A0A087XH83_POEFO Loading...

Potassium calcium-activated channel subfamily M regulatory beta subunit 3

AlphaFold DB , UniProt , Accession A0A087XH83, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 242 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	S	41.1	Very low	34	Very low	169 Å²	169	158.3 Å²	158.3	100%	1.182	81%	0.811	S	S	*	*				0	95.9	0	-45.1	0	0	0	0	107.7
2	A	31.1	Very low	33.5	Very low	103 Å²	103	150.8 Å²	150.8	85%	0.851	80%	0.802	S	S	*	*				80.1	72.9	66.4	0	0	0	0	0	110.9
3	T	41.1	Very low	33.2	Very low	144 Å²	144	152.4 Å²	152.4	88%	0.883	81%	0.811	S	S	*	*			trans	-85.1	121.9	165.4	-47.8	0	0	0	0	107.6
4	Q	35.5	Very low	33.2	Very low	158 Å²	158	146.5 Å²	146.5	74%	0.738	81%	0.805	S	S	*	*			trans	-154.5	113.4	172.5	-149.5	165.7	2	0	0	112.8
5	E	37.8	Very low	33	Very low	150 Å²	150	141.8 Å²	141.8	70%	0.701	80%	0.803	S	S	*	*			trans	54.7	171.9	134.9	-53	-178.6	88.8	0	0	118.6
6	Q	32	Very low	33.1	Very low	159 Å²	159	138.4 Å²	138.4	74%	0.743	81%	0.809	S	S	*	*			cis	-159.2	143.4	14.5	-160.9	-177.4	-6.4	0	0	107.1
7	E	34.1	Very low	33	Very low	111 Å²	111	136 Å²	136	52%	0.519	81%	0.809	S	S	.	*			cis	-155.5	138	-7.7	-115.6	-177.9	99.1	0	0	107.5
8	R	28	Very low	33.6	Very low	212 Å²	212	139.9 Å²	139.9	80%	0.8	82%	0.818	S	S	*	*				93.3	163.9	99	-167.7	169.6	179.8	174	2.8	116.3
9	S	27.3	Very low	33.9	Very low	101 Å²	101	136.6 Å²	136.6	71%	0.706	82%	0.817	S	S	*	*			trans	74.3	139.2	177.3	-93.4	0	0	0	0	116.8
10	Q	29.9	Very low	34.1	Very low	182 Å²	182	135.2 Å²	135.2	85%	0.85	82%	0.821	S	S	*	*			cis	-147.1	149.3	-2	-153.3	166.6	6.4	0	0	111.7
11	R	36.3	Very low	34.4	Very low	252 Å²	252	140.8 Å²	140.8	95%	0.951	83%	0.827	S	S	*	*			trans	-94.1	112.2	176.3	-178.5	-176	-177.4	-177.5	1.6	109.8
12	G	28.4	Very low	34.1	Very low	68 Å²	68	138.1 Å²	138.1	70%	0.701	81%	0.809	S	S	*	*			trans	-163.9	119.1	162.6	0	0	0	0	0	106.9
13	D	29	Very low	34.4	Very low	172 Å²	172	142.2 Å²	142.2	92%	0.92	81%	0.81	S	S	*	*				120.2	152.7	50.4	-173.5	25.4	0	0	0	105.9
14	G	33	Very low	34.3	Very low	70 Å²	70	142.5 Å²	142.5	72%	0.722	80%	0.803	S	S	*	*			trans	-89.4	142.4	-165.8	0	0	0	0	0	114.4
15	G	29.9	Very low	34.4	Very low	76 Å²	76	139 Å²	139	78%	0.784	80%	0.796	S	S	*	*			trans	173	108.6	171.6	0	0	0	0	0	112.2
16	G	34.4	Very low	34.3	Very low	87 Å²	87	138.9 Å²	138.9	90%	0.897	81%	0.806	S	S	*	*			trans	-71.2	144.8	-170.4	0	0	0	0	0	115.1
17	A	31.4	Very low	34.9	Very low	98 Å²	98	135.8 Å²	135.8	81%	0.81	80%	0.802	S	S	*	*			trans	-148.4	57.7	167	0	0	0	0	0	111.4	G19	A17-G19 PolarHBondContact O-N 3.44Å
18	E	44.8	Very low	35.9	Very low	206 Å²	206	132.6 Å²	132.6	96%	0.963	79%	0.792	S	S	*	*			trans	-62.8	102.6	166.9	-71.7	-176.3	88.8	0	0	109.9
19	G	39.2	Very low	37.3	Very low	78 Å²	78	126.6 Å²	126.6	80%	0.804	78%	0.779	S	S	*	*			trans	-170.2	5.9	-174.2	0	0	0	0	0	118.8	A17	A17-G19 PolarHBondContact O-N 3.44Å
20	A	38.1	Very low	38.8	Very low	108 Å²	108	124.4 Å²	124.4	89%	0.893	77%	0.771	S	S	*	*	S	Bend	trans	-137.9	15.4	-170.4	0	0	0	0	0	116.2
21	R	39.3	Very low	40.4	Very low	253 Å²	253	118.9 Å²	118.9	96%	0.955	75%	0.746	S	S	*	*			trans	-130.1	68	-174.1	-159.8	178.5	-170.3	121.9	2.5	114.1
22	S	36.2	Very low	42.1	Very low	113 Å²	113	113.4 Å²	113.4	79%	0.79	73%	0.731	S	S	*	*			trans	-152.7	47.9	168.4	-154.1	0	0	0	0	113.8
23	Q	37.6	Very low	44.3	Very low	188 Å²	188	118.3 Å²	118.3	88%	0.879	73%	0.728	S	S	*	*			trans	-131.6	36.7	164.4	-78.8	-162	-55.8	0	0	112.6
24	M	38.8	Very low	46.7	Very low	150 Å²	150	112.3 Å²	112.3	74%	0.739	70%	0.703	S	S	*	*			trans	-115.8	146.9	150.5	-117.6	86.4	-176.6	0	0	105.4
25	S	37.1	Very low	48.8	Very low	85 Å²	85	110.6 Å²	110.6	59%	0.594	68%	0.676	S	S	*	*	S	Bend	cis	-143.3	7.5	24.6	-49.9	0	0	0	0	115.2
26	T	36.1	Very low	51.1	Low	148 Å²	148	112 Å²	112	91%	0.908	67%	0.665	S	S	*	*	S	Bend	trans	-98.4	-24.5	-164.1	49	0	0	0	0	116.3
27	S	43	Very low	53.3	Low	94 Å²	94	112.5 Å²	112.5	66%	0.657	65%	0.647	S	S	*	*	S	Bend	trans	-92.2	-24.2	177.8	-163.1	0	0	0	0	113.7	V29	S27-V29 PolarHBondContact O-N 3.18Å
28	S	56.4	Low	55.7	Low	43 Å²	43	108 Å²	108	30%	0.301	61%	0.61	S	S	.	*	H	α-helix	trans	-68.3	-37	-168.4	-159.6	0	0	0	0	113.5	G30 E31 E32	S28-G30 PolarHBondContact O-N 3.15Å; S28-E31 PolarHBondContact O-N 3.45Å; S28-E32 WeakPolarHBondContact O-CB 3.33Å; S28-E32 PolarHBondContact O-N 3.22Å
29	V	56.8	Low	57.4	Low	87 Å²	87	103.9 Å²	103.9	53%	0.527	59%	0.589	S	S	.	*	H	α-helix	trans	-67.1	-37.2	-169.5	-176.8	0	0	0	0	112.1	S27 R33	S27-V29 PolarHBondContact O-N 3.18Å; V29-R33 WeakPolarHBondContact O-CG 3.39Å; V29-R33 PolarHBondContact O-N 2.9Å
30	G	59.5	Low	59.5	Low	54 Å²	54	103 Å²	103	56%	0.557	57%	0.568	S	S	*	*	H	α-helix	trans	-72.4	-38.2	176.2	0	0	0	0	0	112.8	S28 A34	S28-G30 PolarHBondContact O-N 3.15Å; G30-A34 WeakPolarHBondContact O-CB 3.21Å; G30-A34 PolarHBondContact O-N 3.11Å
31	E	64.1	Low	61.7	Low	66 Å²	66	102.1 Å²	102.1	31%	0.308	55%	0.546	S	S	.	.	H	α-helix	trans	-65.7	-48.2	-179.3	-170.9	-173.3	110.5	0	0	112.1	S28 R33 A34 I35 V198 Q202	S28-E31 PolarHBondContact O-N 3.45Å; E31-R33 VanDerWaalsContact C-N 3.33Å; E31-R33 PolarHBondContact O-N 3.15Å; E31-A34 PolarHBondContact O-N 2.88Å; E31-I35 HydrophobicContact CG-CD1 4.15Å; E31-I35 WeakPolarHBondContact O-CG1 3.48Å; E31-I35 PolarHBondContact O-N 2.8Å; E31-V198 HydrophobicContact CG-CG1 3.81Å; E31-Q202 VanDerWaalsContact OE1-CD 3.24Å; E31-Q202 PolarHBondContact OE1-NE2 2.89Å; E31-Q202 PolarHBondContact OE2-NE2 2.92Å
32	E	70.6	Confident	63.8	Low	137 Å²	137	92 Å²	92	64%	0.64	51%	0.51	S	S	*	.	H	α-helix	trans	-65.3	-36.5	-179.5	-167.5	168.4	-135.7	0	0	111.8	S28 L36	S28-E32 WeakPolarHBondContact O-CB 3.33Å; S28-E32 PolarHBondContact O-N 3.22Å; E32-L36 WeakPolarHBondContact O-CB 3.5Å; E32-L36 PolarHBondContact O-N 2.91Å
33	R	75.5	Confident	66	Low	172 Å²	172	89.1 Å²	89.1	65%	0.649	49%	0.493	S	S	*	.	H	α-helix	trans	-65.1	-42.7	171.9	-64.1	-84.7	-178.4	177.1	0.2	111.9	V29 E31 L36 L37	V29-R33 WeakPolarHBondContact O-CG 3.39Å; V29-R33 PolarHBondContact O-N 2.9Å; E31-R33 VanDerWaalsContact C-N 3.33Å; E31-R33 PolarHBondContact O-N 3.15Å; R33-L36 PolarHBondContact O-N 2.93Å; R33-L37 WeakPolarHBondContact O-CB 3.47Å; R33-L37 VanDerWaalsContact O-CG 3.3Å; R33-L37 WeakPolarHBondContact O-CG 3.35Å; R33-L37 PolarHBondContact O-N 3.08Å
34	A	79.4	Confident	68	Low	46 Å²	46	86.7 Å²	86.7	38%	0.38	48%	0.48	S	S	.	.	H	α-helix	trans	-65.6	-40.1	178.5	0	0	0	0	0	112.1	G30 E31 L37 G38	G30-A34 WeakPolarHBondContact O-CB 3.21Å; G30-A34 PolarHBondContact O-N 3.11Å; E31-A34 PolarHBondContact O-N 2.88Å; A34-L37 PolarHBondContact O-N 3.18Å; A34-G38 PolarHBondContact O-N 3.04Å
35	I	76	Confident	70.1	Confident	33 Å²	33	79.9 Å²	79.9	17%	0.169	45%	0.447	C	S	.	.	H	α-helix	trans	-63.6	-46.4	174.3	-68.3	166.7	0	0	0	110.6	E31 L37 G38 F39 V198	E31-I35 HydrophobicContact CG-CD1 4.15Å; E31-I35 WeakPolarHBondContact O-CG1 3.48Å; E31-I35 PolarHBondContact O-N 2.8Å; I35-L37 PolarHBondContact O-N 2.88Å; I35-G38 PolarHBondContact O-N 2.72Å; I35-F39 HydrophobicContact CG2-CD2 3.82Å; I35-F39 HydrophobicContact CG2-CE2 3.77Å; I35-F39 WeakPolarHBondContact O-CD2 3.06Å; I35-F39 PolarHBondContact O-N 3.38Å; I35-V198 HydrophobicContact CD1-CG1 4.05Å; I35-V198 HydrophobicContact CG1-CG1 4.01Å
36	L	79.9	Confident	72.2	Confident	105 Å²	105	78.6 Å²	78.6	55%	0.55	44%	0.436	S	S	.	.	H	α-helix	trans	-60.4	-44.5	177.3	-177.7	63	0	0	0	112.1	E32 R33 G38 F39 T40	E32-L36 WeakPolarHBondContact O-CB 3.5Å; E32-L36 PolarHBondContact O-N 2.91Å; R33-L36 PolarHBondContact O-N 2.93Å; L36-G38 VanDerWaalsContact C-N 3.34Å; L36-G38 PolarHBondContact O-N 3.07Å; L36-F39 PolarHBondContact O-N 2.79Å; L36-T40 PolarHBondContact O-N 2.86Å; L36-T40 PolarHBondContact O-OG1 3.26Å
37	L	80.6	Confident	74.3	Confident	99 Å²	99	76.5 Å²	76.5	52%	0.518	42%	0.419	S	S	.	.	H	α-helix	trans	-60.6	-42.5	175.6	-74.3	169.4	0	0	0	111.9	R33 A34 I35 T40 M41	R33-L37 WeakPolarHBondContact O-CB 3.47Å; R33-L37 VanDerWaalsContact O-CG 3.3Å; R33-L37 WeakPolarHBondContact O-CG 3.35Å; R33-L37 PolarHBondContact O-N 3.08Å; A34-L37 PolarHBondContact O-N 3.18Å; I35-L37 PolarHBondContact O-N 2.88Å; L37-T40 WeakPolarHBondContact CA-OG1 3.01Å; L37-T40 PolarHBondContact O-N 3.37Å; L37-T40 PolarHBondContact O-OG1 2.77Å; L37-M41 WeakPolarHBondContact O-CB 3.48Å; L37-M41 VanDerWaalsContact O-CG 3.31Å; L37-M41 WeakPolarHBondContact O-CG 3.26Å; L37-M41 PolarHBondContact O-N 2.89Å
