A0A077ZKB4_TRITR Loading...

Endothelial differentiation factor 1

AlphaFold DB , UniProt , Accession A0A077ZKB4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 155 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.7	Very low	55.8	Low	234 Å²	234	144.7 Å²	144.7	100%	1.153	78%	0.781	S	S	*	*				0	97.4	0	-70.8	177.9	168.6	0	0	107.4	S3	M1-S3 PolarHBondContact O-N 2.9Å; M1-S3 VanDerWaalsContact O-N 3.09Å
2	Q	49.4	Very low	56.6	Low	191 Å²	191	141.8 Å²	141.8	89%	0.893	77%	0.771	S	S	*	*			trans	-67.5	105.1	179.8	-75.7	86.1	-4.8	0	0	109.9	N4	Q2-N4 PolarHBondContact O-N 2.63Å
3	S	55.1	Low	57.3	Low	102 Å²	102	142.2 Å²	142.2	71%	0.713	77%	0.771	S	S	*	*			trans	-71.5	103.8	171.1	51.9	0	0	0	0	109.1	M1 T5	M1-S3 PolarHBondContact O-N 2.9Å; M1-S3 VanDerWaalsContact O-N 3.09Å; S3-T5 PolarHBondContact O-N 2.92Å
4	N	57.6	Low	57.7	Low	161 Å²	161	149 Å²	149	86%	0.861	78%	0.78	S	S	*	*			trans	-76.5	69.5	175.3	-154.4	18.6	0	0	0	109.4	Q2 G6	Q2-N4 PolarHBondContact O-N 2.63Å; N4-G6 VanDerWaalsContact C-N 3.26Å; N4-G6 PolarHBondContact O-N 3.08Å
5	T	53.8	Low	58.5	Low	112 Å²	112	152.2 Å²	152.2	69%	0.687	79%	0.785	S	S	*	*			trans	-77	84	173.3	-46.5	0	0	0	0	107.3	S3 W7	S3-T5 PolarHBondContact O-N 2.92Å; T5-W7 VanDerWaalsContact O-CD1 3.25Å
6	G	53.1	Low	59.5	Low	42 Å²	42	157 Å²	157	43%	0.433	79%	0.79	S	S	.	*			trans	-62.1	131.2	-173.8	0	0	0	0	0	113	N4 D8	N4-G6 VanDerWaalsContact C-N 3.26Å; N4-G6 PolarHBondContact O-N 3.08Å; G6-D8 PolarHBondContact O-N 3.07Å
7	W	58.7	Low	60.4	Low	268 Å²	268	154.4 Å²	154.4	100%	1.015	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	17.1	-176	-63.3	36.1	0	0	0	112.7	T5	T5-W7 VanDerWaalsContact O-CD1 3.25Å
8	D	58.4	Low	61.2	Low	144 Å²	144	150.4 Å²	150.4	77%	0.77	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.4	11	-171.2	-147.6	12.4	0	0	0	112.6	G6 V10	G6-D8 PolarHBondContact O-N 3.07Å; D8-V10 VanDerWaalsContact C-N 3.28Å; D8-V10 PolarHBondContact O-N 3.38Å
9	T	56.3	Low	62.3	Low	118 Å²	118	150 Å²	150	72%	0.724	77%	0.765	S	S	*	*			trans	-79.6	82.5	173.2	-55.7	0	0	0	0	109.2	T11	T9-T11 PolarHBondContact O-N 2.94Å
10	V	61	Low	63	Low	114 Å²	114	146.9 Å²	146.9	69%	0.691	76%	0.755	S	S	*	*			trans	-67.3	101.5	167.3	-178.8	0	0	0	0	107.8	D8 V12	D8-V10 VanDerWaalsContact C-N 3.28Å; D8-V10 PolarHBondContact O-N 3.38Å; V10-V12 HydrophobicContact CG1-CG2 4.4Å; V10-V12 PolarHBondContact O-N 3.23Å
11	T	60.8	Low	63.8	Low	106 Å²	106	144 Å²	144	65%	0.65	75%	0.748	S	S	*	*			trans	-64.2	94.5	173	-45.1	0	0	0	0	109.3	T9 L13	T9-T11 PolarHBondContact O-N 2.94Å; T11-L13 HydrophobicContact CG2-CD1 3.48Å; T11-L13 VanDerWaalsContact CG2-CD1 3.48Å; T11-L13 PolarHBondContact O-N 3.27Å
12	V	65.3	Low	65.1	Low	110 Å²	110	138.3 Å²	138.3	67%	0.667	72%	0.718	S	S	*	*			trans	-73.4	95.4	174.3	-178.6	0	0	0	0	108.5	V10 R14	V10-V12 HydrophobicContact CG1-CG2 4.4Å; V10-V12 PolarHBondContact O-N 3.23Å; V12-R14 VanDerWaalsContact C-N 3.26Å; V12-R14 PolarHBondContact O-N 3.01Å
13	L	66.1	Low	66.3	Low	147 Å²	147	132.5 Å²	132.5	77%	0.77	70%	0.696	S	S	*	*			trans	-69.5	-11.4	-172.9	-117.1	72.1	0	0	0	115.4	T11	T11-L13 HydrophobicContact CG2-CD1 3.48Å; T11-L13 VanDerWaalsContact CG2-CD1 3.48Å; T11-L13 PolarHBondContact O-N 3.27Å
14	R	62.4	Low	67.5	Low	237 Å²	237	137.2 Å²	137.2	89%	0.894	70%	0.698	S	S	*	*			trans	178.3	123.7	167.6	-103	153.2	-173.9	170.3	3.3	110.6	V12	V12-R14 VanDerWaalsContact C-N 3.26Å; V12-R14 PolarHBondContact O-N 3.01Å
15	K	69.5	Low	68.7	Low	197 Å²	197	130.9 Å²	130.9	86%	0.857	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-81.6	123.1	167.9	-162.8	172.3	-175.6	176.3	0	108.6
16	R	74.8	Confident	70.2	Confident	229 Å²	229	131.2 Å²	131.2	86%	0.864	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-58.6	137.4	175.6	-78	179.9	168.5	166.2	-3.2	109.6
17	P	75.8	Confident	71.8	Confident	112 Å²	112	137.2 Å²	137.2	73%	0.727	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-60.2	140.7	173.5	25.9	-32.9	0	0	0	109.3
18	P	73.5	Confident	73.1	Confident	83 Å²	83	126.1 Å²	126.1	54%	0.539	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-62	142.1	-179.7	26.2	-33.6	0	0	0	110.4	E22 T23	P18-E22 WeakPolarHBondContact CA-OE2 3.4Å; P18-E22 HydrophobicContact CB-CB 4.35Å; P18-T23 HydrophobicContact CB-CG2 3.92Å; P18-T23 HydrophobicContact CG-CG2 3.69Å
19	K	82.1	Confident	74.4	Confident	143 Å²	143	121.5 Å²	121.5	62%	0.622	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-64	149.9	174.7	-68.2	177.8	179.1	176	0	109.5	S21 E22 T23	K19-S21 PolarHBondContact O-N 3.31Å; K19-E22 HydrophobicContact CB-CG 4.25Å; K19-E22 PolarHBondContact N-OE2 2.95Å; K19-E22 WeakPolarHBondContact O-CA 3.41Å; K19-E22 WeakPolarHBondContact O-CB 3.33Å; K19-E22 PolarHBondContact O-N 3.34Å; K19-T23 PolarHBondContact O-N 3.25Å
20	P	77.7	Confident	76	Confident	88 Å²	88	123.2 Å²	123.2	57%	0.571	62%	0.621	S	S	*	*	H	α-helix	trans	-56	-25.9	176.4	-27.1	34.9	0	0	0	114.4	T23 R24	P20-T23 WeakPolarHBondContact CA-OG1 3.31Å; P20-T23 PolarHBondContact O-OG1 2.76Å; P20-T23 VanDerWaalsContact O-OG1 3.09Å; P20-R24 VanDerWaalsContact O-CG 3.29Å; P20-R24 WeakPolarHBondContact O-CG 3.23Å; P20-R24 PolarHBondContact O-N 3.4Å
21	S	78.5	Confident	77.3	Confident	87 Å²	87	121.1 Å²	121.1	61%	0.608	61%	0.605	S	S	*	*	H	α-helix	trans	-68.6	-33.9	173.2	52.6	0	0	0	0	112.9	K19 G25	K19-S21 PolarHBondContact O-N 3.31Å; S21-G25 PolarHBondContact O-N 3.18Å
22	E	76.4	Confident	78.5	Confident	113 Å²	113	117 Å²	117	53%	0.528	58%	0.582	S	S	.	*	H	α-helix	trans	-76.9	-38.5	-179.8	-63.5	172.4	136	0	0	110.7	P18 K19 R24 G25 A28	P18-E22 WeakPolarHBondContact CA-OE2 3.4Å; P18-E22 HydrophobicContact CB-CB 4.35Å; K19-E22 HydrophobicContact CB-CG 4.25Å; K19-E22 PolarHBondContact N-OE2 2.95Å; K19-E22 WeakPolarHBondContact O-CA 3.41Å; K19-E22 WeakPolarHBondContact O-CB 3.33Å; K19-E22 PolarHBondContact O-N 3.34Å; E22-R24 VanDerWaalsContact C-N 3.32Å; E22-R24 PolarHBondContact O-N 3.03Å; E22-G25 PolarHBondContact O-N 2.85Å; E22-A28 WeakPolarHBondContact O-CB 3.43Å
23	T	75.7	Confident	79.6	Confident	70 Å²	70	117.6 Å²	117.6	43%	0.429	58%	0.578	S	S	.	*	H	α-helix	trans	-69.4	-28.3	177.9	58	0	0	0	0	113.3	P18 K19 P20	P18-T23 HydrophobicContact CB-CG2 3.92Å; P18-T23 HydrophobicContact CG-CG2 3.69Å; K19-T23 PolarHBondContact O-N 3.25Å; P20-T23 WeakPolarHBondContact CA-OG1 3.31Å; P20-T23 PolarHBondContact O-OG1 2.76Å; P20-T23 VanDerWaalsContact O-OG1 3.09Å
24	R	81.1	Confident	80.8	Confident	200 Å²	200	118.2 Å²	118.2	76%	0.755	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-4.5	175.2	-66	176.7	-172.8	170.9	3	113.8	P20 E22	P20-R24 VanDerWaalsContact O-CG 3.29Å; P20-R24 WeakPolarHBondContact O-CG 3.23Å; P20-R24 PolarHBondContact O-N 3.4Å; E22-R24 VanDerWaalsContact C-N 3.32Å; E22-R24 PolarHBondContact O-N 3.03Å
25	G	82.3	Confident	82	Confident	28 Å²	28	115.7 Å²	115.7	29%	0.289	57%	0.567	S	S	.	*	S	Bend	trans	-69.6	147.9	-179.3	0	0	0	0	0	112.2	S21 E22 Q27 A28 V29	S21-G25 PolarHBondContact O-N 3.18Å; E22-G25 PolarHBondContact O-N 2.85Å; G25-Q27 PolarHBondContact O-N 3.49Å; G25-Q27 VanDerWaalsContact O-N 3.09Å; G25-A28 PolarHBondContact O-N 2.73Å; G25-V29 PolarHBondContact O-N 3.39Å
26	D	85.8	Confident	82.7	Confident	119 Å²	119	109.7 Å²	109.7	64%	0.636	56%	0.561	S	S	*	*	H	α-helix	trans	-51.8	-39.2	-176.9	-68.7	-11.7	0	0	0	113	R30	D26-R30 WeakPolarHBondContact O-CB 3.45Å; D26-R30 WeakPolarHBondContact O-CG 3.43Å; D26-R30 PolarHBondContact O-N 2.99Å
27	Q	86.1	Confident	83.2	Confident	169 Å²	169	102.8 Å²	102.8	79%	0.79	54%	0.544	S	S	*	.	H	α-helix	trans	-66.8	-42.7	178.7	-67.6	-176.1	-5.7	0	0	112.3	G25 R30 L31	G25-Q27 PolarHBondContact O-N 3.49Å; G25-Q27 VanDerWaalsContact O-N 3.09Å; Q27-R30 PolarHBondContact O-N 2.94Å; Q27-L31 WeakPolarHBondContact O-CB 3.39Å; Q27-L31 PolarHBondContact O-N 3.37Å
28	A	84.7	Confident	83.6	Confident	35 Å²	35	106.6 Å²	106.6	29%	0.289	55%	0.552	S	S	.	*	H	α-helix	trans	-67.8	-42	179.2	0	0	0	0	0	111.3	E22 G25 L31 A32	E22-A28 WeakPolarHBondContact O-CB 3.43Å; G25-A28 PolarHBondContact O-N 2.73Å; A28-L31 PolarHBondContact O-N 2.99Å; A28-A32 WeakPolarHBondContact O-CB 3.39Å; A28-A32 PolarHBondContact O-N 3.15Å
29	V	87.2	Confident	84.1	Confident	47 Å²	47	105.9 Å²	105.9	29%	0.285	54%	0.544	S	S	.	.	H	α-helix	trans	-62.5	-46.8	175.4	177.7	0	0	0	0	110.6	G25 L31 A32 Q33 L39	G25-V29 PolarHBondContact O-N 3.39Å; V29-L31 PolarHBondContact O-N 3.49Å; V29-A32 PolarHBondContact O-N 3.2Å; V29-Q33 WeakPolarHBondContact O-CG 3.46Å; V29-Q33 PolarHBondContact O-N 2.94Å; V29-L39 HydrophobicContact CG1-CD1 4.38Å; V29-L39 HydrophobicContact CG1-CD2 4.38Å
