Y109 WeakPolarHBondContact O-CB 3.43Å; N105-Y109 PolarHBondContact O-N 3.43Å; G106-Y109 PolarHBondContact O-N 3.46Å; L107-Y109 VanDerWaalsContact C-N 3.27Å; L107-Y109 PolarHBondContact O-N 2.82Å; Y109-K112 WeakPolarHBondContact O-CB 3.37Å; Y109-K112 PolarHBondContact O-N 3Å
110	R	87.7	Confident	79.6	Confident	118 Å²	118	70.1 Å²	70.1	45%	0.445	35%	0.351	S	S	.	.	H	α-helix	trans	-71.1	-39.7	-179.1	-74.9	-78.4	-179.3	158.9	1.1	112.9	D47 I48 G106 L107 L108 K112	D47-R110 IonicContact OD1-NH1 2.92Å; D47-R110 PolarHBondContact OD1-NH1 3.39Å; I48-R110 HydrophobicContact CD1-CB 4.25Å; I48-R110 WeakPolarHBondContact CD1-O 3.39Å; I48-R110 HydrophobicContact CG1-CB 4.07Å; G106-R110 WeakPolarHBondContact O-CB 3.47Å; G106-R110 VanDerWaalsContact O-CG 3.24Å; G106-R110 WeakPolarHBondContact O-CG 3.48Å; G106-R110 PolarHBondContact O-N 2.83Å; L107-R110 PolarHBondContact O-N 2.67Å; L108-R110 VanDerWaalsContact C-N 3.35Å; L108-R110 PolarHBondContact O-N 3.39Å; R110-K112 VanDerWaalsContact C-N 3.28Å
111	I	87.7	Confident	78	Confident	3 Å²	3	74.9 Å²	74.9	2%	0.015	38%	0.378	C	S	.	.	H	α-helix	trans	-75.9	-18.3	176.3	69.5	178.6	0	0	0	112.1	I48 I74 L77 L78 L107 L108 G113 L114	I48-I111 HydrophobicContact CD1-CG2 4.26Å; I48-I111 HydrophobicContact CG2-CG2 4.27Å; I74-I111 HydrophobicContact CG2-CG2 3.9Å; L77-I111 HydrophobicContact CB-CD1 3.96Å; L77-I111 HydrophobicContact CD1-CD1 4.28Å; L78-I111 HydrophobicContact CD2-CB 4.42Å; L107-I111 HydrophobicContact CD1-CG2 3.84Å; L107-I111 HydrophobicContact CG-CG2 4.42Å; L107-I111 WeakPolarHBondContact O-CG1 3.26Å; L107-I111 WeakPolarHBondContact O-CG2 3.47Å; L107-I111 PolarHBondContact O-N 3.34Å; L108-I111 HydrophobicContact CD2-CD1 4.02Å; L108-I111 WeakPolarHBondContact O-CG1 3.31Å; I111-G113 PolarHBondContact O-N 2.79Å; I111-L114 WeakPolarHBondContact O-CB 3.33Å; I111-L114 PolarHBondContact O-N 3.31Å
112	K	81.9	Confident	76.3	Confident	163 Å²	163	77.3 Å²	77.3	71%	0.709	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	92.2	176.8	-167.4	171.9	-172.7	164.7	0	110.8	L108 Y109 R110	L108-K112 VanDerWaalsContact O-CB 3.24Å; L108-K112 WeakPolarHBondContact O-CB 3.41Å; L108-K112 PolarHBondContact O-N 2.7Å; Y109-K112 WeakPolarHBondContact O-CB 3.37Å; Y109-K112 PolarHBondContact O-N 3Å; R110-K112 VanDerWaalsContact C-N 3.28Å
113	G	77.5	Confident	74.3	Confident	54 Å²	54	83.5 Å²	83.5	56%	0.557	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.8	3.9	-176.5	0	0	0	0	0	114.3	I111	I111-G113 PolarHBondContact O-N 2.79Å
114	L	82	Confident	73.7	Confident	12 Å²	12	87.6 Å²	87.6	6%	0.063	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-71.8	137.5	161.4	-157.9	81.5	0	0	0	108.9	R44 I48 I74 L78 I111	R44-L114 HydrophobicContact CB-CD1 3.7Å; I48-L114 HydrophobicContact CD1-CD1 3.79Å; I48-L114 HydrophobicContact CD1-CD2 4.17Å; I48-L114 HydrophobicContact CD1-CG 4.4Å; I74-L114 HydrophobicContact CG2-CD2 3.63Å; L78-L114 HydrophobicContact CD1-CB 4.37Å; L78-L114 HydrophobicContact CD1-CD2 4.12Å; L78-L114 HydrophobicContact CD2-CB 4.46Å; I111-L114 WeakPolarHBondContact O-CB 3.33Å; I111-L114 PolarHBondContact O-N 3.31Å