38	G	81.8	Confident	76.1	Confident	2 Å²	2	77.1 Å²	77.1	2%	0.021	41%	0.412	C	S	.	.	H	α-helix	trans	-57.4	-47.9	173.8	0	0	0	0	0	112.5	A34 I35 L36 M41 M42	A34-G38 PolarHBondContact O-N 3.04Å; I35-G38 PolarHBondContact O-N 2.72Å; L36-G38 VanDerWaalsContact C-N 3.34Å; L36-G38 PolarHBondContact O-N 3.07Å; G38-M41 PolarHBondContact O-N 2.04Å; G38-M42 WeakPolarHBondContact O-CG 3.29Å; G38-M42 PolarHBondContact O-N 3.35Å
39	F	79.2	Confident	77.2	Confident	121 Å²	121	79.5 Å²	79.5	53%	0.531	42%	0.417	S	S	.	.	H	α-helix	trans	-62.7	-40.7	175.6	-85.4	-69.7	0	0	0	113.1	I35 L36 M42 A43	I35-F39 HydrophobicContact CG2-CD2 3.82Å; I35-F39 HydrophobicContact CG2-CE2 3.77Å; I35-F39 WeakPolarHBondContact O-CD2 3.06Å; I35-F39 PolarHBondContact O-N 3.38Å; L36-F39 PolarHBondContact O-N 2.79Å; F39-M42 HydrophobicContact CD1-SD 4.36Å; F39-M42 PolarHBondContact O-N 3.05Å; F39-A43 WeakPolarHBondContact O-CB 3.39Å; F39-A43 PolarHBondContact O-N 3.33Å
40	T	83.8	Confident	78.1	Confident	58 Å²	58	81.1 Å²	81.1	36%	0.356	42%	0.417	S	S	.	.	H	α-helix	trans	-66	-40.2	175.9	55.1	0	0	0	0	111.9	L36 L37 A43 F44	L36-T40 PolarHBondContact O-N 2.86Å; L36-T40 PolarHBondContact O-OG1 3.26Å; L37-T40 WeakPolarHBondContact CA-OG1 3.01Å; L37-T40 PolarHBondContact O-N 3.37Å; L37-T40 PolarHBondContact O-OG1 2.77Å; T40-A43 PolarHBondContact O-N 3.17Å; T40-F44 WeakPolarHBondContact O-CD2 3.38Å; T40-F44 PolarHBondContact O-N 2.9Å
41	M	83.4	Confident	78.8	Confident	90 Å²	90	82.5 Å²	82.5	44%	0.443	42%	0.415	S	S	.	.	H	α-helix	trans	-63.7	-41.8	176.5	-73	175.6	178.6	0	0	111.5	L37 G38 S45	L37-M41 WeakPolarHBondContact O-CB 3.48Å; L37-M41 VanDerWaalsContact O-CG 3.31Å; L37-M41 WeakPolarHBondContact O-CG 3.26Å; L37-M41 PolarHBondContact O-N 2.89Å; G38-M41 PolarHBondContact O-N 2.04Å; M41-S45 WeakPolarHBondContact O-CB 3.14Å; M41-S45 PolarHBondContact O-N 3.23Å
42	M	83.7	Confident	79	Confident	41 Å²	41	80.9 Å²	80.9	20%	0.202	41%	0.41	C	S	.	.	H	α-helix	trans	-58.7	-50.9	171.5	-70.7	173.3	-178.3	0	0	111.8	G38 F39 S45 V46 S192 V195	G38-M42 WeakPolarHBondContact O-CG 3.29Å; G38-M42 PolarHBondContact O-N 3.35Å; F39-M42 HydrophobicContact CD1-SD 4.36Å; F39-M42 PolarHBondContact O-N 3.05Å; M42-S45 PolarHBondContact O-N 3.16Å; M42-S45 VanDerWaalsContact O-N 3.17Å; M42-V46 WeakPolarHBondContact O-CG2 3.48Å; M42-V46 PolarHBondContact O-N 2.86Å; M42-S192 VanDerWaalsContact CE-CA 3.47Å; M42-V195 HydrophobicContact CE-CB 4.5Å; M42-V195 HydrophobicContact CE-CG2 4.19Å
43	A	82.1	Confident	78.9	Confident	52 Å²	52	75.1 Å²	75.1	43%	0.43	39%	0.387	S	S	.	.	H	α-helix	trans	-61.9	-47.1	-176.4	0	0	0	0	0	112.4	F39 T40 S45 V46 L47	F39-A43 WeakPolarHBondContact O-CB 3.39Å; F39-A43 PolarHBondContact O-N 3.33Å; T40-A43 PolarHBondContact O-N 3.17Å; A43-S45 VanDerWaalsContact C-N 3.31Å; A43-S45 PolarHBondContact O-N 3.26Å; A43-V46 PolarHBondContact O-N 2.96Å; A43-L47 WeakPolarHBondContact O-CG 3.25Å; A43-L47 PolarHBondContact O-N 3.23Å
44	F	79.8	Confident	78.6	Confident	138 Å²	138	72 Å²	72	61%	0.605	38%	0.382	S	S	*	.	H	α-helix	trans	-63.3	-37	174.1	-84.4	-72.4	0	0	0	112.3	T40 L47 M48	T40-F44 WeakPolarHBondContact O-CD2 3.38Å; T40-F44 PolarHBondContact O-N 2.9Å; F44-L47 PolarHBondContact O-N 2.62Å; F44-M48 WeakPolarHBondContact O-CB 3.31Å; F44-M48 VanDerWaalsContact O-CG 3.31Å; F44-M48 WeakPolarHBondContact O-CG 3.45Å; F44-M48 PolarHBondContact O-N 2.63Å
45	S	84.1	Confident	77.8	Confident	7 Å²	7	74.1 Å²	74.1	5%	0.049	39%	0.39	C	S	.	.	H	α-helix	trans	-67.8	-37.4	176.7	-165.9	0	0	0	0	112.9	M41 M42 A43 M48 F49 P184	M41-S45 WeakPolarHBondContact O-CB 3.14Å; M41-S45 PolarHBondContact O-N 3.23Å; M42-S45 PolarHBondContact O-N 3.16Å; M42-S45 VanDerWaalsContact O-N 3.17Å; A43-S45 VanDerWaalsContact C-N 3.31Å; A43-S45 PolarHBondContact O-N 3.26Å; S45-M48 PolarHBondContact O-N 2.02Å; S45-F49 VanDerWaalsContact O-CB 3.31Å; S45-F49 WeakPolarHBondContact O-CB 3.29Å; S45-F49 PolarHBondContact O-N 3.02Å; S45-P184 WeakPolarHBondContact OG-CA 3.43Å; S45-P184 PolarHBondContact OG-O 2.89Å
46	V	81.1	Confident	77	Confident	57 Å²	57	74.3 Å²	74.3	35%	0.345	39%	0.393	S	S	.	.	H	α-helix	trans	-66.5	-44	174	169.6	0	0	0	0	110.6	M42 A43 M48 F49 F50 L188	M42-V46 WeakPolarHBondContact O-CG2 3.48Å; M42-V46 PolarHBondContact O-N 2.86Å; A43-V46 PolarHBondContact O-N 2.96Å; V46-M48 PolarHBondContact O-N 2.97Å; V46-F49 PolarHBondContact O-N 2.67Å; V46-F50 HydrophobicContact CG1-CD2 3.7Å; V46-F50 HydrophobicContact CG1-CE2 3.55Å; V46-F50 VanDerWaalsContact O-CD2 3.24Å; V46-F50 WeakPolarHBondContact O-CD2 3.1Å; V46-F50 PolarHBondContact O-N 2.8Å; V46-L188 HydrophobicContact CG2-CD1 3.7Å
47	L	80.5	Confident	75.9	Confident	105 Å²	105	72.5 Å²	72.5	55%	0.55	39%	0.386	S	S	.	.	H	α-helix	trans	-60.6	-44.2	174.6	-70.9	171.1	0	0	0	111.8	A43 F44 F50 V51	A43-L47 WeakPolarHBondContact O-CG 3.25Å; A43-L47 PolarHBondContact O-N 3.23Å; F44-L47 PolarHBondContact O-N 2.62Å; L47-F50 PolarHBondContact O-N 3.25Å; L47-V51 WeakPolarHBondContact O-CG2 3.49Å; L47-V51 PolarHBondContact O-N 3.28Å
48	M	80.3	Confident	74.5	Confident	106 Å²	106	74.3 Å²	74.3	52%	0.522	39%	0.39	S	S	.	.	H	α-helix	trans	-67.6	-36.9	176.7	-71.9	-67.8	162.4	0	0	112.5	F44 S45 V46 F50 V51 V52 P184	F44-M48 WeakPolarHBondContact O-CB 3.31Å; F44-M48 VanDerWaalsContact O-CG 3.31Å; F44-M48 WeakPolarHBondContact O-CG 3.45Å; F44-M48 PolarHBondContact O-N 2.63Å; S45-M48 PolarHBondContact O-N 2.02Å; V46-M48 PolarHBondContact O-N 2.97Å; M48-F50 VanDerWaalsContact C-N 3.34Å; M48-V51 PolarHBondContact O-N 2.89Å; M48-V52 WeakPolarHBondContact O-CG2 3.41Å; M48-V52 PolarHBondContact O-N 2.92Å; M48-P184 HydrophobicContact CB-CG 4.38Å
49	F	79.9	Confident	73	Confident	93 Å²	93	76.3 Å²	76.3	41%	0.408	40%	0.403	S	S	.	.	H	α-helix	trans	-62.3	-40.4	171.3	-179.2	-89.2	0	0	0	111.7	S45 V46 G53 L181 P184	S45-F49 VanDerWaalsContact O-CB 3.31Å; S45-F49 WeakPolarHBondContact O-CB 3.29Å; S45-F49 PolarHBondContact O-N 3.02Å; V46-F49 PolarHBondContact O-N 2.67Å; F49-G53 VanDerWaalsContact O-CA 3.31Å; F49-G53 WeakPolarHBondContact O-CA 3Å; F49-G53 PolarHBondContact O-N 3.14Å; F49-L181 HydrophobicContact CD2-CD2 3.79Å; F49-L181 HydrophobicContact CE2-CD2 3.87Å; F49-P184 HydrophobicContact CB-CB 4.19Å
50	F	75	Confident	71.3	Confident	121 Å²	121	79.1 Å²	79.1	53%	0.531	41%	0.411	S	S	.	.	H	α-helix	trans	-68.6	-37.4	173.1	-80.8	-62	0	0	0	112.9	V46 L47 M48 I54	V46-F50 HydrophobicContact CG1-CD2 3.7Å; V46-F50 HydrophobicContact CG1-CE2 3.55Å; V46-F50 VanDerWaalsContact O-CD2 3.24Å; V46-F50 WeakPolarHBondContact O-CD2 3.1Å; V46-F50 PolarHBondContact O-N 2.8Å; L47-F50 PolarHBondContact O-N 3.25Å; M48-F50 VanDerWaalsContact C-N 3.34Å; F50-I54 VanDerWaalsContact O-CB 3.25Å; F50-I54 WeakPolarHBondContact O-CB 3.02Å; F50-I54 WeakPolarHBondContact O-CD1 3.35Å; F50-I54 WeakPolarHBondContact O-CG1 3.3Å; F50-I54 PolarHBondContact O-N 3.15Å
51	V	73.4	Confident	69.5	Low	84 Å²	84	82.5 Å²	82.5	51%	0.509	43%	0.425	S	S	.	.	H	α-helix	trans	-65.3	-52	175.7	170.3	0	0	0	0	110.9	L47 M48 G53 I54 T55	L47-V51 WeakPolarHBondContact O-CG2 3.49Å; L47-V51 PolarHBondContact O-N 3.28Å; M48-V51 PolarHBondContact O-N 2.89Å; V51-G53 VanDerWaalsContact C-N 3.33Å; V51-G53 PolarHBondContact O-N 3.05Å; V51-I54 PolarHBondContact O-N 2.98Å; V51-T55 WeakPolarHBondContact O-CG2 3.47Å; V51-T55 PolarHBondContact O-N 3.45Å; V51-T55 PolarHBondContact O-OG1 3.38Å
52	V	69.4	Low	67.5	Low	32 Å²	32	84.6 Å²	84.6	19%	0.194	44%	0.439	C	S	.	.	H	α-helix	trans	-65.6	-37.8	177.7	180	0	0	0	0	111.1	M48 T55 T56 L181	M48-V52 WeakPolarHBondContact O-CG2 3.41Å; M48-V52 PolarHBondContact O-N 2.92Å; V52-T55 WeakPolarHBondContact CA-OG1 3.33Å; V52-T55 PolarHBondContact O-N 3.31Å; V52-T55 PolarHBondContact O-OG1 2.84Å; V52-T56 HydrophobicContact CG1-CG2 4.38Å; V52-T56 WeakPolarHBondContact O-CB 3.4Å; V52-T56 VanDerWaalsContact O-CG2 3.23Å; V52-T56 WeakPolarHBondContact O-CG2 3.28Å; V52-T56 PolarHBondContact O-N 3.37Å; V52-T56 PolarHBondContact O-OG1 3.12Å; V52-L181 HydrophobicContact CB-CD2 3.94Å; V52-L181 HydrophobicContact CG1-CD2 3.6Å; V52-L181 HydrophobicContact CG1-CG 3.73Å
53	G	69	Low	65.3	Low	16 Å²	16	83.5 Å²	83.5	17%	0.165	44%	0.435	C	S	.	.	H	α-helix	trans	-59.7	-47.3	172.7	0	0	0	0	0	111.6	F49 V51 T56 V57	F49-G53 VanDerWaalsContact O-CA 3.31Å; F49-G53 WeakPolarHBondContact O-CA 3Å; F49-G53 PolarHBondContact O-N 3.14Å; V51-G53 VanDerWaalsContact C-N 3.33Å; V51-G53 PolarHBondContact O-N 3.05Å; G53-T56 PolarHBondContact O-N 3.49Å; G53-T56 PolarHBondContact O-OG1 2.79Å; G53-V57 WeakPolarHBondContact O-CB 3.47Å; G53-V57 WeakPolarHBondContact O-CG2 2.95Å; G53-V57 PolarHBondContact O-N 3.27Å