30	R	89	Confident	84.3	Confident	153 Å²	153	107.5 Å²	107.5	58%	0.577	55%	0.553	S	S	*	*	H	α-helix	trans	-61	-42.7	176.7	-74.1	174.7	-163.9	178.5	7	112.4	D26 Q27 Q33 Q34	D26-R30 WeakPolarHBondContact O-CB 3.45Å; D26-R30 WeakPolarHBondContact O-CG 3.43Å; D26-R30 PolarHBondContact O-N 2.99Å; Q27-R30 PolarHBondContact O-N 2.94Å; R30-Q33 WeakPolarHBondContact O-CB 3.49Å; R30-Q33 PolarHBondContact O-N 3.46Å; R30-Q34 WeakPolarHBondContact O-CG 3.5Å; R30-Q34 PolarHBondContact O-N 3.05Å
31	L	88	Confident	84.8	Confident	70 Å²	70	109.6 Å²	109.6	37%	0.366	57%	0.565	S	S	.	*	H	α-helix	trans	-65	-39.6	177.7	-176.4	64.7	0	0	0	111.9	Q27 A28 V29 Q34 R35	Q27-L31 WeakPolarHBondContact O-CB 3.39Å; Q27-L31 PolarHBondContact O-N 3.37Å; A28-L31 PolarHBondContact O-N 2.99Å; V29-L31 PolarHBondContact O-N 3.49Å; L31-Q34 PolarHBondContact O-N 3.27Å; L31-R35 HydrophobicContact CD1-CG 4.46Å; L31-R35 WeakPolarHBondContact O-CB 3.31Å; L31-R35 WeakPolarHBondContact O-CG 3.44Å; L31-R35 PolarHBondContact O-N 2.93Å
32	A	86.3	Confident	85.4	Confident	19 Å²	19	110.6 Å²	110.6	16%	0.157	57%	0.567	C	S	.	*	H	α-helix	trans	-63.8	-41.7	174.8	0	0	0	0	0	111.8	A28 V29 Q34 R35 G36 V37 L39	A28-A32 WeakPolarHBondContact O-CB 3.39Å; A28-A32 PolarHBondContact O-N 3.15Å; V29-A32 PolarHBondContact O-N 3.2Å; A32-Q34 PolarHBondContact O-N 3.14Å; A32-R35 PolarHBondContact O-N 3.13Å; A32-G36 PolarHBondContact O-N 2.9Å; A32-V37 HydrophobicContact CB-CB 4.2Å; A32-V37 PolarHBondContact O-N 3.16Å; A32-L39 HydrophobicContact CB-CD1 4.36Å; A32-L39 HydrophobicContact CB-CD2 3.84Å; A32-L39 HydrophobicContact CB-CG 4.24Å
33	Q	89	Confident	86	Confident	124 Å²	124	115 Å²	115	58%	0.579	58%	0.579	S	S	*	*	H	α-helix	trans	-59	-45.8	173.1	-70.9	175.8	-24.4	0	0	111.6	V29 R30 R35 G36 L39	V29-Q33 WeakPolarHBondContact O-CG 3.46Å; V29-Q33 PolarHBondContact O-N 2.94Å; R30-Q33 WeakPolarHBondContact O-CB 3.49Å; R30-Q33 PolarHBondContact O-N 3.46Å; Q33-R35 VanDerWaalsContact C-N 3.33Å; Q33-R35 PolarHBondContact O-N 3.35Å; Q33-G36 PolarHBondContact O-N 3.07Å; Q33-L39 HydrophobicContact CB-CD1 4.31Å; Q33-L39 HydrophobicContact CG-CD1 3.26Å
34	Q	89.9	Confident	86.7	Confident	160 Å²	160	119.9 Å²	119.9	75%	0.748	60%	0.595	S	S	*	*	H	α-helix	trans	-64.8	-35.3	179.1	-73.3	176.7	-6.3	0	0	113.2	R30 L31 A32 G36	R30-Q34 WeakPolarHBondContact O-CG 3.5Å; R30-Q34 PolarHBondContact O-N 3.05Å; L31-Q34 PolarHBondContact O-N 3.27Å; A32-Q34 PolarHBondContact O-N 3.14Å; Q34-G36 VanDerWaalsContact C-N 3.3Å
35	R	88.7	Confident	87	Confident	184 Å²	184	119.3 Å²	119.3	69%	0.694	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-0.2	-179.6	-68.9	179.8	-179.6	-173.8	-0.4	113.7	L31 A32 Q33 V37	L31-R35 HydrophobicContact CD1-CG 4.46Å; L31-R35 WeakPolarHBondContact O-CB 3.31Å; L31-R35 WeakPolarHBondContact O-CG 3.44Å; L31-R35 PolarHBondContact O-N 2.93Å; A32-R35 PolarHBondContact O-N 3.13Å; Q33-R35 VanDerWaalsContact C-N 3.33Å; Q33-R35 PolarHBondContact O-N 3.35Å; R35-V37 HydrophobicContact CB-CG2 3.91Å; R35-V37 PolarHBondContact O-N 3.09Å
36	G	84	Confident	87.2	Confident	71 Å²	71	122.6 Å²	122.6	73%	0.732	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	66	22.1	-176.1	0	0	0	0	0	113.8	A32 Q33 Q34	A32-G36 PolarHBondContact O-N 2.9Å; Q33-G36 PolarHBondContact O-N 3.07Å; Q34-G36 VanDerWaalsContact C-N 3.3Å
37	V	84.9	Confident	87.2	Confident	84 Å²	84	118.7 Å²	118.7	51%	0.509	59%	0.593	S	S	.	*			trans	-75	135.9	177.2	179.3	0	0	0	0	108.7	A32 R35 L39	A32-V37 HydrophobicContact CB-CB 4.2Å; A32-V37 PolarHBondContact O-N 3.16Å; R35-V37 HydrophobicContact CB-CG2 3.91Å; R35-V37 PolarHBondContact O-N 3.09Å; V37-L39 PolarHBondContact O-N 3.19Å
38	Q	84.6	Confident	87.3	Confident	191 Å²	191	115.7 Å²	115.7	89%	0.893	60%	0.597	S	S	*	*			trans	-58.5	129.5	179.6	-168.7	176	21	0	0	111.1
39	L	84.2	Confident	87.6	Confident	69 Å²	69	117.7 Å²	117.7	36%	0.361	61%	0.606	S	S	.	*			trans	-113.1	123.6	178.1	-74.9	162.5	0	0	0	109.7	V29 A32 Q33 V37	V29-L39 HydrophobicContact CG1-CD1 4.38Å; V29-L39 HydrophobicContact CG1-CD2 4.38Å; A32-L39 HydrophobicContact CB-CD1 4.36Å; A32-L39 HydrophobicContact CB-CD2 3.84Å; A32-L39 HydrophobicContact CB-CG 4.24Å; Q33-L39 HydrophobicContact CB-CD1 4.31Å; Q33-L39 HydrophobicContact CG-CD1 3.26Å; V37-L39 PolarHBondContact O-N 3.19Å
40	E	87.2	Confident	87.6	Confident	176 Å²	176	121.6 Å²	121.6	82%	0.822	63%	0.625	S	S	*	*			trans	-78.9	127.9	169	-168.1	-176.1	170	0	0	109.2	T42	E40-T42 HydrophobicContact CG-CG2 4.42Å
41	T	88	Confident	87.4	Confident	132 Å²	132	120.9 Å²	120.9	81%	0.81	63%	0.626	S	S	*	*			trans	-120	128.5	174.4	62.8	0	0	0	0	109.4
42	T	89.7	Confident	87	Confident	108 Å²	108	123.1 Å²	123.1	66%	0.663	64%	0.635	S	S	*	*			trans	-124.9	132.2	179.8	58.6	0	0	0	0	109	E40 K44	E40-T42 HydrophobicContact CG-CG2 4.42Å; T42-K44 PolarHBondContact O-N 3.21Å
43	R	89.9	Confident	86.7	Confident	206 Å²	206	128 Å²	128	78%	0.777	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-65.8	132.9	173.9	-172.6	175.1	-178.8	167.4	0.6	109.7	A47	R43-A47 HydrophobicContact CG-CB 3.95Å
44	K	90.6	Very high	86.3	Confident	173 Å²	173	125.5 Å²	125.5	75%	0.752	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-67.7	140.9	176.2	-61.4	-178	-179.9	177.9	0	110.3	T42 N46 A47	T42-K44 PolarHBondContact O-N 3.21Å; K44-N46 PolarHBondContact O-N 3.39Å; K44-A47 HydrophobicContact CB-CB 4.21Å; K44-A47 WeakPolarHBondContact O-CB 3.35Å; K44-A47 PolarHBondContact O-N 2.88Å
45	F	86.1	Confident	85.9	Confident	188 Å²	188	124.4 Å²	124.4	83%	0.825	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	133.9	167.2	-176.3	-109.1	0	0	0	109.3	A47	F45-A47 VanDerWaalsContact C-N 3.27Å; F45-A47 PolarHBondContact O-N 3.47Å
46	N	86.5	Confident	85.3	Confident	96 Å²	96	119.1 Å²	119.1	51%	0.513	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	61.4	24.2	-170.8	-61	-35.5	0	0	0	115.3	K44 A48 T49	K44-N46 PolarHBondContact O-N 3.39Å; N46-A48 PolarHBondContact O-N 3.44Å; N46-T49 HydrophobicContact CB-CG2 3.46Å; N46-T49 VanDerWaalsContact CB-CG2 3.46Å; N46-T49 WeakPolarHBondContact O-CG2 3.19Å
47	A	86.5	Confident	85	Confident	38 Å²	38	119 Å²	119	31%	0.314	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.4	133.5	168.9	0	0	0	0	0	111.1	R43 K44 F45	R43-A47 HydrophobicContact CG-CB 3.95Å; K44-A47 HydrophobicContact CB-CB 4.21Å; K44-A47 WeakPolarHBondContact O-CB 3.35Å; K44-A47 PolarHBondContact O-N 2.88Å; F45-A47 VanDerWaalsContact C-N 3.27Å; F45-A47 PolarHBondContact O-N 3.47Å
48	A	88.8	Confident	84.8	Confident	106 Å²	106	118.7 Å²	118.7	88%	0.876	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.6	26.3	-178.4	0	0	0	0	0	115.7	N46	N46-A48 PolarHBondContact O-N 3.44Å
49	T	90	Very high	84.6	Confident	76 Å²	76	112.9 Å²	112.9	47%	0.466	60%	0.597	S	S	.	*			trans	-117.8	152.5	166.6	170.5	0	0	0	0	111.1	N46	N46-T49 HydrophobicContact CB-CG2 3.46Å; N46-T49 VanDerWaalsContact CB-CG2 3.46Å; N46-T49 WeakPolarHBondContact O-CG2 3.19Å
50	N	87.1	Confident	84.6	Confident	130 Å²	130	112.5 Å²	112.5	70%	0.695	60%	0.604	S	S	*	*			trans	-112.6	35.1	-177.3	65	-19.5	0	0	0	112.3	Q52	N50-Q52 PolarHBondContact O-N 3.43Å; N50-Q52 PolarHBondContact O-NE2 3.41Å
51	K	86	Confident	84.3	Confident	138 Å²	138	110.1 Å²	110.1	60%	0.6	59%	0.591	S	S	*	*			trans	-55.1	112	179.6	-173.3	170.2	-175.8	171.8	0	111	H53	K51-H53 VanDerWaalsContact CE-O 3.22Å; K51-H53 WeakPolarHBondContact CE-O 3.37Å
52	Q	78.9	Confident	84	Confident	117 Å²	117	107.3 Å²	107.3	55%	0.547	57%	0.571	S	S	.	*			trans	-77.3	-39.1	-173.7	-64.5	-61.7	-53.4	0	0	113	N50	N50-Q52 PolarHBondContact O-N 3.43Å; N50-Q52 PolarHBondContact O-NE2 3.41Å
53	H	81.3	Confident	83.7	Confident	122 Å²	122	109 Å²	109	57%	0.565	58%	0.576	S	S	*	*			trans	-103.6	105.8	-179.1	-60.7	-63.2	0	0	0	110	K51 E102	K51-H53 VanDerWaalsContact CE-O 3.22Å; K51-H53 WeakPolarHBondContact CE-O 3.37Å; H53-E102 IonicContact CE1-OE1 3.15Å; H53-E102 IonicContact CE1-OE2 3.3Å; H53-E102 PolarHBondContact CE1-OE2 3.42Å
54	V	80.3	Confident	83.4	Confident	70 Å²	70	107.3 Å²	107.3	42%	0.424	57%	0.574	S	S	.	*			trans	-102.9	138.6	176.6	-174.3	0	0	0	0	109.1	T56	V54-T56 PolarHBondContact O-N 3.02Å
55	M	79.9	Confident	82.8	Confident	137 Å²	137	102.1 Å²	102.1	68%	0.675	55%	0.552	S	S	*	*			trans	-59.8	132.4	174.1	-61.4	-59.1	-72.8	0	0	109.5
56	T	76.3	Confident	82.4	Confident	74 Å²	74	99.8 Å²	99.8	45%	0.454	55%	0.554	S	S	.	*	S	Bend	trans	-75.5	-31.6	-178.4	52.7	0	0	0	0	112.4	V54 N118	V54-T56 PolarHBondContact O-N 3.02Å; T56-N118 HydrophobicContact CG2-CB 3.55Å; T56-N118 WeakPolarHBondContact CG2-ND2 3.1Å
57	K	78.2	Confident	81.9	Confident	69 Å²	69	103.1 Å²	103.1	30%	0.3	57%	0.566	S	S	.	*	S	Bend	trans	-105.4	150.5	174.4	-69.3	-174.4	172.9	-171.3	0	110.4	A59 L62 H70	K57-A59 PolarHBondContact O-N 3.16Å; K57-L62 HydrophobicContact CB-CD1 3.99Å; K57-L62 HydrophobicContact CB-CD2 4.37Å; K57-L62 HydrophobicContact CB-CG 4.16Å; K57-L62 HydrophobicContact CD-CD2 3.92Å; K57-H70 PolarHBondContact NZ-O 3.36Å