115	R	76.6	Confident	72.9	Confident	173 Å²	173	91.8 Å²	91.8	65%	0.653	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-92.5	136	178	-64.3	176.2	66.2	-157.2	-1.9	108.8	M117	R115-M117 PolarHBondContact O-N 3.13Å; R115-M117 VanDerWaalsContact O-N 3.15Å
116	K	73.2	Confident	72	Confident	84 Å²	84	93.3 Å²	93.3	37%	0.365	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-58.9	119.4	170.7	-171.7	165.5	-178.6	155.4	0	108.5	L78 E79 S118	L78-K116 HydrophobicContact CD1-CB 4.43Å; E79-K116 VanDerWaalsContact CD-NZ 3.29Å; E79-K116 IonicContact OE1-NZ 2.8Å; E79-K116 PolarHBondContact OE1-NZ 2.83Å; E79-K116 IonicContact OE2-NZ 3.27Å; K116-S118 VanDerWaalsContact C-N 3.3Å
117	M	66.3	Low	70.9	Confident	28 Å²	28	97.5 Å²	97.5	14%	0.138	47%	0.472	C	S	.	.			trans	-82	-13.6	-177.7	-66.4	-167.2	-158.7	0	0	112.5	V35 Y37 D41 L42 R45 R115 G119	V35-M117 WeakPolarHBondContact CG1-O 3.45Å; Y37-M117 HydrophobicContact CD1-CB 4.06Å; Y37-M117 HydrophobicContact CD1-CG 4.41Å; Y37-M117 HydrophobicContact CD1-SD 3.91Å; Y37-M117 HydrophobicContact CE1-CB 3.97Å; Y37-M117 HydrophobicContact CE1-SD 4.44Å; D41-M117 HydrophobicContact CB-CE 4.14Å; D41-M117 VanDerWaalsContact O-CE 3.27Å; D41-M117 WeakPolarHBondContact O-CE 3.13Å; D41-M117 WeakPolarHBondContact OD1-CE 3.44Å; D41-M117 WeakPolarHBondContact OD1-CG 3.37Å; L42-M117 HydrophobicContact CD2-CE 4.02Å; L42-M117 HydrophobicContact CD2-SD 3.5Å; L42-M117 VanDerWaalsContact CD2-SD 3.5Å; L42-M117 HydrophobicContact CG-CE 4.28Å; L42-M117 HydrophobicContact CG-SD 4.07Å; R45-M117 HydrophobicContact CB-CE 3.55Å; R45-M117 HydrophobicContact CG-CE 4.18Å; R115-M117 PolarHBondContact O-N 3.13Å; R115-M117 VanDerWaalsContact O-N 3.15Å; M117-G119 PolarHBondContact O-N 2.81Å
118	S	60.8	Low	69.7	Low	74 Å²	74	103.6 Å²	103.6	52%	0.517	50%	0.501	S	S	.	.			trans	-66.3	102.7	169.8	-168.1	0	0	0	0	109.6	K116	K116-S118 VanDerWaalsContact C-N 3.3Å
119	G	53.9	Low	68.5	Low	20 Å²	20	109.5 Å²	109.5	21%	0.206	53%	0.529	C	S	.	.			trans	-66.2	149	167.5	0	0	0	0	0	109.6	M117 L121	M117-G119 PolarHBondContact O-N 2.81Å; G119-L121 PolarHBondContact O-N 2.69Å
120	P	48.7	Very low	67	Low	116 Å²	116	104.4 Å²	104.4	75%	0.753	52%	0.516	S	S	*	.			trans	-58.8	107.4	175.2	23.4	-31	0	0	0	108.5	K122	P120-K122 PolarHBondContact O-N 2.92Å
121	L	48.7	Very low	65.4	Low	144 Å²	144	103.3 Å²	103.3	75%	0.754	52%	0.522	S	S	*	.			trans	-61	92.1	162.1	-76.9	156.8	0	0	0	105.3	G119 K123	G119-L121 PolarHBondContact O-N 2.69Å; L121-K123 PolarHBondContact O-N 3.27Å
122	K	48.5	Very low	63.5	Low	192 Å²	192	111.7 Å²	111.7	84%	0.835	56%	0.564	S	S	*	*			trans	-62.8	109.9	175.2	-61.9	-166.4	172.3	-162	0	106.4	P120	P120-K122 PolarHBondContact O-N 2.92Å
123	K	44.1	Very low	61.8	Low	280 Å²	280	107 Å²	107	100%	1.217	55%	0.551	S	S	*	*			trans	-58.9	0	170.4	-66.7	-180	175.3	178.8	0	110.5	L121	L121-K123 PolarHBondContact O-N 3.27Å

Retrieved 123 of 123 residues in 65 ms (Link to these results)

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