54	I	67.9	Low	63	Low	107 Å²	107	85.2 Å²	85.2	55%	0.549	44%	0.442	S	S	.	.	H	α-helix	trans	-70.8	-38.8	179	-69.1	164.6	0	0	0	111.3	F50 V51 T56 V57 K58	F50-I54 VanDerWaalsContact O-CB 3.25Å; F50-I54 WeakPolarHBondContact O-CB 3.02Å; F50-I54 WeakPolarHBondContact O-CD1 3.35Å; F50-I54 WeakPolarHBondContact O-CG1 3.3Å; F50-I54 PolarHBondContact O-N 3.15Å; V51-I54 PolarHBondContact O-N 2.98Å; I54-T56 PolarHBondContact O-N 3.23Å; I54-V57 PolarHBondContact O-N 2.82Å; I54-K58 WeakPolarHBondContact O-CB 3.22Å; I54-K58 PolarHBondContact O-N 3.45Å
55	T	62.5	Low	61.2	Low	90 Å²	90	82.4 Å²	82.4	55%	0.552	43%	0.428	S	S	*	.	H	α-helix	trans	-71	-16.3	176.4	58.6	0	0	0	0	113.9	V51 V52 P59	V51-T55 WeakPolarHBondContact O-CG2 3.47Å; V51-T55 PolarHBondContact O-N 3.45Å; V51-T55 PolarHBondContact O-OG1 3.38Å; V52-T55 WeakPolarHBondContact CA-OG1 3.33Å; V52-T55 PolarHBondContact O-N 3.31Å; V52-T55 PolarHBondContact O-OG1 2.84Å; T55-P59 WeakPolarHBondContact O-CD 2.91Å; T55-P59 WeakPolarHBondContact O-CG 3.48Å
56	T	60.3	Low	58.9	Low	37 Å²	37	88.9 Å²	88.9	23%	0.227	46%	0.458	C	S	.	.	H	α-helix	trans	-96.5	-33.9	172.7	54.1	0	0	0	0	112.5	V52 G53 I54 Y60 A177	V52-T56 HydrophobicContact CG1-CG2 4.38Å; V52-T56 WeakPolarHBondContact O-CB 3.4Å; V52-T56 VanDerWaalsContact O-CG2 3.23Å; V52-T56 WeakPolarHBondContact O-CG2 3.28Å; V52-T56 PolarHBondContact O-N 3.37Å; V52-T56 PolarHBondContact O-OG1 3.12Å; G53-T56 PolarHBondContact O-N 3.49Å; G53-T56 PolarHBondContact O-OG1 2.79Å; I54-T56 PolarHBondContact O-N 3.23Å; T56-Y60 PolarHBondContact O-N 3.01Å; T56-A177 HydrophobicContact CG2-CB 3.45Å; T56-A177 VanDerWaalsContact CG2-CB 3.45Å
57	V	55.9	Low	56.7	Low	66 Å²	66	92.6 Å²	92.6	40%	0.4	47%	0.471	S	S	.	.	H	α-helix	trans	-76.3	-30.2	176	170	0	0	0	0	112.5	G53 I54 Y60 I61	G53-V57 WeakPolarHBondContact O-CB 3.47Å; G53-V57 WeakPolarHBondContact O-CG2 2.95Å; G53-V57 PolarHBondContact O-N 3.27Å; I54-V57 PolarHBondContact O-N 2.82Å; V57-Y60 CarbonylContact O-C 3.58Å; V57-Y60 WeakPolarHBondContact O-CA 3.37Å; V57-Y60 PolarHBondContact O-N 3.36Å; V57-I61 HydrophobicContact CG1-CD1 3.47Å; V57-I61 VanDerWaalsContact CG1-CD1 3.47Å; V57-I61 HydrophobicContact CG1-CG1 3.9Å; V57-I61 PolarHBondContact O-N 2.9Å
58	K	51.1	Low	54.8	Low	137 Å²	137	89 Å²	89	60%	0.596	46%	0.457	S	S	*	.	H	α-helix	trans	-56.9	-59.1	174.5	-141.5	-167.2	174.7	67.7	0	110.1	I54 Y60 I61 D62	I54-K58 WeakPolarHBondContact O-CB 3.22Å; I54-K58 PolarHBondContact O-N 3.45Å; K58-Y60 PolarHBondContact O-N 3.07Å; K58-I61 PolarHBondContact O-N 2.87Å; K58-I61 VanDerWaalsContact O-N 3.16Å; K58-D62 WeakPolarHBondContact O-CB 3.45Å; K58-D62 PolarHBondContact O-N 3.16Å
59	P	50.3	Low	52.8	Low	45 Å²	45	88.6 Å²	88.6	29%	0.292	46%	0.464	S	S	.	.	H	α-helix	trans	-82.7	36.9	171.8	41.7	-40.8	0	0	0	112.3	T55 S63 R170	T55-P59 WeakPolarHBondContact O-CD 2.91Å; T55-P59 WeakPolarHBondContact O-CG 3.48Å; P59-S63 PolarHBondContact O-OG 2.99Å; P59-R170 VanDerWaalsContact CB-NH2 3.27Å; P59-R170 PolarHBondContact O-NH1 3.41Å; P59-R170 PolarHBondContact O-NH2 2.9Å; P59-R170 VanDerWaalsContact O-NH2 3.11Å
60	Y	44.1	Very low	51.1	Low	180 Å²	180	85 Å²	85	71%	0.706	45%	0.45	S	S	*	.	H	α-helix	trans	-123.2	-24.1	158.2	-177	-101.9	0	0	0	111.8	T56 V57 K58 S63	T56-Y60 PolarHBondContact O-N 3.01Å; V57-Y60 CarbonylContact O-C 3.58Å; V57-Y60 WeakPolarHBondContact O-CA 3.37Å; V57-Y60 PolarHBondContact O-N 3.36Å; K58-Y60 PolarHBondContact O-N 3.07Å; Y60-S63 WeakPolarHBondContact CA-OG 3.47Å; Y60-S63 PolarHBondContact N-OG 2.92Å; Y60-S63 PolarHBondContact O-OG 3.3Å
61	I	45.1	Very low	49.4	Very low	128 Å²	128	83.4 Å²	83.4	66%	0.656	45%	0.451	S	S	*	.	H	α-helix	trans	-99.5	-37.7	174.9	-64.5	-179.8	0	0	0	112.7	V57 K58 S63	V57-I61 HydrophobicContact CG1-CD1 3.47Å; V57-I61 VanDerWaalsContact CG1-CD1 3.47Å; V57-I61 HydrophobicContact CG1-CG1 3.9Å; V57-I61 PolarHBondContact O-N 2.9Å; K58-I61 PolarHBondContact O-N 2.87Å; K58-I61 VanDerWaalsContact O-N 3.16Å; I61-S63 PolarHBondContact N-OG 2.86Å; I61-S63 PolarHBondContact O-N 2.87Å
62	D	41.2	Very low	48	Very low	135 Å²	135	81.5 Å²	81.5	72%	0.722	44%	0.437	S	S	*	.	S	Bend	trans	-74.9	24.5	178	-134.3	6.5	0	0	0	112	K58	K58-D62 WeakPolarHBondContact O-CB 3.45Å; K58-D62 PolarHBondContact O-N 3.16Å
63	S	38.1	Very low	46.6	Very low	18 Å²	18	83.6 Å²	83.6	13%	0.126	45%	0.452	C	S	.	.			trans	-165.2	56.2	-147.7	59.4	0	0	0	0	109.1	P59 Y60 I61 W65	P59-S63 PolarHBondContact O-OG 2.99Å; Y60-S63 WeakPolarHBondContact CA-OG 3.47Å; Y60-S63 PolarHBondContact N-OG 2.92Å; Y60-S63 PolarHBondContact O-OG 3.3Å; I61-S63 PolarHBondContact N-OG 2.86Å; I61-S63 PolarHBondContact O-N 2.87Å; S63-W65 VanDerWaalsContact C-CD1 3.4Å; S63-W65 VanDerWaalsContact CB-CD1 3.4Å; S63-W65 PolarHBondContact O-N 3.23Å
64	C	34.2	Very low	45.3	Very low	87 Å²	87	88.5 Å²	88.5	59%	0.588	47%	0.47	S	S	*	.			trans	-75.8	51.5	174.1	-172.2	0	0	0	0	110.3	E66	C64-E66 PolarHBondContact O-N 2.85Å
65	W	41.1	Very low	43.9	Very low	80 Å²	80	84.2 Å²	84.2	30%	0.303	45%	0.449	S	S	.	.			trans	-72	110.3	178.6	-49.7	86.1	0	0	0	108.6	S63 F156 S157 D158 I167	S63-W65 VanDerWaalsContact C-CD1 3.4Å; S63-W65 VanDerWaalsContact CB-CD1 3.4Å; S63-W65 PolarHBondContact O-N 3.23Å; W65-F156 HydrophobicContact CB-CB 4.17Å; W65-F156 HydrophobicContact CB-CD1 4.04Å; W65-F156 HydrophobicContact CD2-CB 4.07Å; W65-F156 HydrophobicContact CE3-CB 3.64Å; W65-F156 HydrophobicContact CG-CB 4.29Å; W65-F156 HydrophobicContact CZ3-CB 4.35Å; W65-F156 VanDerWaalsContact CZ3-O 3.31Å; W65-F156 WeakPolarHBondContact CZ3-O 3.42Å; W65-S157 VanDerWaalsContact CZ3-C 3.46Å; W65-D158 HydrophobicContact CD2-CB 4.3Å; W65-D158 HydrophobicContact CE3-CB 3.91Å; W65-D158 HydrophobicContact CH2-CB 3.66Å; W65-D158 HydrophobicContact CZ2-CB 4.05Å; W65-D158 HydrophobicContact CZ3-CB 3.6Å; W65-I167 HydrophobicContact CH2-CD1 4.09Å; W65-I167 HydrophobicContact CH2-CG1 4.47Å
66	E	36.5	Very low	42.8	Very low	143 Å²	143	83.6 Å²	83.6	67%	0.668	44%	0.442	S	S	*	.			trans	-72.6	140.2	166.8	-71.3	174	61	0	0	109.1	C64 A68	C64-E66 PolarHBondContact O-N 2.85Å; E66-A68 VanDerWaalsContact C-N 3.33Å; E66-A68 PolarHBondContact O-N 3.14Å
67	E	35.4	Very low	42.2	Very low	134 Å²	134	84.8 Å²	84.8	63%	0.626	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72	84	-175.3	-174.1	97.7	-142.8	0	0	110.2	A154 F156	E67-A154 WeakPolarHBondContact OE1-CB 3.46Å; E67-F156 VanDerWaalsContact OE1-CZ 3.29Å; E67-F156 WeakPolarHBondContact OE1-CZ 3.16Å
68	A	40.8	Very low	41.6	Very low	31 Å²	31	84.8 Å²	84.8	26%	0.256	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	110	-172.5	0	0	0	0	0	112.3	E66 C70 V99	E66-A68 VanDerWaalsContact C-N 3.33Å; E66-A68 PolarHBondContact O-N 3.14Å; A68-C70 PolarHBondContact O-N 3.2Å; A68-C70 PolarHBondContact O-SG 3.1Å; A68-V99 HydrophobicContact CB-CG1 4.35Å
69	S	38	Very low	41.2	Very low	96 Å²	96	86.7 Å²	86.7	67%	0.671	46%	0.455	S	S	*	.			trans	-59.5	93.3	174.5	-61.6	0	0	0	0	112.2	T100	S69-T100 WeakPolarHBondContact O-CB 3.41Å; S69-T100 PolarHBondContact O-OG1 3.06Å
70	C	43.7	Very low	40.9	Very low	18 Å²	18	91.2 Å²	91.2	12%	0.122	47%	0.472	C	S	.	.			trans	-83.9	150.7	178.8	-61.5	0	0	0	0	112	A68 C155	A68-C70 PolarHBondContact O-N 3.2Å; A68-C70 PolarHBondContact O-SG 3.1Å; C70-C155 HydrophobicContact CB-CB 3.72Å
71	V	39.4	Very low	41.4	Very low	88 Å²	88	85.9 Å²	85.9	53%	0.533	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.3	178.4	172.8	0	0	0	0	108.3	P73 S98 T100	V71-P73 VanDerWaalsContact O-CD 3.29Å; V71-P73 WeakPolarHBondContact O-CD 3.15Å; V71-S98 PolarHBondContact N-O 3.11Å; V71-S98 PolarHBondContact O-OG 2.75Å; V71-T100 WeakPolarHBondContact CG2-OG1 3.46Å
72	L	44	Very low	42.1	Very low	43 Å²	43	81.1 Å²	81.1	23%	0.225	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	116.9	178.7	178.6	67.6	0	0	0	110.3	T75 V95 V97 L149	L72-T75 HydrophobicContact CD1-CG2 3.81Å; L72-T75 HydrophobicContact CD2-CG2 3.69Å; L72-T75 HydrophobicContact CG-CG2 4.11Å; L72-V95 HydrophobicContact CD1-CG1 4.27Å; L72-V97 HydrophobicContact CD1-CG1 3.86Å; L72-L149 HydrophobicContact CB-CB 4.17Å; L72-L149 HydrophobicContact CB-CD2 4.23Å; L72-L149 HydrophobicContact CD1-CD2 3.93Å; L72-L149 HydrophobicContact CD2-CB 3.62Å; L72-L149 HydrophobicContact CD2-CD2 3.88Å; L72-L149 HydrophobicContact CD2-CG 4.41Å; L72-L149 HydrophobicContact CG-CB 4.47Å; L72-L149 HydrophobicContact CG-CD2 4.24Å