58	S	80.1	Confident	81.3	Confident	77 Å²	77	106.4 Å²	106.4	54%	0.538	59%	0.594	S	S	.	*			trans	-68.2	122	176.1	-179.8	0	0	0	0	110.2	A60 K61 L62	S58-A60 PolarHBondContact O-N 3.5Å; S58-K61 WeakPolarHBondContact O-CB 3.42Å; S58-K61 PolarHBondContact O-N 3.34Å; S58-L62 PolarHBondContact O-N 3.41Å; S58-L62 VanDerWaalsContact O-N 3.08Å
59	A	81	Confident	80.5	Confident	68 Å²	68	104.4 Å²	104.4	56%	0.562	57%	0.566	S	S	*	*	H	α-helix	trans	-56.7	-38.8	179.3	0	0	0	0	0	112.1	K57 K61 L62 D63	K57-A59 PolarHBondContact O-N 3.16Å; A59-K61 PolarHBondContact O-N 2.87Å; A59-L62 PolarHBondContact O-N 3.26Å; A59-D63 WeakPolarHBondContact O-CB 3.28Å; A59-D63 PolarHBondContact O-N 3.23Å
60	A	83.4	Confident	79.9	Confident	62 Å²	62	108 Å²	108	51%	0.512	58%	0.577	S	S	.	*	H	α-helix	trans	-67.4	-23.3	177.6	0	0	0	0	0	113.8	S58 K64	S58-A60 PolarHBondContact O-N 3.5Å; A60-K64 WeakPolarHBondContact O-CG 3.2Å
61	K	82.2	Confident	79.6	Confident	125 Å²	125	106 Å²	106	54%	0.543	57%	0.566	S	S	.	*	H	α-helix	trans	-79.9	-46.4	173.5	177.6	164.8	-179.9	178.3	0	109.7	S58 A59 D63 K64 E65	S58-K61 WeakPolarHBondContact O-CB 3.42Å; S58-K61 PolarHBondContact O-N 3.34Å; A59-K61 PolarHBondContact O-N 2.87Å; K61-D63 VanDerWaalsContact C-N 3.27Å; K61-D63 PolarHBondContact O-N 3.44Å; K61-K64 PolarHBondContact O-N 2.89Å; K61-E65 WeakPolarHBondContact CE-OE1 3.27Å; K61-E65 WeakPolarHBondContact CG-OE1 3.14Å; K61-E65 VanDerWaalsContact O-CG 3.26Å; K61-E65 WeakPolarHBondContact O-CG 3.32Å; K61-E65 PolarHBondContact O-N 3.2Å
62	L	81.6	Confident	79.5	Confident	74 Å²	74	104.7 Å²	104.7	39%	0.387	57%	0.565	S	S	.	*	H	α-helix	trans	-58	-37.5	175.9	-68.6	174.3	0	0	0	113.1	K57 S58 A59 E65	K57-L62 HydrophobicContact CB-CD1 3.99Å; K57-L62 HydrophobicContact CB-CD2 4.37Å; K57-L62 HydrophobicContact CB-CG 4.16Å; K57-L62 HydrophobicContact CD-CD2 3.92Å; S58-L62 PolarHBondContact O-N 3.41Å; S58-L62 VanDerWaalsContact O-N 3.08Å; A59-L62 PolarHBondContact O-N 3.26Å; L62-E65 PolarHBondContact O-N 2.79Å
63	D	83.2	Confident	80	Confident	142 Å²	142	102.6 Å²	102.6	76%	0.759	56%	0.56	S	S	*	*	H	α-helix	trans	-69.2	-33.6	179.6	-173.9	66.8	0	0	0	113.5	A59 K61 E65	A59-D63 WeakPolarHBondContact O-CB 3.28Å; A59-D63 PolarHBondContact O-N 3.23Å; K61-D63 VanDerWaalsContact C-N 3.27Å; K61-D63 PolarHBondContact O-N 3.44Å; D63-E65 VanDerWaalsContact C-N 3.32Å
64	K	84.6	Confident	80.3	Confident	171 Å²	171	97.5 Å²	97.5	74%	0.743	54%	0.538	S	S	*	.	H	α-helix	trans	-79.1	-18.6	177.9	-71.5	179.6	-178.8	-171.2	0	113.3	A60 K61 T66	A60-K64 WeakPolarHBondContact O-CG 3.2Å; K61-K64 PolarHBondContact O-N 2.89Å; K64-T66 PolarHBondContact O-N 2.97Å
65	E	77	Confident	80.7	Confident	64 Å²	64	95.5 Å²	95.5	30%	0.299	53%	0.531	S	S	.	.			trans	-88.3	111.7	-173	-75	-170.3	-132.7	0	0	110.6	K61 L62 D63 Q69	K61-E65 WeakPolarHBondContact CE-OE1 3.27Å; K61-E65 WeakPolarHBondContact CG-OE1 3.14Å; K61-E65 VanDerWaalsContact O-CG 3.26Å; K61-E65 WeakPolarHBondContact O-CG 3.32Å; K61-E65 PolarHBondContact O-N 3.2Å; L62-E65 PolarHBondContact O-N 2.79Å; D63-E65 VanDerWaalsContact C-N 3.32Å; E65-Q69 PolarHBondContact OE1-NE2 3.39Å; E65-Q69 WeakPolarHBondContact OE2-CG 3.46Å; E65-Q69 PolarHBondContact OE2-NE2 3.01Å
66	T	77.1	Confident	81.3	Confident	140 Å²	140	94 Å²	94	86%	0.859	53%	0.525	S	S	*	.			trans	-88.8	-10.9	179.7	51.8	0	0	0	0	113.1	K64	K64-T66 PolarHBondContact O-N 2.97Å
67	E	77.3	Confident	82.1	Confident	166 Å²	166	95.5 Å²	95.5	78%	0.776	53%	0.527	S	S	*	.	S	Bend	trans	-105.3	153.9	-179.3	-64.8	-177.3	-177.7	0	0	111.8	Q69	E67-Q69 PolarHBondContact O-N 2.95Å; E67-Q69 VanDerWaalsContact O-N 3.15Å
68	A	73.3	Confident	82.7	Confident	107 Å²	107	92.5 Å²	92.5	88%	0.884	51%	0.514	S	S	*	.			trans	-67.4	112.6	179.4	0	0	0	0	0	111.2
69	Q	72.4	Confident	83.4	Confident	63 Å²	63	88.9 Å²	88.9	29%	0.294	49%	0.489	S	S	.	.			trans	-75.4	134.7	173.5	-72.4	-160.1	-50.7	0	0	112.4	E65 E67 I71	E65-Q69 PolarHBondContact OE1-NE2 3.39Å; E65-Q69 WeakPolarHBondContact OE2-CG 3.46Å; E65-Q69 PolarHBondContact OE2-NE2 3.01Å; E67-Q69 PolarHBondContact O-N 2.95Å; E67-Q69 VanDerWaalsContact O-N 3.15Å; Q69-I71 PolarHBondContact O-N 3.22Å
70	H	77.7	Confident	84	Confident	153 Å²	153	93.4 Å²	93.4	71%	0.708	49%	0.492	S	S	*	.			trans	-58.7	131.5	159.3	-171	71.1	0	0	0	109.8	K57 D72	K57-H70 PolarHBondContact NZ-O 3.36Å; H70-D72 IonicContact CD2-OD1 3.41Å; H70-D72 PolarHBondContact CD2-OD1 3.01Å; H70-D72 IonicContact NE2-OD1 3.85Å
71	I	79.8	Confident	84.5	Confident	88 Å²	88	91.5 Å²	91.5	45%	0.451	47%	0.473	S	S	.	.			trans	-109.9	111	175.6	-60.7	175.6	0	0	0	107.2	Q69 T73 V116	Q69-I71 PolarHBondContact O-N 3.22Å; I71-T73 PolarHBondContact O-N 3.33Å; I71-V116 HydrophobicContact CG2-CB 4.17Å; I71-V116 HydrophobicContact CG2-CG1 3.57Å; I71-V116 HydrophobicContact CG2-CG2 3.63Å
72	D	83.1	Confident	85.1	Confident	109 Å²	109	85.6 Å²	85.6	58%	0.583	45%	0.447	S	S	*	.			trans	-63.3	128.3	176	-59.5	-39.3	0	0	0	110.1	H70 V117	H70-D72 IonicContact CD2-OD1 3.41Å; H70-D72 PolarHBondContact CD2-OD1 3.01Å; H70-D72 IonicContact NE2-OD1 3.85Å; D72-V117 HydrophobicContact CB-CG2 4.38Å; D72-V117 PolarHBondContact O-N 3.28Å
73	T	89.4	Confident	85.7	Confident	73 Å²	73	86 Å²	86	45%	0.448	45%	0.447	S	S	.	.	B	Isolated β-bridge	trans	-96.7	161.9	170.7	60.4	0	0	0	0	109.8	I71 G75 G113 A115	I71-T73 PolarHBondContact O-N 3.33Å; T73-G75 PolarHBondContact O-N 3.32Å; T73-G113 WeakPolarHBondContact CB-O 3.16Å; T73-A115 WeakPolarHBondContact CA-O 3.42Å
74	V	88.6	Confident	86.2	Confident	16 Å²	16	86 Å²	86	10%	0.097	44%	0.44	C	S	.	.			trans	-64	-21.2	179.1	-68	0	0	0	0	113.7	V78 Y110 A115 V117 L122	V74-V78 HydrophobicContact CB-CB 4.23Å; V74-V78 HydrophobicContact CB-CG1 4.13Å; V74-V78 WeakPolarHBondContact O-CB 3.33Å; V74-V78 VanDerWaalsContact O-CG2 3.28Å; V74-V78 WeakPolarHBondContact O-CG2 3.38Å; V74-Y110 HydrophobicContact CB-CD1 4.42Å; V74-Y110 HydrophobicContact CG1-CD1 3.66Å; V74-Y110 HydrophobicContact CG1-CE1 3.51Å; V74-Y110 HydrophobicContact CG2-CD1 4.06Å; V74-A115 HydrophobicContact CG2-CB 4.44Å; V74-A115 PolarHBondContact N-O 2.87Å; V74-V117 HydrophobicContact CG1-CG2 4Å; V74-L122 HydrophobicContact CG1-CD2 4.21Å
75	G	89.5	Confident	86.7	Confident	27 Å²	27	77.9 Å²	77.9	28%	0.278	41%	0.405	S	S	.	.	H	α-helix	trans	76.2	160.7	-176.9	0	0	0	0	0	113.2	T73 E77 V78 G79 G113	T73-G75 PolarHBondContact O-N 3.32Å; G75-E77 VanDerWaalsContact C-N 3.34Å; G75-E77 PolarHBondContact O-N 3.34Å; G75-V78 PolarHBondContact O-N 3.25Å; G75-G79 PolarHBondContact O-N 2.94Å; G75-G113 PolarHBondContact N-O 3.21Å; G75-G113 WeakPolarHBondContact O-CA 3.3Å
76	I	92.2	Very high	87.5	Confident	105 Å²	105	76.8 Å²	76.8	54%	0.538	40%	0.398	S	S	.	.	H	α-helix	trans	-68.3	-33.6	-172.9	-60.7	171	0	0	0	111.9	V78 G79 R80	I76-V78 PolarHBondContact O-N 2.68Å; I76-G79 PolarHBondContact O-N 3.06Å; I76-R80 HydrophobicContact CG2-CG 4.46Å; I76-R80 WeakPolarHBondContact O-CG 3.46Å; I76-R80 PolarHBondContact O-N 3.37Å
77	E	91.7	Very high	88.3	Confident	107 Å²	107	75.3 Å²	75.3	50%	0.5	38%	0.382	S	S	.	.	H	α-helix	trans	-57.1	-47.7	178.5	-177	-169.1	-153.2	0	0	111.8	G75 G79 R80 I81 K138	G75-E77 VanDerWaalsContact C-N 3.34Å; G75-E77 PolarHBondContact O-N 3.34Å; E77-G79 VanDerWaalsContact C-N 3.33Å; E77-G79 PolarHBondContact O-N 3Å; E77-R80 PolarHBondContact O-N 3.41Å; E77-I81 HydrophobicContact CG-CD1 4.35Å; E77-I81 WeakPolarHBondContact O-CG1 3.46Å; E77-I81 PolarHBondContact O-N 3.48Å; E77-K138 IonicContact OE2-NZ 3.95Å; E77-K138 PolarHBondContact OE2-NZ 3.19Å
78	V	92.5	Very high	89.1	Confident	6 Å²	6	72.7 Å²	72.7	4%	0.036	38%	0.377	C	S	.	.	H	α-helix	trans	-63.2	-42	177.6	173.2	0	0	0	0	110.6	V74 G75 I76 R80 I81 I82 L122 L133 K138	V74-V78 HydrophobicContact CB-CB 4.23Å; V74-V78 HydrophobicContact CB-CG1 4.13Å; V74-V78 WeakPolarHBondContact O-CB 3.33Å; V74-V78 VanDerWaalsContact O-CG2 3.28Å; V74-V78 WeakPolarHBondContact O-CG2 3.38Å; G75-V78 PolarHBondContact O-N 3.25Å; I76-V78 PolarHBondContact O-N 2.68Å; V78-R80 VanDerWaalsContact C-N 3.34Å; V78-R80 PolarHBondContact O-N 3.3Å; V78-I81 PolarHBondContact O-N 3.13Å; V78-I82 HydrophobicContact CG1-CD1 3.93Å; V78-I82 HydrophobicContact CG1-CG1 4.47Å; V78-I82 WeakPolarHBondContact O-CG1 3.49Å; V78-I82 PolarHBondContact O-N 3.44Å; V78-L122 HydrophobicContact CG1-CD2 4.39Å; V78-L133 HydrophobicContact CG1-CB 4.23Å; V78-L133 HydrophobicContact CG1-CD2 4.25Å; V78-K138 HydrophobicContact CG2-CD 4.22Å