73	P	39.6	Very low	42.7	Very low	77 Å²	77	79.8 Å²	79.8	50%	0.5	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-42.5	177.7	33.3	-30.5	0	0	0	111.5	V71 T96 S98	V71-P73 VanDerWaalsContact O-CD 3.29Å; V71-P73 WeakPolarHBondContact O-CD 3.15Å; P73-T96 WeakPolarHBondContact CD-O 3.14Å; P73-S98 WeakPolarHBondContact CD-OG 3.49Å; P73-S98 WeakPolarHBondContact CG-OG 3.48Å
74	Q	41.5	Very low	43.9	Very low	119 Å²	119	80 Å²	80	56%	0.556	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-158.1	145.6	-168.9	-165.2	160.3	-28.6	0	0	112.1	D76	Q74-D76 WeakPolarHBondContact CG-OD2 3.34Å; Q74-D76 PolarHBondContact NE2-OD2 3.17Å
75	T	38.5	Very low	45.2	Very low	16 Å²	16	85.8 Å²	85.8	10%	0.098	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.1	171.8	60.1	0	0	0	0	107.5	L72 V95 K142 D146	L72-T75 HydrophobicContact CD1-CG2 3.81Å; L72-T75 HydrophobicContact CD2-CG2 3.69Å; L72-T75 HydrophobicContact CG-CG2 4.11Å; T75-V95 HydrophobicContact CG2-CG1 3.79Å; T75-K142 WeakPolarHBondContact O-CE 3.12Å; T75-K142 PolarHBondContact O-NZ 3.45Å; T75-K142 WeakPolarHBondContact OG1-CE 3.37Å; T75-D146 WeakPolarHBondContact CB-OD1 3.25Å; T75-D146 VanDerWaalsContact CG2-OD1 3.25Å; T75-D146 WeakPolarHBondContact CG2-OD1 3.42Å; T75-D146 PolarHBondContact OG1-OD1 3.07Å
76	D	39.4	Very low	46	Very low	78 Å²	78	84.8 Å²	84.8	42%	0.417	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	147.2	-177.6	-77.6	-47.7	0	0	0	111.3	Q74 T94	Q74-D76 WeakPolarHBondContact CG-OD2 3.34Å; Q74-D76 PolarHBondContact NE2-OD2 3.17Å; D76-T94 CarbonylContact O-C 3.54Å; D76-T94 PolarHBondContact O-N 3.46Å; D76-T94 PolarHBondContact O-OG1 2.78Å
77	I	47.9	Very low	46.9	Very low	61 Å²	61	82.9 Å²	82.9	31%	0.313	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	123.4	169.4	-63.2	167.7	0	0	0	104.3	E79 L93 V138 K142	I77-E79 PolarHBondContact O-N 2.91Å; I77-E79 VanDerWaalsContact O-N 3.15Å; I77-L93 HydrophobicContact CG1-CD1 3.85Å; I77-V138 HydrophobicContact CD1-CG1 4.25Å; I77-V138 HydrophobicContact CG1-CG1 4.26Å; I77-V138 HydrophobicContact CG2-CG1 4.49Å; I77-K142 HydrophobicContact CD1-CD 4.16Å; I77-K142 HydrophobicContact CG1-CD 4.1Å
78	L	44.6	Very low	47.9	Very low	66 Å²	66	77.4 Å²	77.4	35%	0.346	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	116.8	177.6	-166.5	71.1	0	0	0	107.6	E80 C92 T94	L78-E80 HydrophobicContact CD2-CB 4.16Å; L78-E80 HydrophobicContact CG-CB 4.07Å; L78-E80 PolarHBondContact O-N 3.42Å; L78-C92 HydrophobicContact CB-CB 4.18Å; L78-C92 HydrophobicContact CD2-CB 4.39Å; L78-C92 PolarHBondContact N-O 2.93Å; L78-T94 HydrophobicContact CB-CG2 4.09Å; L78-T94 HydrophobicContact CD2-CG2 4.42Å
79	E	41.8	Very low	48.9	Very low	178 Å²	178	78.6 Å²	78.6	83%	0.832	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	-11.2	-178.8	-62.9	-161.6	129	0	0	112.6	I77 W81	I77-E79 PolarHBondContact O-N 2.91Å; I77-E79 VanDerWaalsContact O-N 3.15Å; E79-W81 PolarHBondContact O-N 2.91Å
80	E	43.4	Very low	50	Low	139 Å²	139	74 Å²	74	65%	0.65	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	103.8	173.2	-167.4	160.5	-145.6	0	0	110.8	L78 V82	L78-E80 HydrophobicContact CD2-CB 4.16Å; L78-E80 HydrophobicContact CG-CB 4.07Å; L78-E80 PolarHBondContact O-N 3.42Å; E80-V82 PolarHBondContact O-N 2.83Å
81	W	55.1	Low	50.8	Low	69 Å²	69	73.4 Å²	73.4	26%	0.261	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	108.7	178.7	-66.6	71.9	0	0	0	110.4	E79 P91 R131 Q135	E79-W81 PolarHBondContact O-N 2.91Å; W81-P91 HydrophobicContact CZ3-CB 4.45Å; W81-P91 HydrophobicContact CZ3-CG 4.33Å; W81-R131 VanDerWaalsContact CD2-NH2 3.3Å; W81-R131 HydrophobicContact CH2-CG 3.46Å; W81-R131 VanDerWaalsContact CH2-CG 3.46Å; W81-R131 HydrophobicContact CZ2-CG 4.48Å; W81-R131 HydrophobicContact CZ3-CG 3.64Å; W81-Q135 HydrophobicContact CH2-CG 3.97Å; W81-Q135 HydrophobicContact CZ2-CG 4.46Å
82	V	58.7	Low	51.7	Low	28 Å²	28	69.2 Å²	69.2	17%	0.17	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	139.2	179	-60.8	0	0	0	0	111.1	E80 C84 V90 L124	E80-V82 PolarHBondContact O-N 2.83Å; V82-C84 PolarHBondContact O-N 3.32Å; V82-V90 HydrophobicContact CG2-CG2 3.67Å; V82-V90 PolarHBondContact N-O 3.23Å; V82-V90 PolarHBondContact O-N 3.46Å; V82-L124 HydrophobicContact CG2-CD1 3.64Å
83	D	53.9	Low	52.5	Low	106 Å²	106	67.2 Å²	67.2	57%	0.567	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	112.4	178.4	179.6	7.3	0	0	0	110.9	R85 G86	D83-R85 PolarHBondContact O-N 3.02Å; D83-G86 VanDerWaalsContact OD1-CA 3.26Å; D83-G86 WeakPolarHBondContact OD1-CA 3.4Å; D83-G86 PolarHBondContact OD1-N 3.36Å; D83-G86 WeakPolarHBondContact OD2-CA 3.47Å; D83-G86 PolarHBondContact OD2-N 3.49Å
84	C	63.7	Low	53.4	Low	22 Å²	22	64.2 Å²	64.2	15%	0.149	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	92.4	170.1	-174.6	0	0	0	0	110.9	V82 G86 V87 S88 V90 C127	V82-C84 PolarHBondContact O-N 3.32Å; C84-G86 PolarHBondContact O-N 2.87Å; C84-V87 PolarHBondContact O-N 3.25Å; C84-V87 VanDerWaalsContact O-N 3.08Å; C84-S88 VanDerWaalsContact CB-O 3.29Å; C84-S88 WeakPolarHBondContact CB-O 3.13Å; C84-S88 PolarHBondContact N-O 2.91Å; C84-V90 HydrophobicContact CB-CG1 4.05Å; C84-V90 HydrophobicContact CB-CG2 4.36Å; C84-C127 HydrophobicContact CB-CB 3.71Å; C84-C127 WeakPolarHBondContact CB-SG 3.23Å; C84-C127 WeakPolarHBondContact SG-CB 3.31Å; C84-C127 CovalentContact SG-SG 2.02Å; C84-C127 PolarHBondContact SG-SG 2.77Å
85	R	61.9	Low	54	Low	209 Å²	209	58.7 Å²	58.7	79%	0.789	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	26.2	167.8	-58.4	-177.9	173.2	-173.7	-3	114.8	D83 V87	D83-R85 PolarHBondContact O-N 3.02Å; R85-V87 VanDerWaalsContact C-N 3.34Å
86	G	57.3	Low	54.7	Low	60 Å²	60	59.3 Å²	59.3	62%	0.619	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	18.5	-178.4	0	0	0	0	0	113.9	D83 C84	D83-G86 VanDerWaalsContact OD1-CA 3.26Å; D83-G86 WeakPolarHBondContact OD1-CA 3.4Å; D83-G86 PolarHBondContact OD1-N 3.36Å; D83-G86 WeakPolarHBondContact OD2-CA 3.47Å; D83-G86 PolarHBondContact OD2-N 3.49Å; C84-G86 PolarHBondContact O-N 2.87Å
87	V	56.4	Low	55.2	Low	102 Å²	102	55.7 Å²	55.7	62%	0.618	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-39.1	-173.8	-178.5	0	0	0	0	112.8	C84 R85 M129	C84-V87 PolarHBondContact O-N 3.25Å; C84-V87 VanDerWaalsContact O-N 3.08Å; R85-V87 VanDerWaalsContact C-N 3.34Å; V87-M129 HydrophobicContact CG1-CE 3.72Å; V87-M129 WeakPolarHBondContact O-CE 3.46Å
88	S	56.6	Low	55	Low	20 Å²	20	54.6 Å²	54.6	14%	0.14	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	138.1	178.2	-173.6	0	0	0	0	111.2	C84 Q128	C84-S88 VanDerWaalsContact CB-O 3.29Å; C84-S88 WeakPolarHBondContact CB-O 3.13Å; C84-S88 PolarHBondContact N-O 2.91Å; S88-Q128 PolarHBondContact OG-O 2.79Å
89	T	61.9	Low	55.4	Low	55 Å²	55	52.3 Å²	52.3	34%	0.337	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	125.3	170.9	55.5	0	0	0	0	110.1
90	V	60.3	Low	55.3	Low	1 Å²	1	48.3 Å²	48.3	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144.5	-178.9	-55.4	0	0	0	0	111.7	V82 C84 L124 C127 L134	V82-V90 HydrophobicContact CG2-CG2 3.67Å; V82-V90 PolarHBondContact N-O 3.23Å; V82-V90 PolarHBondContact O-N 3.46Å; C84-V90 HydrophobicContact CB-CG1 4.05Å; C84-V90 HydrophobicContact CB-CG2 4.36Å; V90-L124 HydrophobicContact CG2-CD1 3.6Å; V90-L124 HydrophobicContact CG2-CG 4.23Å; V90-C127 HydrophobicContact CG1-CB 4.31Å; V90-L134 HydrophobicContact CB-CD2 3.87Å; V90-L134 HydrophobicContact CG1-CD2 3.71Å
91	P	60.1	Low	55.2	Low	4 Å²	4	45.7 Å²	45.7	3%	0.026	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	137	177.3	31	-31.6	0	0	0	110.8	W81 P125 L134 Q135 V138	W81-P91 HydrophobicContact CZ3-CB 4.45Å; W81-P91 HydrophobicContact CZ3-CG 4.33Å; P91-P125 WeakPolarHBondContact O-CD 3.4Å; P91-L134 HydrophobicContact CG-CD2 4.48Å; P91-L134 HydrophobicContact CG-CG 4.37Å; P91-Q135 HydrophobicContact CG-CG 4.49Å; P91-V138 HydrophobicContact CG-CG2 4.17Å
92	C	59.8	Low	54.6	Low	0 Å²	0	44.7 Å²	44.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	130	175.8	167.1	0	0	0	0	109.9	L78 C121	L78-C92 HydrophobicContact CB-CB 4.18Å; L78-C92 HydrophobicContact CD2-CB 4.39Å; L78-C92 PolarHBondContact N-O 2.93Å; C92-C121 HydrophobicContact CB-CB 4.22Å; C92-C121 WeakPolarHBondContact CB-SG 3.48Å; C92-C121 WeakPolarHBondContact SG-CA 3.42Å; C92-C121 WeakPolarHBondContact SG-CB 3.29Å; C92-C121 CovalentContact SG-SG 2.04Å; C92-C121 PolarHBondContact SG-SG 3.24Å
93	L	60.7	Low	53.8	Low	1 Å²	1	51.9 Å²	51.9	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	128.5	168	-176.7	64.2	0	0	0	109.1	I77 V95 F122 Y123 V138 V141 K142	I77-L93 HydrophobicContact CG1-CD1 3.85Å; L93-V95 HydrophobicContact CG-CG2 4.27Å; L93-F122 HydrophobicContact CD2-CD1 4.37Å; L93-F122 WeakPolarHBondContact O-CB 3.15Å; L93-F122 PolarHBondContact O-N 3.11Å; L93-Y123 PolarHBondContact N-O 3.19Å; L93-Y123 VanDerWaalsContact N-O 3.15Å; L93-Y123 PolarHBondContact O-N 2.99Å; L93-V138 HydrophobicContact CB-CG1 4.09Å; L93-V138 HydrophobicContact CD1-CG1 4.36Å; L93-V141 HydrophobicContact CD2-CG1 3.98Å; L93-K142 HydrophobicContact CD1-CB 4.22Å; L93-K142 HydrophobicContact CD1-CG 4.33Å
94	T	58.3	Low	53.2	Low	14 Å²	14	53.5 Å²	53.5	9%	0.086	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	154.4	168.6	48.6	0	0	0	0	109.4	D76 L78	D76-T94 CarbonylContact O-C 3.54Å; D76-T94 PolarHBondContact O-N 3.46Å; D76-T94 PolarHBondContact O-OG1 2.78Å; L78-T94 HydrophobicContact CB-CG2 4.09Å; L78-T94 HydrophobicContact CD2-CG2 4.42Å
95	V	54.7	Low	52.1	Low	3 Å²	3	56.6 Å²	56.6	2%	0.018	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	127.7	178.8	-163.1	0	0	0	0	107.6	L72 T75 L93 L108 F122 V145	L72-V95 HydrophobicContact CD1-CG1 4.27Å; T75-V95 HydrophobicContact CG2-CG1 3.79Å; L93-V95 HydrophobicContact CG-CG2 4.27Å; V95-L108 HydrophobicContact CB-CB 4.29Å; V95-L108 HydrophobicContact CB-CD1 4.04Å; V95-L108 HydrophobicContact CG1-CD1 3.67Å; V95-L108 WeakPolarHBondContact O-CB 3.49Å; V95-L108 PolarHBondContact O-N 3.13Å; V95-F122 HydrophobicContact CB-CD2 3.95Å; V95-F122 HydrophobicContact CB-CE2 4.25Å; V95-F122 HydrophobicContact CB-CG 4.13Å; V95-F122 HydrophobicContact CG2-CB 3.93Å; V95-F122 HydrophobicContact CG2-CD1 3.52Å; V95-F122 HydrophobicContact CG2-CD2 3.76Å; V95-F122 HydrophobicContact CG2-CE1 3.86Å; V95-F122 HydrophobicContact CG2-CE2 4.07Å; V95-F122 HydrophobicContact CG2-CG 3.47Å; V95-F122 VanDerWaalsContact CG2-CG 3.47Å; V95-F122 HydrophobicContact CG2-CZ 4.12Å; V95-V145 HydrophobicContact CG1-CG1 4.39Å
96	T	52.3	Low	51.4	Low	30 Å²	30	47 Å²	47	18%	0.184	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	133.5	-170.6	-49.6	0	0	0	0	109.2	P73 A106	P73-T96 WeakPolarHBondContact CD-O 3.14Å; T96-A106 WeakPolarHBondContact CA-O 3.46Å; T96-A106 WeakPolarHBondContact CG2-O 3.29Å
97	V	50.2	Low	51.1	Low	2 Å²	2	48 Å²	48	1%	0.012	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	150.3	-178.7	-71.8	0	0	0	0	112.5	L72 S105 A106 L108 V166	L72-V97 HydrophobicContact CD1-CG1 3.86Å; V97-S105 WeakPolarHBondContact O-CA 3.46Å; V97-A106 PolarHBondContact N-O 3.11Å; V97-A106 PolarHBondContact O-N 3.13Å; V97-L108 HydrophobicContact CB-CD2 4.3Å; V97-L108 HydrophobicContact CB-CG 4.41Å; V97-L108 HydrophobicContact CG1-CD1 3.67Å; V97-L108 HydrophobicContact CG1-CD2 3.86Å; V97-L108 HydrophobicContact CG1-CG 3.75Å; V97-L108 HydrophobicContact CG2-CD2 3.47Å; V97-L108 VanDerWaalsContact CG2-CD2 3.47Å; V97-L108 HydrophobicContact CG2-CG 3.9Å; V97-V166 HydrophobicContact CG2-CB 4Å; V97-V166 HydrophobicContact CG2-CG1 3.96Å; V97-V166 HydrophobicContact CG2-CG2 4.3Å
98	S	44.1	Very low	50.7	Low	37 Å²	37	43.6 Å²	43.6	26%	0.259	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	123	162.7	45.5	0	0	0	0	108.6	V71 P73	V71-S98 PolarHBondContact N-O 3.11Å; V71-S98 PolarHBondContact O-OG 2.75Å; P73-S98 WeakPolarHBondContact CD-OG 3.49Å; P73-S98 WeakPolarHBondContact CG-OG 3.48Å
99	V	51.4	Low	50.4	Low	19 Å²	19	47.1 Å²	47.1	12%	0.115	28%	0.283	C	S	.	.			trans	-76.9	127.3	171.6	179.2	0	0	0	0	107.6	A68 G101 S102 V166	A68-V99 HydrophobicContact CB-CG1 4.35Å; V99-G101 VanDerWaalsContact C-N 3.34Å; V99-G101 PolarHBondContact O-N 2.81Å; V99-S102 PolarHBondContact O-N 3.03Å; V99-S102 VanDerWaalsContact O-N 3.07Å; V99-V166 HydrophobicContact CG2-CG2 4.19Å
100	T	40.1	Very low	49.5	Very low	93 Å²	93	48.9 Å²	48.9	57%	0.571	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	90.1	-175.9	-46.2	0	0	0	0	110.5	S69 V71	S69-T100 WeakPolarHBondContact O-CB 3.41Å; S69-T100 PolarHBondContact O-OG1 3.06Å; V71-T100 WeakPolarHBondContact CG2-OG1 3.46Å
101	G	42	Very low	48.6	Very low	84 Å²	84	52.7 Å²	52.7	87%	0.866	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	145.5	-22.6	-173.9	0	0	0	0	0	113.8	V99	V99-G101 VanDerWaalsContact C-N 3.34Å; V99-G101 PolarHBondContact O-N 2.81Å
102	S	41.7	Very low	47.7	Very low	49 Å²	49	60.4 Å²	60.4	34%	0.343	34%	0.342	S	S	.	.			trans	-107.8	149.2	166.8	66	0	0	0	0	110.5	V99 E104	V99-S102 PolarHBondContact O-N 3.03Å; V99-S102 VanDerWaalsContact O-N 3.07Å; S102-E104 PolarHBondContact O-N 2.93Å
103	N	42.5	Very low	46.6	Very low	179 Å²	179	66.9 Å²	66.9	96%	0.957	38%	0.377	S	S	*	.	S	Bend	trans	-94.1	24.7	177.6	-144.4	44.2	0	0	0	111.4
104	E	41.6	Very low	45.5	Very low	139 Å²	139	69.1 Å²	69.1	65%	0.65	39%	0.393	S	S	*	.			trans	-120.9	135.5	-170.2	-64.7	-179.5	133.2	0	0	109.8	S102	S102-E104 PolarHBondContact O-N 2.93Å
105	S	41.1	Very low	44.6	Very low	87 Å²	87	74.5 Å²	74.5	61%	0.608	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	110.9	-179.2	56.6	0	0	0	0	110.5	V97	V97-S105 WeakPolarHBondContact O-CA 3.46Å
106	A	46.7	Very low	44	Very low	7 Å²	7	82.6 Å²	82.6	6%	0.058	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	146.5	180	0	0	0	0	0	111.5	T96 V97 V166	T96-A106 WeakPolarHBondContact CA-O 3.46Å; T96-A106 WeakPolarHBondContact CG2-O 3.29Å; V97-A106 PolarHBondContact N-O 3.11Å; V97-A106 PolarHBondContact O-N 3.13Å; A106-V166 HydrophobicContact CB-CG2 3.65Å
107	F	49.9	Very low	43.8	Very low	81 Å²	81	84.2 Å²	84.2	36%	0.355	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	138.4	176.1	-71.5	-83.7	0	0	0	110.2	N164 V166	F107-N164 PolarHBondContact N-O 3.29Å; F107-N164 VanDerWaalsContact N-O 3.11Å; F107-V166 PolarHBondContact O-N 3.42Å; F107-V166 VanDerWaalsContact O-N 3.16Å
108	L	49.8	Very low	43.3	Very low	11 Å²	11	90.1 Å²	90.1	6%	0.058	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	133.1	171.1	-71.5	-177.9	0	0	0	110.6	V95 V97 F122 L149 V166 L168	V95-L108 HydrophobicContact CB-CB 4.29Å; V95-L108 HydrophobicContact CB-CD1 4.04Å; V95-L108 HydrophobicContact CG1-CD1 3.67Å; V95-L108 WeakPolarHBondContact O-CB 3.49Å; V95-L108 PolarHBondContact O-N 3.13Å; V97-L108 HydrophobicContact CB-CD2 4.3Å; V97-L108 HydrophobicContact CB-CG 4.41Å; V97-L108 HydrophobicContact CG1-CD1 3.67Å; V97-L108 HydrophobicContact CG1-CD2 3.86Å; V97-L108 HydrophobicContact CG1-CG 3.75Å; V97-L108 HydrophobicContact CG2-CD2 3.47Å; V97-L108 VanDerWaalsContact CG2-CD2 3.47Å; V97-L108 HydrophobicContact CG2-CG 3.9Å; L108-F122 HydrophobicContact CB-CD2 3.79Å; L108-F122 HydrophobicContact CB-CE2 3.88Å; L108-F122 HydrophobicContact CD1-CE2 4.19Å; L108-L149 HydrophobicContact CD1-CD2 4.26Å; L108-V166 HydrophobicContact CD2-CB 3.96Å; L108-V166 HydrophobicContact CD2-CG1 3.82Å; L108-V166 WeakPolarHBondContact CD2-O 3.36Å; L108-L168 HydrophobicContact CD1-CD1 3.62Å; L108-L168 HydrophobicContact CD2-CB 4.23Å; L108-L168 HydrophobicContact CD2-CD1 3.74Å; L108-L168 HydrophobicContact CG-CD1 4.37Å
109	Q	48.9	Very low	43.5	Very low	93 Å²	93	92.7 Å²	92.7	44%	0.435	52%	0.517	S	S	.	.			trans	-118.2	116.9	170.2	-159.3	161.7	0.4	0	0	108.1	H165 V166	Q109-H165 PolarHBondContact OE1-ND1 2.92Å; Q109-V166 PolarHBondContact N-O 3.31Å
110	F	43.6	Very low	43.4	Very low	93 Å²	93	98.8 Å²	98.8	41%	0.408	54%	0.544	S	S	.	.			trans	-80.4	-30	-166.5	-169.8	-105.5	0	0	0	114	F122 N169	F110-F122 HydrophobicContact CB-CD2 3.99Å; F110-F122 HydrophobicContact CB-CE1 4.47Å; F110-F122 HydrophobicContact CB-CE2 3.72Å; F110-F122 HydrophobicContact CB-CG 4.48Å; F110-F122 HydrophobicContact CB-CZ 3.98Å; F110-F122 HydrophobicContact CD2-CE1 4.32Å; F110-F122 AromaticContact CD2-CE2 3.83Å; F110-F122 HydrophobicContact CD2-CE2 3.83Å; F110-F122 AromaticContact CD2-CZ 3.5Å; F110-F122 HydrophobicContact CD2-CZ 3.5Å; F110-F122 VanDerWaalsContact CD2-CZ 3.5Å; F110-F122 HydrophobicContact CE2-CZ 4.28Å; F110-F122 HydrophobicContact CG-CE2 4.17Å; F110-F122 AromaticContact CG-CZ 3.98Å; F110-F122 HydrophobicContact CG-CZ 3.98Å; F110-N169 HydrophobicContact CE2-CB 4.44Å
111	D	42.1	Very low	44.1	Very low	80 Å²	80	95.4 Å²	95.4	43%	0.428	52%	0.524	S	S	.	.			trans	-149.9	131.3	-167.6	-159.2	-24.3	0	0	0	111.7	D113 S114	D111-D113 VanDerWaalsContact C-N 3.32Å; D111-D113 PolarHBondContact OD1-N 3.47Å; D111-S114 WeakPolarHBondContact O-CB 3.15Å; D111-S114 PolarHBondContact O-OG 2.85Å