79	G	94.1	Very high	90	Very high	1 Å²	1	71.7 Å²	71.7	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-57.1	-43.8	176	0	0	0	0	0	113.2	G75 I76 E77 I81 I82 Q83 Y110 E111	G75-G79 PolarHBondContact O-N 2.94Å; I76-G79 PolarHBondContact O-N 3.06Å; E77-G79 VanDerWaalsContact C-N 3.33Å; E77-G79 PolarHBondContact O-N 3Å; G79-I81 PolarHBondContact O-N 3.2Å; G79-I82 PolarHBondContact O-N 2.91Å; G79-Q83 PolarHBondContact O-N 3.02Å; G79-Y110 WeakPolarHBondContact CA-O 3.3Å; G79-E111 WeakPolarHBondContact CA-O 3.47Å
80	R	94.1	Very high	91.1	Very high	163 Å²	163	77.9 Å²	77.9	62%	0.615	38%	0.379	S	S	*	.	H	α-helix	trans	-63.2	-40.3	176	-69	178.5	-173.4	138.3	0.4	112.6	I76 E77 V78 Q83 K84	I76-R80 HydrophobicContact CG2-CG 4.46Å; I76-R80 WeakPolarHBondContact O-CG 3.46Å; I76-R80 PolarHBondContact O-N 3.37Å; E77-R80 PolarHBondContact O-N 3.41Å; V78-R80 VanDerWaalsContact C-N 3.34Å; V78-R80 PolarHBondContact O-N 3.3Å; R80-Q83 PolarHBondContact O-N 3.01Å; R80-K84 WeakPolarHBondContact O-CB 3.34Å; R80-K84 PolarHBondContact O-N 3.35Å
81	I	94	Very high	91.9	Very high	22 Å²	22	73.8 Å²	73.8	11%	0.113	36%	0.357	C	S	.	.	H	α-helix	trans	-65.2	-42.8	178.3	-64.6	163.4	0	0	0	110.6	E77 V78 G79 Q83 K84 G85 L131 L133 K138	E77-I81 HydrophobicContact CG-CD1 4.35Å; E77-I81 WeakPolarHBondContact O-CG1 3.46Å; E77-I81 PolarHBondContact O-N 3.48Å; V78-I81 PolarHBondContact O-N 3.13Å; G79-I81 PolarHBondContact O-N 3.2Å; I81-Q83 VanDerWaalsContact C-N 3.34Å; I81-Q83 PolarHBondContact O-N 3.18Å; I81-K84 PolarHBondContact O-N 3.38Å; I81-G85 PolarHBondContact O-N 3.5Å; I81-L131 HydrophobicContact CG2-CB 4.21Å; I81-L131 HydrophobicContact CG2-CD1 3.95Å; I81-L133 HydrophobicContact CB-CD2 3.96Å; I81-L133 HydrophobicContact CG2-CD2 3.53Å; I81-K138 HydrophobicContact CD1-CB 3.73Å
82	I	94.7	Very high	92.7	Very high	0 Å²	0	73 Å²	73	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-59.1	-48.8	175.6	-65.8	164.4	0	0	0	109.9	V78 G79 K84 G85 R86 L96 E111 L125 I129 L133	V78-I82 HydrophobicContact CG1-CD1 3.93Å; V78-I82 HydrophobicContact CG1-CG1 4.47Å; V78-I82 WeakPolarHBondContact O-CG1 3.49Å; V78-I82 PolarHBondContact O-N 3.44Å; G79-I82 PolarHBondContact O-N 2.91Å; I82-K84 PolarHBondContact O-N 3.47Å; I82-G85 PolarHBondContact O-N 3.02Å; I82-R86 WeakPolarHBondContact O-CB 3.35Å; I82-R86 PolarHBondContact O-N 3.19Å; I82-L96 HydrophobicContact CG2-CD2 3.97Å; I82-E111 HydrophobicContact CB-CG 4.36Å; I82-E111 HydrophobicContact CG2-CG 3.83Å; I82-L125 HydrophobicContact CD1-CD1 4Å; I82-L125 HydrophobicContact CG2-CD2 4.41Å; I82-I129 HydrophobicContact CG1-CD1 4.42Å; I82-L133 HydrophobicContact CD1-CD1 3.99Å; I82-L133 HydrophobicContact CG1-CD1 3.63Å; I82-L133 HydrophobicContact CG1-CD2 3.75Å; I82-L133 HydrophobicContact CG1-CG 4.36Å
83	Q	94.3	Very high	93.2	Very high	82 Å²	82	70 Å²	70	38%	0.383	34%	0.339	S	S	.	.	H	α-helix	trans	-60.6	-44.6	-179.7	-164.1	-174	38.4	0	0	111.6	G79 R80 I81 R86 Q87	G79-Q83 PolarHBondContact O-N 3.02Å; R80-Q83 PolarHBondContact O-N 3.01Å; I81-Q83 VanDerWaalsContact C-N 3.34Å; I81-Q83 PolarHBondContact O-N 3.18Å; Q83-R86 PolarHBondContact O-N 2.92Å; Q83-Q87 VanDerWaalsContact O-CG 3.28Å; Q83-Q87 WeakPolarHBondContact O-CG 3.47Å; Q83-Q87 PolarHBondContact O-N 3.07Å
84	K	93.7	Very high	93.5	Very high	142 Å²	142	67.5 Å²	67.5	62%	0.617	33%	0.326	S	S	*	.	H	α-helix	trans	-59.9	-48.7	174.8	-176.1	179	-179.8	-179.8	0	111.4	R80 I81 I82 R86 Q87 T88	R80-K84 WeakPolarHBondContact O-CB 3.34Å; R80-K84 PolarHBondContact O-N 3.35Å; I81-K84 PolarHBondContact O-N 3.38Å; I82-K84 PolarHBondContact O-N 3.47Å; K84-R86 VanDerWaalsContact C-N 3.31Å; K84-R86 PolarHBondContact O-N 2.92Å; K84-Q87 PolarHBondContact O-N 3.05Å; K84-T88 PolarHBondContact O-N 2.95Å; K84-T88 PolarHBondContact O-OG1 3.25Å
85	G	94.1	Very high	93.9	Very high	2 Å²	2	69.2 Å²	69.2	2%	0.021	34%	0.335	C	S	.	.	H	α-helix	trans	-60.2	-39.9	178.8	0	0	0	0	0	112.9	I81 I82 K89	I81-G85 PolarHBondContact O-N 3.5Å; I82-G85 PolarHBondContact O-N 3.02Å; G85-K89 PolarHBondContact O-N 3.35Å
86	R	94.9	Very high	94.2	Very high	40 Å²	40	68 Å²	68	15%	0.151	32%	0.322	C	S	.	.	H	α-helix	trans	-63.2	-45.5	174.4	-177	-179.3	65.1	80	-6.8	111.9	I82 Q83 K84 K89 K90 W91 L96 E111	I82-R86 WeakPolarHBondContact O-CB 3.35Å; I82-R86 PolarHBondContact O-N 3.19Å; Q83-R86 PolarHBondContact O-N 2.92Å; K84-R86 VanDerWaalsContact C-N 3.31Å; K84-R86 PolarHBondContact O-N 2.92Å; R86-K89 CarbonylContact O-C 3.56Å; R86-K89 PolarHBondContact O-N 2.93Å; R86-K90 PolarHBondContact O-N 2.89Å; R86-K90 VanDerWaalsContact O-N 3.14Å; R86-W91 WeakPolarHBondContact CD-O 3.22Å; R86-W91 HydrophobicContact CG-CB 3.85Å; R86-W91 WeakPolarHBondContact CG-O 3.45Å; R86-W91 PolarHBondContact NH1-O 3.38Å; R86-W91 PolarHBondContact O-N 2.86Å; R86-L96 HydrophobicContact CB-CD2 4.4Å; R86-L96 HydrophobicContact CG-CD2 4.47Å; R86-E111 WeakPolarHBondContact CD-OE1 3.38Å; R86-E111 IonicContact CZ-OE1 3.84Å; R86-E111 IonicContact NE-OE1 2.85Å; R86-E111 PolarHBondContact NE-OE1 2.91Å; R86-E111 IonicContact NE-OE2 2.79Å; R86-E111 IonicContact NH2-OE1 3.93Å; R86-E111 IonicContact NH2-OE2 2.68Å
87	Q	93.6	Very high	94.4	Very high	109 Å²	109	63.1 Å²	63.1	51%	0.509	30%	0.298	S	S	.	.	H	α-helix	trans	-65.4	-42.2	179.5	-72.3	175	19.2	0	0	112.3	Q83 K84 K89 K90	Q83-Q87 VanDerWaalsContact O-CG 3.28Å; Q83-Q87 WeakPolarHBondContact O-CG 3.47Å; Q83-Q87 PolarHBondContact O-N 3.07Å; K84-Q87 PolarHBondContact O-N 3.05Å; Q87-K89 PolarHBondContact O-N 3.36Å; Q87-K90 PolarHBondContact O-N 3.25Å
88	T	93.3	Very high	94.6	Very high	112 Å²	112	66.2 Å²	66.2	69%	0.687	31%	0.305	S	S	*	.	H	α-helix	trans	-56.8	-37	174.8	-54.4	0	0	0	0	111.8	K84 K90	K84-T88 PolarHBondContact O-N 2.95Å; K84-T88 PolarHBondContact O-OG1 3.25Å; T88-K90 VanDerWaalsContact C-N 3.32Å
89	K	93.4	Very high	94.6	Very high	86 Å²	86	71.6 Å²	71.6	37%	0.374	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	0.5	176.8	-66.1	-166.4	174.8	-167.1	0	114.4	G85 R86 Q87 W91 A128 I129	G85-K89 PolarHBondContact O-N 3.35Å; R86-K89 CarbonylContact O-C 3.56Å; R86-K89 PolarHBondContact O-N 2.93Å; Q87-K89 PolarHBondContact O-N 3.36Å; K89-W91 HydrophobicContact CB-CD2 3.87Å; K89-W91 HydrophobicContact CB-CE3 4.16Å; K89-W91 HydrophobicContact CB-CG 4.12Å; K89-W91 HydrophobicContact CD-CD2 4.38Å; K89-W91 HydrophobicContact CD-CE3 4.07Å; K89-W91 HydrophobicContact CD-CH2 3.69Å; K89-W91 HydrophobicContact CD-CZ2 4Å; K89-W91 HydrophobicContact CD-CZ3 3.73Å; K89-W91 PolarHBondContact O-N 3.1Å; K89-A128 WeakPolarHBondContact CE-O 3.35Å; K89-A128 PolarHBondContact NZ-O 3.45Å; K89-I129 VanDerWaalsContact CE-O 3.22Å; K89-I129 WeakPolarHBondContact CE-O 3.48Å
90	K	94.6	Very high	94.6	Very high	192 Å²	192	71.8 Å²	71.8	84%	0.835	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	33.8	-175.9	-56.1	-179	179.6	178.9	0	113.6	R86 Q87 T88	R86-K90 PolarHBondContact O-N 2.89Å; R86-K90 VanDerWaalsContact O-N 3.14Å; Q87-K90 PolarHBondContact O-N 3.25Å; T88-K90 VanDerWaalsContact C-N 3.32Å
91	W	95.1	Very high	94.7	Very high	67 Å²	67	70.2 Å²	70.2	25%	0.254	33%	0.334	S	S	.	.			trans	-90.8	145.9	178.6	-73.7	-14.7	0	0	0	111.7	R86 K89 D95 L96 Q99 A128	R86-W91 WeakPolarHBondContact CD-O 3.22Å; R86-W91 HydrophobicContact CG-CB 3.85Å; R86-W91 WeakPolarHBondContact CG-O 3.45Å; R86-W91 PolarHBondContact NH1-O 3.38Å; R86-W91 PolarHBondContact O-N 2.86Å; K89-W91 HydrophobicContact CB-CD2 3.87Å; K89-W91 HydrophobicContact CB-CE3 4.16Å; K89-W91 HydrophobicContact CB-CG 4.12Å; K89-W91 HydrophobicContact CD-CD2 4.38Å; K89-W91 HydrophobicContact CD-CE3 4.07Å; K89-W91 HydrophobicContact CD-CH2 3.69Å; K89-W91 HydrophobicContact CD-CZ2 4Å; K89-W91 HydrophobicContact CD-CZ3 3.73Å; K89-W91 PolarHBondContact O-N 3.1Å; W91-D95 HydrophobicContact CB-CB 4.05Å; W91-D95 HydrophobicContact CG-CB 4.21Å; W91-L96 HydrophobicContact CE3-CD1 4.14Å; W91-L96 HydrophobicContact CZ3-CD1 4.21Å; W91-Q99 HydrophobicContact CH2-CG 3.99Å; W91-Q99 HydrophobicContact CZ3-CG 4.28Å; W91-A128 VanDerWaalsContact CH2-O 3.27Å; W91-A128 WeakPolarHBondContact CH2-O 3.48Å; W91-A128 HydrophobicContact CZ3-CB 4.17Å; W91-A128 WeakPolarHBondContact CZ3-O 3.39Å
92	T	95.6	Very high	94.6	Very high	73 Å²	73	70.6 Å²	70.6	45%	0.448	34%	0.335	S	S	.	.			trans	-79.2	166.8	164.3	68.9	0	0	0	0	110.5	A94 D95 L96	T92-A94 PolarHBondContact O-N 3.4Å; T92-A94 PolarHBondContact OG1-N 2.83Å; T92-D95 WeakPolarHBondContact CB-OD2 3.43Å; T92-D95 WeakPolarHBondContact CG2-OD2 3.47Å; T92-D95 PolarHBondContact N-OD2 3.46Å; T92-D95 PolarHBondContact O-N 3.35Å; T92-D95 PolarHBondContact OG1-N 3.25Å; T92-D95 VanDerWaalsContact OG1-N 3.08Å; T92-D95 PolarHBondContact OG1-OD2 3.43Å; T92-L96 PolarHBondContact O-N 2.87Å