112	E	40.3	Very low	44.8	Very low	166 Å²	166	92.9 Å²	92.9	78%	0.776	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-23.5	177	-64.8	-173.6	104.9	0	0	112.2	S114	E112-S114 PolarHBondContact O-N 3.05Å; E112-S114 VanDerWaalsContact O-N 3.14Å
113	D	35.9	Very low	45.4	Very low	137 Å²	137	94 Å²	94	73%	0.733	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	6.4	177.1	-80.2	-40.4	0	0	0	113.1	D111 V115	D111-D113 VanDerWaalsContact C-N 3.32Å; D111-D113 PolarHBondContact OD1-N 3.47Å; D113-V115 PolarHBondContact O-N 2.99Å
114	S	38	Very low	46.4	Very low	47 Å²	47	88.5 Å²	88.5	33%	0.329	46%	0.457	S	S	.	.			trans	-74	32.7	-179.2	-55.4	0	0	0	0	115.1	D111 E112 F116 L117	D111-S114 WeakPolarHBondContact O-CB 3.15Å; D111-S114 PolarHBondContact O-OG 2.85Å; E112-S114 PolarHBondContact O-N 3.05Å; E112-S114 VanDerWaalsContact O-N 3.14Å; S114-F116 PolarHBondContact O-N 3.03Å; S114-L117 PolarHBondContact O-N 2.97Å
115	V	40.3	Very low	47.4	Very low	128 Å²	128	82 Å²	82	78%	0.776	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	9.5	-170.7	-173.5	0	0	0	0	114.3	D113	D113-V115 PolarHBondContact O-N 2.99Å
116	F	40.8	Very low	48.5	Very low	173 Å²	173	86.8 Å²	86.8	76%	0.759	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.7	12	-175.1	-128.3	-85	0	0	0	115.4	S114	S114-F116 PolarHBondContact O-N 3.03Å
117	L	47.7	Very low	49.3	Very low	64 Å²	64	89.6 Å²	89.6	34%	0.335	46%	0.455	S	S	.	.			trans	-107.7	110.7	171.7	-70.7	85.8	0	0	0	109	S114 N119 C121 L124	S114-L117 PolarHBondContact O-N 2.97Å; L117-N119 VanDerWaalsContact C-N 3.27Å; L117-N119 PolarHBondContact O-N 3.28Å; L117-C121 HydrophobicContact CD2-CB 3.89Å; L117-L124 HydrophobicContact CD2-CB 3.77Å; L117-L124 HydrophobicContact CD2-CD2 4.05Å; L117-L124 HydrophobicContact CD2-CG 4.46Å; L117-L124 HydrophobicContact CG-CD2 4.36Å
118	P	41.4	Very low	50	Low	125 Å²	125	90.8 Å²	90.8	81%	0.812	46%	0.462	S	S	*	.			trans	-79.3	-8.5	-177.9	32.1	-35.7	0	0	0	113.9
119	N	47.1	Very low	50.6	Low	91 Å²	91	97 Å²	97	49%	0.487	49%	0.492	S	S	.	.	S	Bend	trans	-122.9	158.9	-178.4	-58.7	9.8	0	0	0	109.3	L117 C121	L117-N119 VanDerWaalsContact C-N 3.27Å; L117-N119 PolarHBondContact O-N 3.28Å; N119-C121 PolarHBondContact O-N 3.24Å
120	E	50.6	Low	51.7	Low	148 Å²	148	96.4 Å²	96.4	69%	0.692	49%	0.492	S	S	*	.			trans	-72.3	44	-165.2	-59.7	165.1	128.9	0	0	115.4
121	C	54.8	Low	52.8	Low	22 Å²	22	98.2 Å²	98.2	15%	0.149	50%	0.496	C	S	.	.			trans	-90	124.4	-173.9	-65.9	0	0	0	0	113.3	C92 L117 N119	C92-C121 HydrophobicContact CB-CB 4.22Å; C92-C121 WeakPolarHBondContact CB-SG 3.48Å; C92-C121 WeakPolarHBondContact SG-CA 3.42Å; C92-C121 WeakPolarHBondContact SG-CB 3.29Å; C92-C121 CovalentContact SG-SG 2.04Å; C92-C121 PolarHBondContact SG-SG 3.24Å; L117-C121 HydrophobicContact CD2-CB 3.89Å; N119-C121 PolarHBondContact O-N 3.24Å
122	F	54.9	Low	54.1	Low	31 Å²	31	102 Å²	102	14%	0.136	51%	0.509	C	S	.	.	S	Bend	trans	-74.2	-35.2	176.8	176.1	-83	0	0	0	112.6	L93 V95 L108 F110 V145	L93-F122 HydrophobicContact CD2-CD1 4.37Å; L93-F122 WeakPolarHBondContact O-CB 3.15Å; L93-F122 PolarHBondContact O-N 3.11Å; V95-F122 HydrophobicContact CB-CD2 3.95Å; V95-F122 HydrophobicContact CB-CE2 4.25Å; V95-F122 HydrophobicContact CB-CG 4.13Å; V95-F122 HydrophobicContact CG2-CB 3.93Å; V95-F122 HydrophobicContact CG2-CD1 3.52Å; V95-F122 HydrophobicContact CG2-CD2 3.76Å; V95-F122 HydrophobicContact CG2-CE1 3.86Å; V95-F122 HydrophobicContact CG2-CE2 4.07Å; V95-F122 HydrophobicContact CG2-CG 3.47Å; V95-F122 VanDerWaalsContact CG2-CG 3.47Å; V95-F122 HydrophobicContact CG2-CZ 4.12Å; L108-F122 HydrophobicContact CB-CD2 3.79Å; L108-F122 HydrophobicContact CB-CE2 3.88Å; L108-F122 HydrophobicContact CD1-CE2 4.19Å; F110-F122 HydrophobicContact CB-CD2 3.99Å; F110-F122 HydrophobicContact CB-CE1 4.47Å; F110-F122 HydrophobicContact CB-CE2 3.72Å; F110-F122 HydrophobicContact CB-CG 4.48Å; F110-F122 HydrophobicContact CB-CZ 3.98Å; F110-F122 HydrophobicContact CD2-CE1 4.32Å; F110-F122 AromaticContact CD2-CE2 3.83Å; F110-F122 HydrophobicContact CD2-CE2 3.83Å; F110-F122 AromaticContact CD2-CZ 3.5Å; F110-F122 HydrophobicContact CD2-CZ 3.5Å; F110-F122 VanDerWaalsContact CD2-CZ 3.5Å; F110-F122 HydrophobicContact CE2-CZ 4.28Å; F110-F122 HydrophobicContact CG-CE2 4.17Å; F110-F122 AromaticContact CG-CZ 3.98Å; F110-F122 HydrophobicContact CG-CZ 3.98Å; F122-V145 HydrophobicContact CE1-CG2 4.31Å
123	Y	55.6	Low	55.7	Low	71 Å²	71	95.3 Å²	95.3	28%	0.278	48%	0.484	S	S	.	.	B	Isolated β-bridge	trans	-146.5	133	174.2	176.2	-96.8	0	0	0	111	L93 P125 V138 V141	L93-Y123 PolarHBondContact N-O 3.19Å; L93-Y123 VanDerWaalsContact N-O 3.15Å; L93-Y123 PolarHBondContact O-N 2.99Å; Y123-P125 HydrophobicContact CE1-CB 3.97Å; Y123-V138 HydrophobicContact CD1-CG2 4.28Å; Y123-V138 HydrophobicContact CE1-CG2 4.19Å; Y123-V141 HydrophobicContact CD1-CG1 4.34Å; Y123-V141 HydrophobicContact CE1-CG2 4.13Å; Y123-V141 HydrophobicContact CG-CG1 4.41Å
124	L	63.5	Low	57.2	Low	64 Å²	64	88.9 Å²	88.9	34%	0.335	45%	0.45	S	S	.	.			trans	-124.6	114.8	177.6	-166	74	0	0	0	108.7	V82 V90 L117	V82-L124 HydrophobicContact CG2-CD1 3.64Å; V90-L124 HydrophobicContact CG2-CD1 3.6Å; V90-L124 HydrophobicContact CG2-CG 4.23Å; L117-L124 HydrophobicContact CD2-CB 3.77Å; L117-L124 HydrophobicContact CD2-CD2 4.05Å; L117-L124 HydrophobicContact CD2-CG 4.46Å; L117-L124 HydrophobicContact CG-CD2 4.36Å
125	P	63.1	Low	58.6	Low	3 Å²	3	91.4 Å²	91.4	2%	0.019	46%	0.456	C	S	.	.			trans	-72.1	164.8	-178.6	32.2	-37.3	0	0	0	111.6	P91 Y123 C127 L134 V138	P91-P125 WeakPolarHBondContact O-CD 3.4Å; Y123-P125 HydrophobicContact CE1-CB 3.97Å; P125-C127 PolarHBondContact O-N 3.49Å; P125-L134 HydrophobicContact CB-CD1 3.58Å; P125-L134 HydrophobicContact CB-CG 4.26Å; P125-L134 HydrophobicContact CG-CD1 3.57Å; P125-L134 HydrophobicContact CG-CD2 4.32Å; P125-L134 HydrophobicContact CG-CG 3.74Å; P125-V138 HydrophobicContact CB-CG2 4.27Å; P125-V138 HydrophobicContact CG-CG2 3.77Å
126	K	63.8	Low	60.2	Low	188 Å²	188	90.5 Å²	90.5	82%	0.817	45%	0.447	S	S	*	.			trans	-66.7	129.9	179.7	-69.3	180	-178.3	174.9	0	110.3	Q128 L134	K126-Q128 PolarHBondContact O-N 3.28Å; K126-L134 WeakPolarHBondContact O-CD1 3.24Å
127	C	63.1	Low	61.5	Low	66 Å²	66	86.3 Å²	86.3	45%	0.446	43%	0.43	S	S	.	.			trans	-61.7	113.4	-173.7	-47.3	0	0	0	0	111.8	C84 V90 P125	C84-C127 HydrophobicContact CB-CB 3.71Å; C84-C127 WeakPolarHBondContact CB-SG 3.23Å; C84-C127 WeakPolarHBondContact SG-CB 3.31Å; C84-C127 CovalentContact SG-SG 2.02Å; C84-C127 PolarHBondContact SG-SG 2.77Å; V90-C127 HydrophobicContact CG1-CB 4.31Å; P125-C127 PolarHBondContact O-N 3.49Å
128	Q	64.3	Low	62.5	Low	105 Å²	105	83.3 Å²	83.3	49%	0.491	41%	0.414	S	S	.	.			trans	-133.7	158.8	-174.7	-162.3	-180	66.5	0	0	109.2	S88 K126 L134	S88-Q128 PolarHBondContact OG-O 2.79Å; K126-Q128 PolarHBondContact O-N 3.28Å; Q128-L134 HydrophobicContact CB-CD1 4.36Å
129	M	62	Low	63.7	Low	141 Å²	141	81.5 Å²	81.5	70%	0.695	40%	0.395	S	S	*	.	S	Bend	trans	-86	-16.6	177.1	-64.8	-62.6	-171.2	0	0	113.5	V87 R131	V87-M129 HydrophobicContact CG1-CE 3.72Å; V87-M129 WeakPolarHBondContact O-CE 3.46Å; M129-R131 PolarHBondContact O-N 3.48Å
130	D	72.9	Confident	64.9	Low	82 Å²	82	84.7 Å²	84.7	44%	0.439	40%	0.404	S	S	.	.			trans	-78.1	90.9	175.3	-178.9	7.4	0	0	0	110.7	K132 G133 L134	D130-K132 PolarHBondContact O-N 3.23Å; D130-K132 VanDerWaalsContact O-N 3.12Å; D130-K132 PolarHBondContact OD1-N 2.72Å; D130-G133 VanDerWaalsContact CG-N 3.26Å; D130-G133 PolarHBondContact O-N 2.76Å; D130-G133 PolarHBondContact OD1-N 3.18Å; D130-G133 VanDerWaalsContact OD1-N 3.1Å; D130-G133 WeakPolarHBondContact OD2-CA 3.38Å; D130-G133 PolarHBondContact OD2-N 3.3Å; D130-L134 VanDerWaalsContact O-CB 3.3Å; D130-L134 WeakPolarHBondContact O-CB 3.31Å; D130-L134 PolarHBondContact O-N 2.88Å
131	R	65.8	Low	65.7	Low	130 Å²	130	79.3 Å²	79.3	49%	0.491	38%	0.382	S	S	.	.	H	α-helix	trans	-59	-20.5	177.9	-165.8	169.4	-176.5	144.8	1.9	113.8	W81 M129	W81-R131 VanDerWaalsContact CD2-NH2 3.3Å; W81-R131 HydrophobicContact CH2-CG 3.46Å; W81-R131 VanDerWaalsContact CH2-CG 3.46Å; W81-R131 HydrophobicContact CZ2-CG 4.48Å; W81-R131 HydrophobicContact CZ3-CG 3.64Å; M129-R131 PolarHBondContact O-N 3.48Å
132	K	69.9	Low	66.3	Low	161 Å²	161	80.2 Å²	80.2	70%	0.7	38%	0.383	S	S	*	.	H	α-helix	trans	-89.3	-51.5	178.1	-67.8	-173.6	178.3	-176.8	0	111.6	D130 L134 Q135 D136	D130-K132 PolarHBondContact O-N 3.23Å; D130-K132 VanDerWaalsContact O-N 3.12Å; D130-K132 PolarHBondContact OD1-N 2.72Å; K132-L134 PolarHBondContact O-N 3.29Å; K132-Q135 PolarHBondContact O-N 3.48Å; K132-D136 PolarHBondContact O-N 3.22Å
133	G	73.4	Confident	66.9	Low	24 Å²	24	84.7 Å²	84.7	25%	0.247	40%	0.403	C	S	.	.	H	α-helix	trans	-54	-36.1	174.5	0	0	0	0	0	112.6	D130 D136 E137	D130-G133 VanDerWaalsContact CG-N 3.26Å; D130-G133 PolarHBondContact O-N 2.76Å; D130-G133 PolarHBondContact OD1-N 3.18Å; D130-G133 VanDerWaalsContact OD1-N 3.1Å; D130-G133 WeakPolarHBondContact OD2-CA 3.38Å; D130-G133 PolarHBondContact OD2-N 3.3Å; G133-D136 PolarHBondContact O-N 3.03Å; G133-E137 WeakPolarHBondContact O-CB 3.31Å; G133-E137 PolarHBondContact O-N 3.42Å
134	L	68.4	Low	67.4	Low	2 Å²	2	88.8 Å²	88.8	1%	0.01	42%	0.418	C	S	.	.	H	α-helix	trans	-68.4	-35.5	176.2	-154.4	68.7	0	0	0	113.6	V90 P91 P125 K126 Q128 D130 K132 V138	V90-L134 HydrophobicContact CB-CD2 3.87Å; V90-L134 HydrophobicContact CG1-CD2 3.71Å; P91-L134 HydrophobicContact CG-CD2 4.48Å; P91-L134 HydrophobicContact CG-CG 4.37Å; P125-L134 HydrophobicContact CB-CD1 3.58Å; P125-L134 HydrophobicContact CB-CG 4.26Å; P125-L134 HydrophobicContact CG-CD1 3.57Å; P125-L134 HydrophobicContact CG-CD2 4.32Å; P125-L134 HydrophobicContact CG-CG 3.74Å; K126-L134 WeakPolarHBondContact O-CD1 3.24Å; Q128-L134 HydrophobicContact CB-CD1 4.36Å; D130-L134 VanDerWaalsContact O-CB 3.3Å; D130-L134 WeakPolarHBondContact O-CB 3.31Å; D130-L134 PolarHBondContact O-N 2.88Å; K132-L134 PolarHBondContact O-N 3.29Å; L134-V138 WeakPolarHBondContact O-CG2 3.48Å; L134-V138 PolarHBondContact O-N 2.92Å
135	Q	66.6	Low	67.4	Low	100 Å²	100	86.2 Å²	86.2	47%	0.467	40%	0.404	S	S	.	.	H	α-helix	trans	-73.1	-40.1	172.2	-79	-167.5	-38	0	0	111.8	W81 P91 K132 E137 V138 Q139	W81-Q135 HydrophobicContact CH2-CG 3.97Å; W81-Q135 HydrophobicContact CZ2-CG 4.46Å; P91-Q135 HydrophobicContact CG-CG 4.49Å; K132-Q135 PolarHBondContact O-N 3.48Å; Q135-E137 VanDerWaalsContact C-N 3.34Å; Q135-E137 PolarHBondContact O-N 3.48Å; Q135-V138 PolarHBondContact O-N 3.26Å; Q135-Q139 VanDerWaalsContact O-CB 3.28Å; Q135-Q139 WeakPolarHBondContact O-CB 3.4Å; Q135-Q139 PolarHBondContact O-N 3.45Å
136	D	73.4	Confident	67.4	Low	109 Å²	109	88.4 Å²	88.4	58%	0.583	42%	0.416	S	S	*	.	H	α-helix	trans	-63.9	-38	176.1	-78.8	-25.8	0	0	0	111.7	K132 G133 K140	K132-D136 PolarHBondContact O-N 3.22Å; G133-D136 PolarHBondContact O-N 3.03Å; D136-K140 WeakPolarHBondContact O-CB 3.31Å; D136-K140 PolarHBondContact O-N 2.89Å
137	E	69.3	Low	67.2	Low	86 Å²	86	80.9 Å²	80.9	40%	0.402	39%	0.392	S	S	.	.	H	α-helix	trans	-61.8	-52.1	172.7	-177	167.2	-137.2	0	0	111.3	G133 Q135 Q139 K140 V141	G133-E137 WeakPolarHBondContact O-CB 3.31Å; G133-E137 PolarHBondContact O-N 3.42Å; Q135-E137 VanDerWaalsContact C-N 3.34Å; Q135-E137 PolarHBondContact O-N 3.48Å; E137-Q139 PolarHBondContact O-N 3.34Å; E137-K140 WeakPolarHBondContact O-CB 3.44Å; E137-K140 PolarHBondContact O-N 3.3Å; E137-V141 WeakPolarHBondContact O-CG2 3.31Å; E137-V141 PolarHBondContact O-N 2.85Å
138	V	67.5	Low	66.9	Low	1 Å²	1	82.3 Å²	82.3	1%	0.006	39%	0.392	C	S	.	.	H	α-helix	trans	-63.9	-40.1	178.9	169.8	0	0	0	0	112.1	I77 P91 L93 Y123 P125 L134 Q135 K140 V141 K142	I77-V138 HydrophobicContact CD1-CG1 4.25Å; I77-V138 HydrophobicContact CG1-CG1 4.26Å; I77-V138 HydrophobicContact CG2-CG1 4.49Å; P91-V138 HydrophobicContact CG-CG2 4.17Å; L93-V138 HydrophobicContact CB-CG1 4.09Å; L93-V138 HydrophobicContact CD1-CG1 4.36Å; Y123-V138 HydrophobicContact CD1-CG2 4.28Å; Y123-V138 HydrophobicContact CE1-CG2 4.19Å; P125-V138 HydrophobicContact CB-CG2 4.27Å; P125-V138 HydrophobicContact CG-CG2 3.77Å; L134-V138 WeakPolarHBondContact O-CG2 3.48Å; L134-V138 PolarHBondContact O-N 2.92Å; Q135-V138 PolarHBondContact O-N 3.26Å; V138-K140 VanDerWaalsContact C-N 3.32Å; V138-K140 PolarHBondContact O-N 2.87Å; V138-V141 PolarHBondContact O-N 3.43Å; V138-K142 WeakPolarHBondContact O-CB 3.15Å; V138-K142 PolarHBondContact O-N 3.01Å
139	Q	67.6	Low	66.5	Low	86 Å²	86	78.5 Å²	78.5	40%	0.402	38%	0.375	S	S	.	.	H	α-helix	trans	-68.5	-32.2	177.5	-158	-163	51.6	0	0	112	Q135 E137 K143	Q135-Q139 VanDerWaalsContact O-CB 3.28Å; Q135-Q139 WeakPolarHBondContact O-CB 3.4Å; Q135-Q139 PolarHBondContact O-N 3.45Å; E137-Q139 PolarHBondContact O-N 3.34Å; Q139-K143 WeakPolarHBondContact O-CB 2.93Å; Q139-K143 WeakPolarHBondContact O-CD 3.41Å; Q139-K143 VanDerWaalsContact O-CG 3.29Å; Q139-K143 WeakPolarHBondContact O-CG 3.31Å; Q139-K143 PolarHBondContact O-N 3.43Å
140	K	73.1	Confident	66	Low	158 Å²	158	80.4 Å²	80.4	69%	0.687	38%	0.379	S	S	*	.	H	α-helix	trans	-69.3	-41.4	172.7	-179.7	-177.4	178.3	-175.1	0	111.7	D136 E137 V138 W144	D136-K140 WeakPolarHBondContact O-CB 3.31Å; D136-K140 PolarHBondContact O-N 2.89Å; E137-K140 WeakPolarHBondContact O-CB 3.44Å; E137-K140 PolarHBondContact O-N 3.3Å; V138-K140 VanDerWaalsContact C-N 3.32Å; V138-K140 PolarHBondContact O-N 2.87Å; K140-W144 PolarHBondContact O-N 3.18Å; K140-W144 VanDerWaalsContact O-N 3.13Å
141	V	66.6	Low	64.6	Low	35 Å²	35	82.7 Å²	82.7	21%	0.212	39%	0.392	C	S	.	.	H	α-helix	trans	-62.4	-47.1	172.5	171.8	0	0	0	0	110.4	L93 Y123 E137 V138 K143 W144 V145	L93-V141 HydrophobicContact CD2-CG1 3.98Å; Y123-V141 HydrophobicContact CD1-CG1 4.34Å; Y123-V141 HydrophobicContact CE1-CG2 4.13Å; Y123-V141 HydrophobicContact CG-CG1 4.41Å; E137-V141 WeakPolarHBondContact O-CG2 3.31Å; E137-V141 PolarHBondContact O-N 2.85Å; V138-V141 PolarHBondContact O-N 3.43Å; V141-K143 PolarHBondContact O-N 2.81Å; V141-W144 WeakPolarHBondContact O-CB 3.33Å; V141-W144 PolarHBondContact O-N 2.8Å; V141-W144 VanDerWaalsContact O-N 3.11Å; V141-V145 HydrophobicContact CG1-CG2 4.36Å; V141-V145 WeakPolarHBondContact O-CG2 3.34Å; V141-V145 PolarHBondContact O-N 2.8Å
142	K	67.4	Low	63.6	Low	42 Å²	42	82 Å²	82	18%	0.183	41%	0.407	C	S	.	.	H	α-helix	trans	-53	-56.2	175.3	-173.3	-175.3	-176.9	174.8	0	111.7	T75 I77 L93 V138 W144 V145 D146	T75-K142 WeakPolarHBondContact O-CE 3.12Å; T75-K142 PolarHBondContact O-NZ 3.45Å; T75-K142 WeakPolarHBondContact OG1-CE 3.37Å; I77-K142 HydrophobicContact CD1-CD 4.16Å; I77-K142 HydrophobicContact CG1-CD 4.1Å; L93-K142 HydrophobicContact CD1-CB 4.22Å; L93-K142 HydrophobicContact CD1-CG 4.33Å; V138-K142 WeakPolarHBondContact O-CB 3.15Å; V138-K142 PolarHBondContact O-N 3.01Å; K142-W144 PolarHBondContact O-N 3.36Å; K142-W144 VanDerWaalsContact O-N 3.13Å; K142-V145 PolarHBondContact O-N 3.39Å; K142-D146 PolarHBondContact O-N 3.39Å
143	K	67.1	Low	62.4	Low	125 Å²	125	76.2 Å²	76.2	54%	0.543	39%	0.387	S	S	.	.	H	α-helix	trans	-56.5	-31.4	178.7	-73.8	165	178.6	165	0	113.2	Q139 V141 G147	Q139-K143 WeakPolarHBondContact O-CB 2.93Å; Q139-K143 WeakPolarHBondContact O-CD 3.41Å; Q139-K143 VanDerWaalsContact O-CG 3.29Å; Q139-K143 WeakPolarHBondContact O-CG 3.31Å; Q139-K143 PolarHBondContact O-N 3.43Å; V141-K143 PolarHBondContact O-N 2.81Å; K143-G147 PolarHBondContact O-N 3.3Å
144	W	66.4	Low	60.9	Low	157 Å²	157	77.5 Å²	77.5	60%	0.595	40%	0.395	S	S	*	.	H	α-helix	trans	-74.4	-44.8	174.8	-178	85.9	0	0	0	112.1	K140 V141 K142 G147 Q148	K140-W144 PolarHBondContact O-N 3.18Å; K140-W144 VanDerWaalsContact O-N 3.13Å; V141-W144 WeakPolarHBondContact O-CB 3.33Å; V141-W144 PolarHBondContact O-N 2.8Å; V141-W144 VanDerWaalsContact O-N 3.11Å; K142-W144 PolarHBondContact O-N 3.36Å; K142-W144 VanDerWaalsContact O-N 3.13Å; W144-G147 CarbonylContact O-C 3.58Å; W144-G147 PolarHBondContact O-N 2.96Å; W144-Q148 HydrophobicContact CD2-CG 4.07Å; W144-Q148 HydrophobicContact CE3-CG 4.23Å; W144-Q148 HydrophobicContact CH2-CG 3.91Å; W144-Q148 HydrophobicContact CZ2-CG 3.73Å; W144-Q148 HydrophobicContact CZ3-CG 4.15Å; W144-Q148 WeakPolarHBondContact O-CG 3.47Å; W144-Q148 PolarHBondContact O-N 3.42Å
145	V	63.5	Low	59.7	Low	9 Å²	9	77.6 Å²	77.6	6%	0.055	40%	0.396	C	S	.	.	H	α-helix	trans	-60.8	-48.1	175.1	173.7	0	0	0	0	111	V95 F122 V141 K142 G147 Q148 L149	V95-V145 HydrophobicContact CG1-CG1 4.39Å; F122-V145 HydrophobicContact CE1-CG2 4.31Å; V141-V145 HydrophobicContact CG1-CG2 4.36Å; V141-V145 WeakPolarHBondContact O-CG2 3.34Å; V141-V145 PolarHBondContact O-N 2.8Å; K142-V145 PolarHBondContact O-N 3.39Å; V145-G147 PolarHBondContact O-N 2.89Å; V145-Q148 PolarHBondContact O-N 3.17Å; V145-L149 HydrophobicContact CG1-CD1 4.21Å; V145-L149 PolarHBondContact O-N 2.96Å