93	Q	94.7	Very high	94.6	Very high	44 Å²	44	78.1 Å²	78.1	21%	0.206	37%	0.368	C	S	.	.	H	α-helix	trans	-58.8	-34.4	172.1	-72.8	-179.4	-21.6	0	0	111.2	A97 Q104 V107 E111	Q93-A97 VanDerWaalsContact O-CB 3.23Å; Q93-A97 WeakPolarHBondContact O-CB 3.28Å; Q93-A97 PolarHBondContact O-N 2.89Å; Q93-Q104 HydrophobicContact CB-CG 4.05Å; Q93-V107 HydrophobicContact CB-CG1 4.33Å; Q93-V107 HydrophobicContact CG-CG1 4.35Å; Q93-E111 PolarHBondContact NE2-OE2 3.37Å
94	A	96	Very high	94.6	Very high	21 Å²	21	79 Å²	79	17%	0.174	37%	0.372	C	S	.	.	H	α-helix	trans	-66.5	-40.6	175.8	0	0	0	0	0	112	T92 A97 R98	T92-A94 PolarHBondContact O-N 3.4Å; T92-A94 PolarHBondContact OG1-N 2.83Å; A94-A97 PolarHBondContact O-N 3.34Å; A94-R98 VanDerWaalsContact O-CG 3.31Å; A94-R98 WeakPolarHBondContact O-CG 3.04Å; A94-R98 PolarHBondContact O-N 3.3Å
95	D	95.5	Very high	94.7	Very high	53 Å²	53	75.2 Å²	75.2	28%	0.283	36%	0.363	S	S	.	.	H	α-helix	trans	-66.9	-42.8	177.4	-57.4	-43	0	0	0	111.6	W91 T92 A97 R98 Q99	W91-D95 HydrophobicContact CB-CB 4.05Å; W91-D95 HydrophobicContact CG-CB 4.21Å; T92-D95 WeakPolarHBondContact CB-OD2 3.43Å; T92-D95 WeakPolarHBondContact CG2-OD2 3.47Å; T92-D95 PolarHBondContact N-OD2 3.46Å; T92-D95 PolarHBondContact O-N 3.35Å; T92-D95 PolarHBondContact OG1-N 3.25Å; T92-D95 VanDerWaalsContact OG1-N 3.08Å; T92-D95 PolarHBondContact OG1-OD2 3.43Å; D95-A97 VanDerWaalsContact C-N 3.33Å; D95-A97 PolarHBondContact O-N 2.94Å; D95-R98 PolarHBondContact O-N 3.32Å; D95-R98 IonicContact OD1-NH1 2.9Å; D95-R98 PolarHBondContact OD1-NH1 3.21Å; D95-Q99 WeakPolarHBondContact O-CB 3.4Å; D95-Q99 PolarHBondContact O-N 3.43Å
96	L	95.8	Very high	94.7	Very high	0 Å²	0	76.6 Å²	76.6	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-60.9	-44.3	174.3	179.6	58.4	0	0	0	111.1	I82 R86 W91 T92 Q99 I100 V107 L125 A128 I129	I82-L96 HydrophobicContact CG2-CD2 3.97Å; R86-L96 HydrophobicContact CB-CD2 4.4Å; R86-L96 HydrophobicContact CG-CD2 4.47Å; W91-L96 HydrophobicContact CE3-CD1 4.14Å; W91-L96 HydrophobicContact CZ3-CD1 4.21Å; T92-L96 PolarHBondContact O-N 2.87Å; L96-Q99 WeakPolarHBondContact O-CB 3.3Å; L96-Q99 PolarHBondContact O-N 3.47Å; L96-I100 HydrophobicContact CD1-CG2 4.26Å; L96-I100 WeakPolarHBondContact O-CG1 3.22Å; L96-I100 PolarHBondContact O-N 3.37Å; L96-V107 HydrophobicContact CD2-CG1 3.79Å; L96-V107 HydrophobicContact CG-CG1 4.32Å; L96-V107 HydrophobicContact CG-CG2 4.45Å; L96-L125 HydrophobicContact CD1-CD2 4.15Å; L96-L125 HydrophobicContact CD2-CD2 3.93Å; L96-L125 HydrophobicContact CG-CD2 4.14Å; L96-A128 HydrophobicContact CD1-CB 3.9Å; L96-I129 HydrophobicContact CD1-CG2 4.07Å
97	A	96.2	Very high	94.7	Very high	4 Å²	4	74.7 Å²	74.7	3%	0.033	36%	0.364	C	S	.	.	H	α-helix	trans	-60	-45.3	178.2	0	0	0	0	0	112.1	Q93 A94 D95 Q99 I100 N101 E102 Q104 V107	Q93-A97 VanDerWaalsContact O-CB 3.23Å; Q93-A97 WeakPolarHBondContact O-CB 3.28Å; Q93-A97 PolarHBondContact O-N 2.89Å; A94-A97 PolarHBondContact O-N 3.34Å; D95-A97 VanDerWaalsContact C-N 3.33Å; D95-A97 PolarHBondContact O-N 2.94Å; A97-Q99 PolarHBondContact O-N 3.31Å; A97-I100 PolarHBondContact O-N 3.27Å; A97-N101 PolarHBondContact O-N 3.28Å; A97-E102 CarbonylContact C-O 3.49Å; A97-E102 WeakPolarHBondContact CB-O 3.46Å; A97-E102 PolarHBondContact O-N 3.41Å; A97-Q104 HydrophobicContact CB-CB 4.36Å; A97-V107 HydrophobicContact CB-CG2 3.81Å
98	R	95.9	Very high	94.8	Very high	172 Å²	172	73 Å²	73	65%	0.649	36%	0.359	S	S	*	.	H	α-helix	trans	-60	-44.8	173.2	-70.1	173.6	-164.7	142.8	-3.2	111.5	A94 D95 I100 N101	A94-R98 VanDerWaalsContact O-CG 3.31Å; A94-R98 WeakPolarHBondContact O-CG 3.04Å; A94-R98 PolarHBondContact O-N 3.3Å; D95-R98 PolarHBondContact O-N 3.32Å; D95-R98 IonicContact OD1-NH1 2.9Å; D95-R98 PolarHBondContact OD1-NH1 3.21Å; R98-I100 VanDerWaalsContact C-N 3.3Å; R98-I100 PolarHBondContact O-N 3.42Å; R98-N101 PolarHBondContact O-N 3.36Å; R98-N101 VanDerWaalsContact O-N 3.15Å
99	Q	94.1	Very high	94.9	Very high	119 Å²	119	71.7 Å²	71.7	56%	0.556	35%	0.345	S	S	*	.	H	α-helix	trans	-62.7	-35.1	-178.4	-169.8	64.3	13.4	0	0	113	W91 D95 L96 A97 A128	W91-Q99 HydrophobicContact CH2-CG 3.99Å; W91-Q99 HydrophobicContact CZ3-CG 4.28Å; D95-Q99 WeakPolarHBondContact O-CB 3.4Å; D95-Q99 PolarHBondContact O-N 3.43Å; L96-Q99 WeakPolarHBondContact O-CB 3.3Å; L96-Q99 PolarHBondContact O-N 3.47Å; A97-Q99 PolarHBondContact O-N 3.31Å; Q99-A128 HydrophobicContact CG-CB 4.14Å
100	I	94.1	Very high	95	Very high	4 Å²	4	68.1 Å²	68.1	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-94.1	-1.2	178.2	69.4	176.5	0	0	0	113.5	L96 A97 R98 E102 V107 K124 L125 A128	L96-I100 HydrophobicContact CD1-CG2 4.26Å; L96-I100 WeakPolarHBondContact O-CG1 3.22Å; L96-I100 PolarHBondContact O-N 3.37Å; A97-I100 PolarHBondContact O-N 3.27Å; R98-I100 VanDerWaalsContact C-N 3.3Å; R98-I100 PolarHBondContact O-N 3.42Å; I100-E102 VanDerWaalsContact C-N 3.34Å; I100-E102 HydrophobicContact CD1-CB 3.86Å; I100-E102 HydrophobicContact CD1-CG 3.78Å; I100-E102 HydrophobicContact CG1-CB 3.79Å; I100-E102 HydrophobicContact CG1-CG 3.76Å; I100-E102 PolarHBondContact O-N 3.26Å; I100-V107 HydrophobicContact CD1-CG2 3.91Å; I100-K124 HydrophobicContact CB-CB 3.94Å; I100-K124 HydrophobicContact CB-CD 4.28Å; I100-K124 HydrophobicContact CG2-CB 3.97Å; I100-K124 WeakPolarHBondContact O-CD 3.4Å; I100-K124 PolarHBondContact O-NZ 2.97Å; I100-L125 HydrophobicContact CD1-CD2 3.7Å; I100-L125 HydrophobicContact CD1-CG 4.08Å; I100-L125 HydrophobicContact CG2-CD2 4.37Å; I100-A128 HydrophobicContact CG2-CB 3.7Å
101	N	94.4	Very high	95	Very high	130 Å²	130	60 Å²	60	70%	0.695	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	49.1	-173.3	-56.9	-77	0	0	0	112.4	A97 R98	A97-N101 PolarHBondContact O-N 3.28Å; R98-N101 PolarHBondContact O-N 3.36Å; R98-N101 VanDerWaalsContact O-N 3.15Å
102	E	93.8	Very high	94.9	Very high	31 Å²	31	59 Å²	59	15%	0.145	30%	0.297	C	S	.	.	S	Bend	trans	-126.9	168.6	172.3	-61.6	-64.7	161.9	0	0	109.6	H53 A97 I100 V106 V121 K124	H53-E102 IonicContact CE1-OE1 3.15Å; H53-E102 IonicContact CE1-OE2 3.3Å; H53-E102 PolarHBondContact CE1-OE2 3.42Å; A97-E102 CarbonylContact C-O 3.49Å; A97-E102 WeakPolarHBondContact CB-O 3.46Å; A97-E102 PolarHBondContact O-N 3.41Å; I100-E102 VanDerWaalsContact C-N 3.34Å; I100-E102 HydrophobicContact CD1-CB 3.86Å; I100-E102 HydrophobicContact CD1-CG 3.78Å; I100-E102 HydrophobicContact CG1-CB 3.79Å; I100-E102 HydrophobicContact CG1-CG 3.76Å; I100-E102 PolarHBondContact O-N 3.26Å; E102-V106 HydrophobicContact CB-CB 4.43Å; E102-V106 HydrophobicContact CB-CG1 4.42Å; E102-V121 HydrophobicContact CG-CG1 4.45Å; E102-K124 IonicContact OE1-NZ 3.93Å; E102-K124 PolarHBondContact OE1-NZ 2.81Å
103	K	94.1	Very high	94.7	Very high	157 Å²	157	55.8 Å²	55.8	68%	0.683	28%	0.278	S	S	*	.			trans	-73.9	151.3	175.9	-65	-177.1	177.5	-179.5	0	111.3	S105 V106 V107	K103-S105 PolarHBondContact O-N 3.43Å; K103-V106 HydrophobicContact CB-CG2 4.17Å; K103-V106 WeakPolarHBondContact O-CB 3.48Å; K103-V106 PolarHBondContact O-N 2.68Å; K103-V106 VanDerWaalsContact O-N 3.07Å; K103-V107 PolarHBondContact O-N 3.15Å
104	Q	94.8	Very high	94.5	Very high	101 Å²	101	62 Å²	62	47%	0.472	30%	0.3	S	S	.	.	H	α-helix	trans	-59.1	-34.6	174.5	-174.2	179	0.1	0	0	112.4	Q93 A97 V106 V107 N108	Q93-Q104 HydrophobicContact CB-CG 4.05Å; A97-Q104 HydrophobicContact CB-CB 4.36Å; Q104-V106 VanDerWaalsContact C-N 3.28Å; Q104-V106 PolarHBondContact O-N 2.65Å; Q104-V107 PolarHBondContact O-N 2.88Å; Q104-N108 PolarHBondContact O-N 3.01Å
105	S	95.2	Very high	94.3	Very high	62 Å²	62	61.1 Å²	61.1	43%	0.434	29%	0.293	S	S	.	.	H	α-helix	trans	-58.4	-41	175.2	61.9	0	0	0	0	112.1	K103 N108 E109	K103-S105 PolarHBondContact O-N 3.43Å; S105-N108 WeakPolarHBondContact O-CB 3.28Å; S105-N108 PolarHBondContact O-N 3.39Å; S105-E109 WeakPolarHBondContact O-CG 3.3Å; S105-E109 PolarHBondContact O-N 2.97Å
106	V	94	Very high	94	Very high	31 Å²	31	61.8 Å²	61.8	19%	0.188	30%	0.298	C	S	.	.	H	α-helix	trans	-62.5	-48	178.1	177.2	0	0	0	0	109.8	E102 K103 Q104 N108 E109 Y110	E102-V106 HydrophobicContact CB-CB 4.43Å; E102-V106 HydrophobicContact CB-CG1 4.42Å; K103-V106 HydrophobicContact CB-CG2 4.17Å; K103-V106 WeakPolarHBondContact O-CB 3.48Å; K103-V106 PolarHBondContact O-N 2.68Å; K103-V106 VanDerWaalsContact O-N 3.07Å; Q104-V106 VanDerWaalsContact C-N 3.28Å; Q104-V106 PolarHBondContact O-N 2.65Å; V106-N108 VanDerWaalsContact C-N 3.29Å; V106-N108 PolarHBondContact O-N 2.84Å; V106-E109 WeakPolarHBondContact O-CB 3.41Å; V106-E109 PolarHBondContact O-N 3.02Å; V106-E109 VanDerWaalsContact O-N 3.16Å; V106-Y110 HydrophobicContact CG1-CD2 3.71Å; V106-Y110 HydrophobicContact CG1-CE2 3.52Å; V106-Y110 WeakPolarHBondContact O-CD2 3.42Å; V106-Y110 PolarHBondContact O-N 3Å
107	V	95	Very high	93.7	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.006	31%	0.31	C	S	.	.	H	α-helix	trans	-58.2	-42.5	176.4	175.8	0	0	0	0	111.5	Q93 L96 A97 I100 K103 Q104 E109 Y110 E111	Q93-V107 HydrophobicContact CB-CG1 4.33Å; Q93-V107 HydrophobicContact CG-CG1 4.35Å; L96-V107 HydrophobicContact CD2-CG1 3.79Å; L96-V107 HydrophobicContact CG-CG1 4.32Å; L96-V107 HydrophobicContact CG-CG2 4.45Å; A97-V107 HydrophobicContact CB-CG2 3.81Å; I100-V107 HydrophobicContact CD1-CG2 3.91Å; K103-V107 PolarHBondContact O-N 3.15Å; Q104-V107 PolarHBondContact O-N 2.88Å; V107-E109 PolarHBondContact O-N 2.86Å; V107-Y110 PolarHBondContact O-N 3.47Å; V107-E111 HydrophobicContact CG1-CG 4.41Å; V107-E111 PolarHBondContact O-N 3.15Å
108	N	95.7	Very high	93.5	Very high	73 Å²	73	64.9 Å²	64.9	39%	0.39	32%	0.316	S	S	.	.	H	α-helix	trans	-62.2	-42.2	176.8	-174.5	30.1	0	0	0	112.2	Q104 S105 V106 Y110 E111 S112	Q104-N108 PolarHBondContact O-N 3.01Å; S105-N108 WeakPolarHBondContact O-CB 3.28Å; S105-N108 PolarHBondContact O-N 3.39Å; V106-N108 VanDerWaalsContact C-N 3.29Å; V106-N108 PolarHBondContact O-N 2.84Å; N108-Y110 VanDerWaalsContact C-N 3.32Å; N108-Y110 PolarHBondContact O-N 3.38Å; N108-E111 PolarHBondContact O-N 3Å; N108-S112 VanDerWaalsContact O-CB 3.31Å; N108-S112 WeakPolarHBondContact O-CB 3.46Å; N108-S112 PolarHBondContact O-N 2.83Å; N108-S112 PolarHBondContact O-OG 2.61Å
109	E	94.9	Very high	93.2	Very high	84 Å²	84	61.4 Å²	61.4	39%	0.393	31%	0.307	S	S	.	.	H	α-helix	trans	-61.3	-40.7	175.3	-70.6	167	-148.3	0	0	112	S105 V106 V107 S112 G113 R114 A115	S105-E109 WeakPolarHBondContact O-CG 3.3Å; S105-E109 PolarHBondContact O-N 2.97Å; V106-E109 WeakPolarHBondContact O-CB 3.41Å; V106-E109 PolarHBondContact O-N 3.02Å; V106-E109 VanDerWaalsContact O-N 3.16Å; V107-E109 PolarHBondContact O-N 2.86Å; E109-S112 WeakPolarHBondContact CA-OG 3.29Å; E109-S112 PolarHBondContact O-N 3.02Å; E109-S112 PolarHBondContact O-OG 2.73Å; E109-G113 PolarHBondContact O-N 3.1Å; E109-R114 PolarHBondContact O-N 3.16Å; E109-R114 VanDerWaalsContact O-N 3.09Å; E109-A115 HydrophobicContact CB-CB 3.9Å; E109-A115 PolarHBondContact O-N 3.17Å
110	Y	95.5	Very high	93	Very high	11 Å²	11	59.5 Å²	59.5	4%	0.043	30%	0.298	C	S	.	.	H	α-helix	trans	-67.7	-45.2	175.6	-82.5	-77.3	0	0	0	112.5	V74 G79 V106 V107 N108 S112 G113 A115 V116 N118 V121 L122 L125	V74-Y110 HydrophobicContact CB-CD1 4.42Å; V74-Y110 HydrophobicContact CG1-CD1 3.66Å; V74-Y110 HydrophobicContact CG1-CE1 3.51Å; V74-Y110 HydrophobicContact CG2-CD1 4.06Å; G79-Y110 WeakPolarHBondContact CA-O 3.3Å; V106-Y110 HydrophobicContact CG1-CD2 3.71Å; V106-Y110 HydrophobicContact CG1-CE2 3.52Å; V106-Y110 WeakPolarHBondContact O-CD2 3.42Å; V106-Y110 PolarHBondContact O-N 3Å; V107-Y110 PolarHBondContact O-N 3.47Å; N108-Y110 VanDerWaalsContact C-N 3.32Å; N108-Y110 PolarHBondContact O-N 3.38Å; Y110-S112 VanDerWaalsContact C-N 3.28Å; Y110-S112 PolarHBondContact O-N 3.26Å; Y110-G113 PolarHBondContact O-N 3.46Å; Y110-G113 VanDerWaalsContact O-N 3.13Å; Y110-A115 HydrophobicContact CD1-CB 3.65Å; Y110-A115 HydrophobicContact CD2-CB 3.8Å; Y110-A115 HydrophobicContact CE1-CB 3.7Å; Y110-A115 HydrophobicContact CE2-CB 3.84Å; Y110-A115 HydrophobicContact CG-CB 3.66Å; Y110-V116 PolarHBondContact OH-O 3.05Å; Y110-N118 WeakPolarHBondContact OH-CB 3.42Å; Y110-V121 HydrophobicContact CD2-CG1 4.13Å; Y110-V121 HydrophobicContact CE2-CB 4.2Å; Y110-V121 HydrophobicContact CE2-CG1 3.52Å; Y110-L122 HydrophobicContact CD1-CD2 4.36Å; Y110-L122 HydrophobicContact CE1-CD2 4.21Å; Y110-L125 HydrophobicContact CD1-CD1 4.3Å; Y110-L125 HydrophobicContact CD2-CD1 4.45Å; Y110-L125 HydrophobicContact CG-CD1 4.15Å
111	E	94	Very high	93	Very high	23 Å²	23	59.6 Å²	59.6	11%	0.107	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-33.9	175.6	-74.2	-168.8	169.1	0	0	111.7	G79 I82 R86 Q93 V107 N108 G113	G79-E111 WeakPolarHBondContact CA-O 3.47Å; I82-E111 HydrophobicContact CB-CG 4.36Å; I82-E111 HydrophobicContact CG2-CG 3.83Å; R86-E111 WeakPolarHBondContact CD-OE1 3.38Å; R86-E111 IonicContact CZ-OE1 3.84Å; R86-E111 IonicContact NE-OE1 2.85Å; R86-E111 PolarHBondContact NE-OE1 2.91Å; R86-E111 IonicContact NE-OE2 2.79Å; R86-E111 IonicContact NH2-OE1 3.93Å; R86-E111 IonicContact NH2-OE2 2.68Å; Q93-E111 PolarHBondContact NE2-OE2 3.37Å; V107-E111 HydrophobicContact CG1-CG 4.41Å; V107-E111 PolarHBondContact O-N 3.15Å; N108-E111 PolarHBondContact O-N 3Å; E111-G113 VanDerWaalsContact C-N 3.27Å; E111-G113 PolarHBondContact O-N 3.22Å
112	S	94.1	Very high	92.9	Very high	45 Å²	45	53.8 Å²	53.8	32%	0.315	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-7.7	175.3	73.4	0	0	0	0	114.5	N108 E109 Y110 R114	N108-S112 VanDerWaalsContact O-CB 3.31Å; N108-S112 WeakPolarHBondContact O-CB 3.46Å; N108-S112 PolarHBondContact O-N 2.83Å; N108-S112 PolarHBondContact O-OG 2.61Å; E109-S112 WeakPolarHBondContact CA-OG 3.29Å; E109-S112 PolarHBondContact O-N 3.02Å; E109-S112 PolarHBondContact O-OG 2.73Å; Y110-S112 VanDerWaalsContact C-N 3.28Å; Y110-S112 PolarHBondContact O-N 3.26Å; S112-R114 VanDerWaalsContact C-N 3.26Å; S112-R114 PolarHBondContact O-N 3.08Å; S112-R114 PolarHBondContact OG-NE 2.98Å; S112-R114 VanDerWaalsContact OG-NE 3.13Å
113	G	91.5	Very high	92.8	Very high	5 Å²	5	53.8 Å²	53.8	5%	0.052	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	0.8	-179.6	0	0	0	0	0	115.5	T73 G75 E109 Y110 E111	T73-G113 WeakPolarHBondContact CB-O 3.16Å; G75-G113 PolarHBondContact N-O 3.21Å; G75-G113 WeakPolarHBondContact O-CA 3.3Å; E109-G113 PolarHBondContact O-N 3.1Å; Y110-G113 PolarHBondContact O-N 3.46Å; Y110-G113 VanDerWaalsContact O-N 3.13Å; E111-G113 VanDerWaalsContact C-N 3.27Å; E111-G113 PolarHBondContact O-N 3.22Å
114	R	91	Very high	92.8	Very high	174 Å²	174	48.2 Å²	48.2	66%	0.657	25%	0.247	S	C	*	.			trans	-89.9	-15.5	-174.3	-61.9	-177	-63.7	170	4	113.9	E109 S112	E109-R114 PolarHBondContact O-N 3.16Å; E109-R114 VanDerWaalsContact O-N 3.09Å; S112-R114 VanDerWaalsContact C-N 3.26Å; S112-R114 PolarHBondContact O-N 3.08Å; S112-R114 PolarHBondContact OG-NE 2.98Å; S112-R114 VanDerWaalsContact OG-NE 3.13Å
115	A	90.7	Very high	92.7	Very high	3 Å²	3	43.4 Å²	43.4	3%	0.025	23%	0.225	C	C	.	.	S	Bend	trans	-64.2	142.3	-178.9	0	0	0	0	0	112.2	T73 V74 E109 Y110	T73-A115 WeakPolarHBondContact CA-O 3.42Å; V74-A115 HydrophobicContact CG2-CB 4.44Å; V74-A115 PolarHBondContact N-O 2.87Å; E109-A115 HydrophobicContact CB-CB 3.9Å; E109-A115 PolarHBondContact O-N 3.17Å; Y110-A115 HydrophobicContact CD1-CB 3.65Å; Y110-A115 HydrophobicContact CD2-CB 3.8Å; Y110-A115 HydrophobicContact CE1-CB 3.7Å; Y110-A115 HydrophobicContact CE2-CB 3.84Å; Y110-A115 HydrophobicContact CG-CB 3.66Å
116	V	89.4	Confident	92.6	Very high	67 Å²	67	41.1 Å²	41.1	41%	0.406	21%	0.207	S	C	.	.	B	Isolated β-bridge	trans	-65.6	138.4	170.2	-179.2	0	0	0	0	109.7	I71 Y110 N118	I71-V116 HydrophobicContact CG2-CB 4.17Å; I71-V116 HydrophobicContact CG2-CG1 3.57Å; I71-V116 HydrophobicContact CG2-CG2 3.63Å; Y110-V116 PolarHBondContact OH-O 3.05Å; V116-N118 PolarHBondContact O-N 3.22Å
117	V	89.3	Confident	92.5	Very high	41 Å²	41	47.6 Å²	47.6	25%	0.248	23%	0.228	C	C	.	.			trans	-62.2	110.2	179.4	179.5	0	0	0	0	110.4	D72 V74 L122	D72-V117 HydrophobicContact CB-CG2 4.38Å; D72-V117 PolarHBondContact O-N 3.28Å; V74-V117 HydrophobicContact CG1-CG2 4Å; V117-L122 HydrophobicContact CG1-CD1 3.92Å
118	N	91.1	Very high	92.4	Very high	28 Å²	28	48 Å²	48	15%	0.15	23%	0.231	C	C	.	.			trans	-117	113.5	169.9	-172.8	-28.9	0	0	0	110	T56 Y110 V116 Q120 V121 L122	T56-N118 HydrophobicContact CG2-CB 3.55Å; T56-N118 WeakPolarHBondContact CG2-ND2 3.1Å; Y110-N118 WeakPolarHBondContact OH-CB 3.42Å; V116-N118 PolarHBondContact O-N 3.22Å; N118-Q120 PolarHBondContact O-N 3.21Å; N118-Q120 WeakPolarHBondContact OD1-CB 3.26Å; N118-Q120 PolarHBondContact OD1-N 2.67Å; N118-V121 HydrophobicContact CB-CB 4.22Å; N118-V121 HydrophobicContact CB-CG2 4.03Å; N118-V121 PolarHBondContact O-N 3.46Å; N118-L122 WeakPolarHBondContact O-CG 2.78Å; N118-L122 PolarHBondContact O-N 2.69Å
119	Q	90.5	Very high	92.3	Very high	100 Å²	100	44.9 Å²	44.9	47%	0.467	22%	0.215	S	C	.	.	H	α-helix	trans	-62.8	-30	-176.9	-62.9	-58.3	-25.3	0	0	113.3	S123	Q119-S123 VanDerWaalsContact O-CB 3.3Å; Q119-S123 WeakPolarHBondContact O-CB 3.33Å; Q119-S123 PolarHBondContact O-N 3.46Å; Q119-S123 PolarHBondContact O-OG 3.43Å
120	Q	90.9	Very high	92.1	Very high	79 Å²	79	41.8 Å²	41.8	37%	0.369	21%	0.206	S	C	.	.	H	α-helix	trans	-68.2	-49.6	176.8	-63.9	179.9	-23.8	0	0	110.4	N118 S123 K124	N118-Q120 PolarHBondContact O-N 3.21Å; N118-Q120 WeakPolarHBondContact OD1-CB 3.26Å; N118-Q120 PolarHBondContact OD1-N 2.67Å; Q120-S123 PolarHBondContact O-N 3.49Å; Q120-K124 WeakPolarHBondContact O-CG 3.49Å; Q120-K124 PolarHBondContact O-N 3.45Å
121	V	92.6	Very high	91.9	Very high	6 Å²	6	42.6 Å²	42.6	4%	0.036	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-45	179.6	-177.6	0	0	0	0	110.8	E102 Y110 N118 S123 K124 L125	E102-V121 HydrophobicContact CG-CG1 4.45Å; Y110-V121 HydrophobicContact CD2-CG1 4.13Å; Y110-V121 HydrophobicContact CE2-CB 4.2Å; Y110-V121 HydrophobicContact CE2-CG1 3.52Å; N118-V121 HydrophobicContact CB-CB 4.22Å; N118-V121 HydrophobicContact CB-CG2 4.03Å; N118-V121 PolarHBondContact O-N 3.46Å; V121-S123 VanDerWaalsContact C-N 3.31Å; V121-S123 PolarHBondContact O-N 3.02Å; V121-K124 WeakPolarHBondContact O-CB 2.84Å; V121-K124 PolarHBondContact O-N 3.34Å; V121-L125 HydrophobicContact CG1-CD1 4.01Å; V121-L125 HydrophobicContact CG1-CG 4.39Å; V121-L125 WeakPolarHBondContact O-CG 3.44Å; V121-L125 PolarHBondContact O-N 3.19Å
122	L	92.8	Very high	91.8	Very high	7 Å²	7	44.5 Å²	44.5	4%	0.037	22%	0.218	C	C	.	.	H	α-helix	trans	-57.9	-43.3	174.5	-71.9	175.5	0	0	0	111.9	V74 V78 Y110 V117 N118 K124 L125 E126 L133 R134	V74-L122 HydrophobicContact CG1-CD2 4.21Å; V78-L122 HydrophobicContact CG1-CD2 4.39Å; Y110-L122 HydrophobicContact CD1-CD2 4.36Å; Y110-L122 HydrophobicContact CE1-CD2 4.21Å; V117-L122 HydrophobicContact CG1-CD1 3.92Å; N118-L122 WeakPolarHBondContact O-CG 2.78Å; N118-L122 PolarHBondContact O-N 2.69Å; L122-K124 VanDerWaalsContact C-N 3.28Å; L122-K124 PolarHBondContact O-N 2.99Å; L122-L125 PolarHBondContact O-N 3.3Å; L122-E126 WeakPolarHBondContact O-CB 3.39Å; L122-E126 VanDerWaalsContact O-CG 3.3Å; L122-E126 WeakPolarHBondContact O-CG 3.29Å; L122-E126 PolarHBondContact O-N 3.5Å; L122-L133 HydrophobicContact CD2-CB 4.35Å; L122-L133 HydrophobicContact CD2-CD1 4.13Å; L122-R134 HydrophobicContact CD1-CG 4.12Å
123	S	92.2	Very high	91.6	Very high	32 Å²	32	42.5 Å²	42.5	22%	0.224	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-30.2	177.2	-57.6	0	0	0	0	113	Q119 Q120 V121 R127 R134	Q119-S123 VanDerWaalsContact O-CB 3.3Å; Q119-S123 WeakPolarHBondContact O-CB 3.33Å; Q119-S123 PolarHBondContact O-N 3.46Å; Q119-S123 PolarHBondContact O-OG 3.43Å; Q120-S123 PolarHBondContact O-N 3.49Å; V121-S123 VanDerWaalsContact C-N 3.31Å; V121-S123 PolarHBondContact O-N 3.02Å; S123-R127 WeakPolarHBondContact O-CG 2.99Å; S123-R127 PolarHBondContact O-NE 3.44Å; S123-R134 VanDerWaalsContact OG-CZ 3.3Å; S123-R134 PolarHBondContact OG-NH1 3.25Å; S123-R134 PolarHBondContact OG-NH2 3.21Å
124	K	93.2	Very high	91.4	Very high	39 Å²	39	46.3 Å²	46.3	17%	0.17	22%	0.217	C	C	.	.	H	α-helix	trans	-73.3	-45.1	173.2	-65.1	179.2	-172.9	176.6	0	110.8	I100 E102 Q120 V121 L122 R127 A128	I100-K124 HydrophobicContact CB-CB 3.94Å; I100-K124 HydrophobicContact CB-CD 4.28Å; I100-K124 HydrophobicContact CG2-CB 3.97Å; I100-K124 WeakPolarHBondContact O-CD 3.4Å; I100-K124 PolarHBondContact O-NZ 2.97Å; E102-K124 IonicContact OE1-NZ 3.93Å; E102-K124 PolarHBondContact OE1-NZ 2.81Å; Q120-K124 WeakPolarHBondContact O-CG 3.49Å; Q120-K124 PolarHBondContact O-N 3.45Å; V121-K124 WeakPolarHBondContact O-CB 2.84Å; V121-K124 PolarHBondContact O-N 3.34Å; L122-K124 VanDerWaalsContact C-N 3.28Å; L122-K124 PolarHBondContact O-N 2.99Å; K124-R127 PolarHBondContact O-N 3.09Å; K124-A128 WeakPolarHBondContact O-CB 3.34Å; K124-A128 PolarHBondContact O-N 2.95Å
125	L	93.7	Very high	91.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.9	-48.5	177.6	-75	167.6	0	0	0	111.8	I82 L96 I100 Y110 V121 L122 R127 A128 I129 L133	I82-L125 HydrophobicContact CD1-CD1 4Å; I82-L125 HydrophobicContact CG2-CD2 4.41Å; L96-L125 HydrophobicContact CD1-CD2 4.15Å; L96-L125 HydrophobicContact CD2-CD2 3.93Å; L96-L125 HydrophobicContact CG-CD2 4.14Å; I100-L125 HydrophobicContact CD1-CD2 3.7Å; I100-L125 HydrophobicContact CD1-CG 4.08Å; I100-L125 HydrophobicContact CG2-CD2 4.37Å; Y110-L125 HydrophobicContact CD1-CD1 4.3Å; Y110-L125 HydrophobicContact CD2-CD1 4.45Å; Y110-L125 HydrophobicContact CG-CD1 4.15Å; V121-L125 HydrophobicContact CG1-CD1 4.01Å; V121-L125 HydrophobicContact CG1-CG 4.39Å; V121-L125 WeakPolarHBondContact O-CG 3.44Å; V121-L125 PolarHBondContact O-N 3.19Å; L122-L125 PolarHBondContact O-N 3.3Å; L125-R127 VanDerWaalsContact C-N 3.32Å; L125-R127 PolarHBondContact O-N 3.44Å; L125-A128 PolarHBondContact O-N 3.01Å; L125-A128 VanDerWaalsContact O-N 3.1Å; L125-I129 VanDerWaalsContact O-CG1 3.3Å; L125-I129 WeakPolarHBondContact O-CG1 3.34Å; L125-I129 PolarHBondContact O-N 3.36Å; L125-L133 HydrophobicContact CB-CD1 3.67Å; L125-L133 HydrophobicContact CD1-CD1 4.43Å
126	E	93.1	Very high	90.7	Very high	14 Å²	14	50.5 Å²	50.5	7%	0.065	26%	0.256	C	S	.	.	H	α-helix	trans	-54.9	-46.5	177.5	-75.1	178.4	163.2	0	0	112	L122 G130 L131 L133 R134 L142	L122-E126 WeakPolarHBondContact O-CB 3.39Å; L122-E126 VanDerWaalsContact O-CG 3.3Å; L122-E126 WeakPolarHBondContact O-CG 3.29Å; L122-E126 PolarHBondContact O-N 3.5Å; E126-G130 VanDerWaalsContact O-CA 3.28Å; E126-G130 WeakPolarHBondContact O-CA 3.49Å; E126-G130 PolarHBondContact O-N 3.33Å; E126-L131 VanDerWaalsContact CA-O 3.29Å; E126-L131 WeakPolarHBondContact CA-O 3.38Å; E126-L131 WeakPolarHBondContact CB-O 3.39Å; E126-L131 WeakPolarHBondContact CG-O 3.18Å; E126-L131 PolarHBondContact O-N 2.96Å; E126-L133 HydrophobicContact CG-CB 3.75Å; E126-L133 HydrophobicContact CG-CD1 4.02Å; E126-L133 HydrophobicContact CG-CG 3.7Å; E126-L133 PolarHBondContact OE1-N 3.33Å; E126-R134 WeakPolarHBondContact OE1-CB 3.13Å; E126-R134 WeakPolarHBondContact OE1-CG 3.38Å; E126-R134 IonicContact OE1-CZ 3.21Å; E126-R134 PolarHBondContact OE1-N 3.09Å; E126-R134 IonicContact OE1-NE 2.87Å; E126-R134 PolarHBondContact OE1-NE 3.47Å; E126-R134 IonicContact OE2-CZ 3.01Å; E126-R134 VanDerWaalsContact OE2-CZ 3.3Å; E126-R134 IonicContact OE2-NE 3.55Å; E126-R134 PolarHBondContact OE2-NE 3.28Å; E126-R134 VanDerWaalsContact OE2-NE 3.15Å; E126-R134 IonicContact OE2-NH2 3.92Å; E126-R134 PolarHBondContact OE2-NH2 2.83Å; E126-L142 HydrophobicContact CB-CD2 4.29Å
127	R	92	Very high	90.5	Very high	167 Å²	167	52.3 Å²	52.3	63%	0.63	26%	0.264	S	S	*	.	H	α-helix	trans	-66.8	-40	176.9	-73.3	-178	-71	150.3	-4.3	112.2	S123 K124 L125 L142	S123-R127 WeakPolarHBondContact O-CG 2.99Å; S123-R127 PolarHBondContact O-NE 3.44Å; K124-R127 PolarHBondContact O-N 3.09Å; L125-R127 VanDerWaalsContact C-N 3.32Å; L125-R127 PolarHBondContact O-N 3.44Å; R127-L142 HydrophobicContact CG-CD2 4.13Å
128	A	93	Very high	90.2	Very high	9 Å²	9	54.2 Å²	54.2	7%	0.074	27%	0.269	C	S	.	.	H	α-helix	trans	-67.8	-44.7	-179	0	0	0	0	0	111.8	K89 W91 L96 Q99 I100 K124 L125	K89-A128 WeakPolarHBondContact CE-O 3.35Å; K89-A128 PolarHBondContact NZ-O 3.45Å; W91-A128 VanDerWaalsContact CH2-O 3.27Å; W91-A128 WeakPolarHBondContact CH2-O 3.48Å; W91-A128 HydrophobicContact CZ3-CB 4.17Å; W91-A128 WeakPolarHBondContact CZ3-O 3.39Å; L96-A128 HydrophobicContact CD1-CB 3.9Å; Q99-A128 HydrophobicContact CG-CB 4.14Å; I100-A128 HydrophobicContact CG2-CB 3.7Å; K124-A128 WeakPolarHBondContact O-CB 3.34Å; K124-A128 PolarHBondContact O-N 2.95Å; L125-A128 PolarHBondContact O-N 3.01Å; L125-A128 VanDerWaalsContact O-N 3.1Å
129	I	92.2	Very high	89.8	Confident	8 Å²	8	54.3 Å²	54.3	4%	0.041	28%	0.277	C	S	.	.	H	α-helix	trans	-88.4	-20.3	-178.7	73.3	-170.7	0	0	0	113.2	I82 K89 L96 L125 L131 L133	I82-I129 HydrophobicContact CG1-CD1 4.42Å; K89-I129 VanDerWaalsContact CE-O 3.22Å; K89-I129 WeakPolarHBondContact CE-O 3.48Å; L96-I129 HydrophobicContact CD1-CG2 4.07Å; L125-I129 VanDerWaalsContact O-CG1 3.3Å; L125-I129 WeakPolarHBondContact O-CG1 3.34Å; L125-I129 PolarHBondContact O-N 3.36Å; I129-L131 HydrophobicContact CD1-CB 4.05Å; I129-L131 HydrophobicContact CG1-CB 3.94Å; I129-L131 HydrophobicContact CG1-CG 4.28Å; I129-L133 HydrophobicContact CD1-CD1 4.15Å; I129-L133 HydrophobicContact CD1-CD2 3.87Å; I129-L133 HydrophobicContact CD1-CG 4.17Å
130	G	91	Very high	89.6	Confident	20 Å²	20	51.4 Å²	51.4	21%	0.206	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	21.1	-178.3	0	0	0	0	0	114.2	E126 L142	E126-G130 VanDerWaalsContact O-CA 3.28Å; E126-G130 WeakPolarHBondContact O-CA 3.49Å; E126-G130 PolarHBondContact O-N 3.33Å; G130-L142 PolarHBondContact O-N 2.78Å
131	L	91.9	Very high	89.3	Confident	27 Å²	27	52.6 Å²	52.6	14%	0.141	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-125.2	147.4	178.6	-56.9	176.3	0	0	0	109.6	I81 E126 I129 S140 V141	I81-L131 HydrophobicContact CG2-CB 4.21Å; I81-L131 HydrophobicContact CG2-CD1 3.95Å; E126-L131 VanDerWaalsContact CA-O 3.29Å; E126-L131 WeakPolarHBondContact CA-O 3.38Å; E126-L131 WeakPolarHBondContact CB-O 3.39Å; E126-L131 WeakPolarHBondContact CG-O 3.18Å; E126-L131 PolarHBondContact O-N 2.96Å; I129-L131 HydrophobicContact CD1-CB 4.05Å; I129-L131 HydrophobicContact CG1-CB 3.94Å; I129-L131 HydrophobicContact CG1-CG 4.28Å; L131-S140 CarbonylContact C-O 3.53Å; L131-S140 VanDerWaalsContact CA-O 3.3Å; L131-S140 WeakPolarHBondContact CA-O 3.4Å; L131-V141 HydrophobicContact CD2-CG2 4.44Å
132	K	92.3	Very high	88.7	Confident	63 Å²	63	54 Å²	54	27%	0.274	29%	0.287	S	S	.	.			trans	-75.2	133.2	173.3	-62.4	-173.4	-167.6	159	0	110.2	G139 S140 L142	K132-G139 PolarHBondContact O-N 3.32Å; K132-S140 WeakPolarHBondContact CD-OG 3.48Å; K132-S140 PolarHBondContact N-O 3.03Å; K132-L142 HydrophobicContact CG-CB 4.43Å; K132-L142 HydrophobicContact CG-CD1 3.91Å
133	L	90.1	Very high	87.8	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.021	32%	0.322	C	S	.	.			trans	-109.5	-8.4	176.2	-61.1	178.8	0	0	0	111.6	V78 I81 I82 L122 L125 E126 I129	V78-L133 HydrophobicContact CG1-CB 4.23Å; V78-L133 HydrophobicContact CG1-CD2 4.25Å; I81-L133 HydrophobicContact CB-CD2 3.96Å; I81-L133 HydrophobicContact CG2-CD2 3.53Å; I82-L133 HydrophobicContact CD1-CD1 3.99Å; I82-L133 HydrophobicContact CG1-CD1 3.63Å; I82-L133 HydrophobicContact CG1-CD2 3.75Å; I82-L133 HydrophobicContact CG1-CG 4.36Å; L122-L133 HydrophobicContact CD2-CB 4.35Å; L122-L133 HydrophobicContact CD2-CD1 4.13Å; L125-L133 HydrophobicContact CB-CD1 3.67Å; L125-L133 HydrophobicContact CD1-CD1 4.43Å; E126-L133 HydrophobicContact CG-CB 3.75Å; E126-L133 HydrophobicContact CG-CD1 4.02Å; E126-L133 HydrophobicContact CG-CG 3.7Å; E126-L133 PolarHBondContact OE1-N 3.33Å; I129-L133 HydrophobicContact CD1-CD1 4.15Å; I129-L133 HydrophobicContact CD1-CD2 3.87Å; I129-L133 HydrophobicContact CD1-CG 4.17Å
134	R	87.4	Confident	86.2	Confident	84 Å²	84	64.5 Å²	64.5	32%	0.317	34%	0.339	S	S	.	.	S	Bend	trans	-124.8	157.5	-174.6	-60.8	175.8	-66.7	179	-1.6	111.6	L122 S123 E126	L122-R134 HydrophobicContact CD1-CG 4.12Å; S123-R134 VanDerWaalsContact OG-CZ 3.3Å; S123-R134 PolarHBondContact OG-NH1 3.25Å; S123-R134 PolarHBondContact OG-NH2 3.21Å; E126-R134 WeakPolarHBondContact OE1-CB 3.13Å; E126-R134 WeakPolarHBondContact OE1-CG 3.38Å; E126-R134 IonicContact OE1-CZ 3.21Å; E126-R134 PolarHBondContact OE1-N 3.09Å; E126-R134 IonicContact OE1-NE 2.87Å; E126-R134 PolarHBondContact OE1-NE 3.47Å; E126-R134 IonicContact OE2-CZ 3.01Å; E126-R134 VanDerWaalsContact OE2-CZ 3.3Å; E126-R134 IonicContact OE2-NE 3.55Å; E126-R134 PolarHBondContact OE2-NE 3.28Å; E126-R134 VanDerWaalsContact OE2-NE 3.15Å; E126-R134 IonicContact OE2-NH2 3.92Å; E126-R134 PolarHBondContact OE2-NH2 2.83Å
135	G	85.1	Confident	84.2	Confident	59 Å²	59	73 Å²	73	61%	0.608	38%	0.376	S	S	*	.	S	Bend	trans	83.9	-163.7	179.2	0	0	0	0	0	113	K138	G135-K138 WeakPolarHBondContact O-CG 3.36Å
136	K	82.1	Confident	81.6	Confident	207 Å²	207	78.9 Å²	78.9	90%	0.9	41%	0.412	S	S	*	.	S	Bend	trans	-75.9	-36.1	-177.1	-63.1	-177.2	179.6	-176.7	0	112.1	K138	K136-K138 VanDerWaalsContact C-N 3.35Å; K136-K138 PolarHBondContact O-N 3.32Å
137	D	83.6	Confident	79	Confident	104 Å²	104	81.8 Å²	81.8	56%	0.556	45%	0.446	S	S	*	.	S	Bend	trans	-94.6	50.4	-174.3	-48	-47.2	0	0	0	112.7	G139 S140	D137-G139 PolarHBondContact O-N 3.03Å; D137-S140 WeakPolarHBondContact CB-OG 3.35Å; D137-S140 WeakPolarHBondContact O-CB 3.48Å; D137-S140 PolarHBondContact O-N 2.93Å; D137-S140 PolarHBondContact O-OG 3.38Å
138	K	83.4	Confident	76.4	Confident	81 Å²	81	77.5 Å²	77.5	35%	0.352	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	134.8	178.1	-57.5	-176	-165.4	166.4	0	110.1	E77 V78 I81 G135 K136 S140	E77-K138 IonicContact OE2-NZ 3.95Å; E77-K138 PolarHBondContact OE2-NZ 3.19Å; V78-K138 HydrophobicContact CG2-CD 4.22Å; I81-K138 HydrophobicContact CD1-CB 3.73Å; G135-K138 WeakPolarHBondContact O-CG 3.36Å; K136-K138 VanDerWaalsContact C-N 3.35Å; K136-K138 PolarHBondContact O-N 3.32Å; K138-S140 VanDerWaalsContact C-N 3.31Å; K138-S140 PolarHBondContact O-N 2.98Å
139	G	82.7	Confident	73.6	Confident	31 Å²	31	85.9 Å²	85.9	32%	0.32	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	-5.9	-178.8	0	0	0	0	0	115	K132 D137	K132-G139 PolarHBondContact O-N 3.32Å; D137-G139 PolarHBondContact O-N 3.03Å
140	S	87.1	Confident	71.1	Confident	39 Å²	39	90.6 Å²	90.6	27%	0.273	53%	0.528	S	S	.	.	S	Bend	trans	-68.9	154.9	169	63.4	0	0	0	0	111.2	L131 K132 D137 K138 L142	L131-S140 CarbonylContact C-O 3.53Å; L131-S140 VanDerWaalsContact CA-O 3.3Å; L131-S140 WeakPolarHBondContact CA-O 3.4Å; K132-S140 WeakPolarHBondContact CD-OG 3.48Å; K132-S140 PolarHBondContact N-O 3.03Å; D137-S140 WeakPolarHBondContact CB-OG 3.35Å; D137-S140 WeakPolarHBondContact O-CB 3.48Å; D137-S140 PolarHBondContact O-N 2.93Å; D137-S140 PolarHBondContact O-OG 3.38Å; K138-S140 VanDerWaalsContact C-N 3.31Å; K138-S140 PolarHBondContact O-N 2.98Å; S140-L142 PolarHBondContact O-N 2.94Å
141	V	84.3	Confident	68.5	Low	104 Å²	104	98.6 Å²	98.6	63%	0.63	56%	0.557	S	S	*	*	B	Isolated β-bridge	trans	-62.1	131.5	176.6	-179.8	0	0	0	0	109.2	L131 E143	L131-V141 HydrophobicContact CD2-CG2 4.44Å; V141-E143 PolarHBondContact O-N 3.01Å
142	L	80.3	Confident	66.2	Low	36 Å²	36	101.8 Å²	101.8	19%	0.188	59%	0.587	C	S	.	*			trans	-71.9	98.5	172.7	-176.6	72.4	0	0	0	107.6	E126 R127 G130 K132 S140 T144	E126-L142 HydrophobicContact CB-CD2 4.29Å; R127-L142 HydrophobicContact CG-CD2 4.13Å; G130-L142 PolarHBondContact O-N 2.78Å; K132-L142 HydrophobicContact CG-CB 4.43Å; K132-L142 HydrophobicContact CG-CD1 3.91Å; S140-L142 PolarHBondContact O-N 2.94Å; L142-T144 VanDerWaalsContact C-N 3.29Å; L142-T144 HydrophobicContact CD2-CG2 4.38Å; L142-T144 PolarHBondContact O-N 3.22Å
143	E	72.9	Confident	64.2	Low	165 Å²	165	107.5 Å²	107.5	77%	0.771	62%	0.615	S	S	*	*			trans	-62.1	94.9	167	-65.9	-173.2	167.6	0	0	108.7	V141 K145	V141-E143 PolarHBondContact O-N 3.01Å; E143-K145 PolarHBondContact O-N 2.95Å
144	T	59.7	Low	62.5	Low	93 Å²	93	113 Å²	113	57%	0.571	65%	0.651	S	S	*	*			trans	-66.5	115.4	166.4	55.4	0	0	0	0	106	L142 T146	L142-T144 VanDerWaalsContact C-N 3.29Å; L142-T144 HydrophobicContact CD2-CG2 4.38Å; L142-T144 PolarHBondContact O-N 3.22Å; T144-T146 WeakPolarHBondContact CB-OG1 3.48Å; T144-T146 PolarHBondContact O-N 2.87Å; T144-T146 PolarHBondContact OG1-OG1 3.04Å
145	K	50	Low	61	Low	218 Å²	218	124.3 Å²	124.3	95%	0.948	69%	0.694	S	S	*	*			trans	-63.4	74.9	163.9	-78.5	-171.7	175.8	-179.6	0	108.9	E143 G147	E143-K145 PolarHBondContact O-N 2.95Å; K145-G147 PolarHBondContact O-N 2.97Å
146	T	40.1	Very low	59.8	Low	124 Å²	124	127.6 Å²	127.6	76%	0.761	70%	0.698	S	S	*	*			trans	-93.2	89.6	171.3	-48.6	0	0	0	0	105.9	T144	T144-T146 WeakPolarHBondContact CB-OG1 3.48Å; T144-T146 PolarHBondContact O-N 2.87Å; T144-T146 PolarHBondContact OG1-OG1 3.04Å
147	G	38.7	Very low	58.6	Low	75 Å²	75	123.4 Å²	123.4	77%	0.773	69%	0.687	S	S	*	*			trans	-175.5	9.9	-179.7	0	0	0	0	0	116.3	K145 K149	K145-G147 PolarHBondContact O-N 2.97Å; G147-K149 PolarHBondContact O-N 2.98Å
148	G	37.4	Very low	57.3	Low	77 Å²	77	124.4 Å²	124.4	79%	0.794	70%	0.695	S	S	*	*	S	Bend	trans	-95.9	81.1	179.1	0	0	0	0	0	113.2
149	K	34.3	Very low	55.7	Low	185 Å²	185	127 Å²	127	80%	0.804	72%	0.715	S	S	*	*			trans	54.1	82	163.4	-55.5	-154.4	-179.5	-170.3	0	117.9	G147 K151	G147-K149 PolarHBondContact O-N 2.98Å; K149-K151 VanDerWaalsContact C-N 3.3Å; K149-K151 PolarHBondContact O-N 2.93Å; K149-K151 VanDerWaalsContact O-N 3.1Å
150	A	38.1	Very low	54	Low	107 Å²	107	133 Å²	133	88%	0.884	74%	0.74	S	S	*	*			trans	-70.1	91	143.4	0	0	0	0	0	108.3	A152	A150-A152 VanDerWaalsContact C-N 3.31Å; A150-A152 PolarHBondContact O-N 3.09Å; A150-A152 VanDerWaalsContact O-N 3.16Å
151	K	37.5	Very low	51.8	Low	187 Å²	187	139.3 Å²	139.3	81%	0.813	77%	0.771	S	S	*	*			trans	-72.7	96.6	156.3	-91.8	-167.6	173.8	-171.7	0	106.1	K149 Q153	K149-K151 VanDerWaalsContact C-N 3.3Å; K149-K151 PolarHBondContact O-N 2.93Å; K149-K151 VanDerWaalsContact O-N 3.1Å; K151-Q153 PolarHBondContact O-N 3.19Å; K151-Q153 VanDerWaalsContact O-N 3.17Å
152	A	42.4	Very low	49.5	Very low	94 Å²	94	141.8 Å²	141.8	78%	0.777	78%	0.781	S	S	*	*			trans	-56.7	113.7	159.9	0	0	0	0	0	107.8	A150	A150-A152 VanDerWaalsContact C-N 3.31Å; A150-A152 PolarHBondContact O-N 3.09Å; A150-A152 VanDerWaalsContact O-N 3.16Å
153	Q	50	Low	47.1	Very low	183 Å²	183	149.9 Å²	149.9	86%	0.855	83%	0.826	S	S	*	*			trans	-75	126.4	159.2	-73.7	-179	-9.9	0	0	106.5	K151	K151-Q153 PolarHBondContact O-N 3.19Å; K151-Q153 VanDerWaalsContact O-N 3.17Å
154	P	55.1	Low	45	Very low	120 Å²	120	148.7 Å²	148.7	78%	0.779	83%	0.831	S	S	*	*			trans	-66	147.5	161.9	29.8	-30.2	0	0	0	108.5
155	R	56.7	Low	43.7	Very low	321 Å²	321	153.7 Å²	153.7	100%	1.211	86%	0.855	S	S	*	*			trans	-58.1	0	168.7	-79.6	176.7	140.8	-146.4	-3.3	111.6

Retrieved 155 of 155 residues in 42.3 ms (Link to these results)

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