146	D	63.6	Low	58.6	Low	49 Å²	49	75.8 Å²	75.8	26%	0.262	39%	0.386	S	S	.	.	H	α-helix	trans	-53.1	-44.8	174.9	-61.4	-25.4	0	0	0	110.9	T75 K142 K150	T75-D146 WeakPolarHBondContact CB-OD1 3.25Å; T75-D146 VanDerWaalsContact CG2-OD1 3.25Å; T75-D146 WeakPolarHBondContact CG2-OD1 3.42Å; T75-D146 PolarHBondContact OG1-OD1 3.07Å; K142-D146 PolarHBondContact O-N 3.39Å; D146-K150 WeakPolarHBondContact O-CB 3.46Å; D146-K150 PolarHBondContact O-N 3.08Å; D146-K150 VanDerWaalsContact O-N 3.11Å
147	G	60	Low	57	Low	31 Å²	31	72.2 Å²	72.2	32%	0.32	37%	0.37	S	S	.	.	H	α-helix	trans	-72.7	-20.5	178.5	0	0	0	0	0	115.2	K143 W144 V145 N151	K143-G147 PolarHBondContact O-N 3.3Å; W144-G147 CarbonylContact O-C 3.58Å; W144-G147 PolarHBondContact O-N 2.96Å; V145-G147 PolarHBondContact O-N 2.89Å; G147-N151 PolarHBondContact O-ND2 2.97Å
148	Q	57	Low	55.4	Low	95 Å²	95	70.2 Å²	70.2	44%	0.444	36%	0.362	S	S	.	.	H	α-helix	trans	-82.7	-50	172.7	-70.3	-62.6	-83.3	0	0	111.2	W144 V145 K150 N151	W144-Q148 HydrophobicContact CD2-CG 4.07Å; W144-Q148 HydrophobicContact CE3-CG 4.23Å; W144-Q148 HydrophobicContact CH2-CG 3.91Å; W144-Q148 HydrophobicContact CZ2-CG 3.73Å; W144-Q148 HydrophobicContact CZ3-CG 4.15Å; W144-Q148 WeakPolarHBondContact O-CG 3.47Å; W144-Q148 PolarHBondContact O-N 3.42Å; V145-Q148 PolarHBondContact O-N 3.17Å; Q148-K150 PolarHBondContact O-N 3.46Å; Q148-N151 PolarHBondContact O-N 3.32Å
149	L	56.1	Low	54.1	Low	25 Å²	25	78.8 Å²	78.8	13%	0.131	40%	0.402	C	S	.	.	H	α-helix	trans	-72.5	-31.6	-174.3	-86.7	64.1	0	0	0	112.5	L72 L108 V145 N151 S152 L168	L72-L149 HydrophobicContact CB-CB 4.17Å; L72-L149 HydrophobicContact CB-CD2 4.23Å; L72-L149 HydrophobicContact CD1-CD2 3.93Å; L72-L149 HydrophobicContact CD2-CB 3.62Å; L72-L149 HydrophobicContact CD2-CD2 3.88Å; L72-L149 HydrophobicContact CD2-CG 4.41Å; L72-L149 HydrophobicContact CG-CB 4.47Å; L72-L149 HydrophobicContact CG-CD2 4.24Å; L108-L149 HydrophobicContact CD1-CD2 4.26Å; V145-L149 HydrophobicContact CG1-CD1 4.21Å; V145-L149 PolarHBondContact O-N 2.96Å; L149-N151 PolarHBondContact O-N 2.85Å; L149-N151 VanDerWaalsContact O-N 3.14Å; L149-S152 PolarHBondContact O-N 2.83Å; L149-L168 HydrophobicContact CD1-CD2 4Å; L149-L168 HydrophobicContact CD2-CD1 3.8Å; L149-L168 HydrophobicContact CG-CD1 4.29Å; L149-L168 HydrophobicContact CG-CD2 4.49Å
150	K	50.9	Low	52.7	Low	182 Å²	182	82.9 Å²	82.9	79%	0.791	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.3	173	-170.9	169.8	-176	174.3	0	113.9	D146 Q148	D146-K150 WeakPolarHBondContact O-CB 3.46Å; D146-K150 PolarHBondContact O-N 3.08Å; D146-K150 VanDerWaalsContact O-N 3.11Å; Q148-K150 PolarHBondContact O-N 3.46Å
151	N	42.9	Very low	51.1	Low	130 Å²	130	77.3 Å²	77.3	70%	0.695	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	27.9	178.1	-71.5	-52	0	0	0	113	G147 Q148 L149	G147-N151 PolarHBondContact O-ND2 2.97Å; Q148-N151 PolarHBondContact O-N 3.32Å; L149-N151 PolarHBondContact O-N 2.85Å; L149-N151 VanDerWaalsContact O-N 3.14Å
152	S	45.1	Very low	49.7	Very low	116 Å²	116	82.4 Å²	82.4	81%	0.811	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	84.1	176.1	-59.6	0	0	0	0	115.1	L149	L149-S152 PolarHBondContact O-N 2.83Å
153	S	44.1	Very low	48.4	Very low	39 Å²	39	85.1 Å²	85.1	27%	0.273	45%	0.449	S	S	.	.			trans	-91.8	122.4	161.2	-45.8	0	0	0	0	109.3	C155	S153-C155 PolarHBondContact O-SG 3.06Å
154	A	41.7	Very low	47	Very low	51 Å²	51	83.8 Å²	83.8	42%	0.421	45%	0.448	S	S	.	.			trans	-63.3	140.7	165.6	0	0	0	0	0	109.4	E67	E67-A154 WeakPolarHBondContact OE1-CB 3.46Å
155	C	44.7	Very low	45.6	Very low	4 Å²	4	80.6 Å²	80.6	3%	0.027	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	152.8	-176.9	-53.3	0	0	0	0	108.8	C70 S153 L168	C70-C155 HydrophobicContact CB-CB 3.72Å; S153-C155 PolarHBondContact O-SG 3.06Å; C155-L168 HydrophobicContact CB-CD1 4.44Å; C155-L168 HydrophobicContact CB-CG 4.46Å; C155-L168 WeakPolarHBondContact SG-CD1 3.32Å
156	F	43	Very low	44.5	Very low	61 Å²	61	80.2 Å²	80.2	27%	0.268	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.4	-176.4	-60.3	-88.3	0	0	0	108.9	W65 E67	W65-F156 HydrophobicContact CB-CB 4.17Å; W65-F156 HydrophobicContact CB-CD1 4.04Å; W65-F156 HydrophobicContact CD2-CB 4.07Å; W65-F156 HydrophobicContact CE3-CB 3.64Å; W65-F156 HydrophobicContact CG-CB 4.29Å; W65-F156 HydrophobicContact CZ3-CB 4.35Å; W65-F156 VanDerWaalsContact CZ3-O 3.31Å; W65-F156 WeakPolarHBondContact CZ3-O 3.42Å; E67-F156 VanDerWaalsContact OE1-CZ 3.29Å; E67-F156 WeakPolarHBondContact OE1-CZ 3.16Å
157	S	39.3	Very low	43.6	Very low	34 Å²	34	80.7 Å²	80.7	24%	0.238	44%	0.439	C	S	.	.			trans	-118.6	131.3	175.9	-163.9	0	0	0	0	110.6	W65	W65-S157 VanDerWaalsContact CZ3-C 3.46Å
158	D	37	Very low	42.8	Very low	45 Å²	45	80.2 Å²	80.2	24%	0.241	43%	0.429	C	S	.	.			trans	-90.9	124.9	174.9	167.7	32.9	0	0	0	108.6	W65 K160 G161	W65-D158 HydrophobicContact CD2-CB 4.3Å; W65-D158 HydrophobicContact CE3-CB 3.91Å; W65-D158 HydrophobicContact CH2-CB 3.66Å; W65-D158 HydrophobicContact CZ2-CB 4.05Å; W65-D158 HydrophobicContact CZ3-CB 3.6Å; D158-K160 PolarHBondContact OD1-N 3.23Å; D158-G161 WeakPolarHBondContact OD2-CA 3.38Å; D158-G161 PolarHBondContact OD2-N 3.37Å
159	Q	38.3	Very low	41.9	Very low	180 Å²	180	79.3 Å²	79.3	84%	0.841	43%	0.427	S	S	*	.	S	Bend	trans	-93.1	1.1	-176	-153.2	-179	94	0	0	112.8
160	K	38.1	Very low	41.1	Very low	172 Å²	172	83.8 Å²	83.8	75%	0.748	44%	0.442	S	S	*	.	S	Bend	trans	-124.8	-22.6	-170.6	-76.6	169.3	-179.4	156	0	115.8	D158	D158-K160 PolarHBondContact OD1-N 3.23Å
161	G	41.3	Very low	40.5	Very low	42 Å²	42	82.5 Å²	82.5	43%	0.433	44%	0.437	S	S	.	.	S	Bend	trans	-86.1	-79	176.8	0	0	0	0	0	113.4	D158	D158-G161 WeakPolarHBondContact OD2-CA 3.38Å; D158-G161 PolarHBondContact OD2-N 3.37Å
162	H	35.8	Very low	40.5	Very low	142 Å²	142	83.9 Å²	83.9	66%	0.657	43%	0.433	S	S	*	.			trans	-142.4	121.8	-171.9	-61.8	84.2	0	0	0	111	N164	H162-N164 VanDerWaalsContact C-N 3.26Å; H162-N164 PolarHBondContact O-N 2.85Å; H162-N164 VanDerWaalsContact O-N 3.15Å
163	P	40.3	Very low	40.8	Very low	99 Å²	99	81 Å²	81	64%	0.643	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-13.1	-169	27	-35.4	0	0	0	115.6
164	N	37.3	Very low	41.1	Very low	96 Å²	96	85.2 Å²	85.2	51%	0.513	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-6.1	-169	-69.4	6.7	0	0	0	115.3	F107 H162	F107-N164 PolarHBondContact N-O 3.29Å; F107-N164 VanDerWaalsContact N-O 3.11Å; H162-N164 VanDerWaalsContact C-N 3.26Å; H162-N164 PolarHBondContact O-N 2.85Å; H162-N164 VanDerWaalsContact O-N 3.15Å
165	H	37.6	Very low	41.7	Very low	91 Å²	91	89.6 Å²	89.6	42%	0.421	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	108.2	-170.7	-58.5	-95.8	0	0	0	111.6	Q109	Q109-H165 PolarHBondContact OE1-ND1 2.92Å
166	V	41	Very low	42.3	Very low	0 Å²	0	97.2 Å²	97.2	0%	0	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.9	177.1	175	0	0	0	0	110.5	V97 V99 A106 F107 L108 Q109	V97-V166 HydrophobicContact CG2-CB 4Å; V97-V166 HydrophobicContact CG2-CG1 3.96Å; V97-V166 HydrophobicContact CG2-CG2 4.3Å; V99-V166 HydrophobicContact CG2-CG2 4.19Å; A106-V166 HydrophobicContact CB-CG2 3.65Å; F107-V166 PolarHBondContact O-N 3.42Å; F107-V166 VanDerWaalsContact O-N 3.16Å; L108-V166 HydrophobicContact CD2-CB 3.96Å; L108-V166 HydrophobicContact CD2-CG1 3.82Å; L108-V166 WeakPolarHBondContact CD2-O 3.36Å; Q109-V166 PolarHBondContact N-O 3.31Å
167	I	43.9	Very low	43.2	Very low	60 Å²	60	95 Å²	95	31%	0.308	46%	0.463	S	S	.	.	B	Isolated β-bridge	trans	-110	115.2	-171.8	-58	178	0	0	0	109.4	W65	W65-I167 HydrophobicContact CH2-CD1 4.09Å; W65-I167 HydrophobicContact CH2-CG1 4.47Å
168	L	43.5	Very low	44.3	Very low	21 Å²	21	98.7 Å²	98.7	11%	0.11	48%	0.48	C	S	.	.			trans	-95.2	-21	-159.7	-161.9	131.5	0	0	0	116	L108 L149 C155	L108-L168 HydrophobicContact CD1-CD1 3.62Å; L108-L168 HydrophobicContact CD2-CB 4.23Å; L108-L168 HydrophobicContact CD2-CD1 3.74Å; L108-L168 HydrophobicContact CG-CD1 4.37Å; L149-L168 HydrophobicContact CD1-CD2 4Å; L149-L168 HydrophobicContact CD2-CD1 3.8Å; L149-L168 HydrophobicContact CG-CD1 4.29Å; L149-L168 HydrophobicContact CG-CD2 4.49Å; C155-L168 HydrophobicContact CB-CD1 4.44Å; C155-L168 HydrophobicContact CB-CG 4.46Å; C155-L168 WeakPolarHBondContact SG-CD1 3.32Å
169	N	37.8	Very low	45.7	Very low	76 Å²	76	104 Å²	104	41%	0.406	50%	0.5	S	S	.	.			trans	-150.8	76.2	-162	-169.4	23.9	0	0	0	115.2	F110 K171	F110-N169 HydrophobicContact CE2-CB 4.44Å; N169-K171 PolarHBondContact O-N 2.87Å; N169-K171 WeakPolarHBondContact OD1-CB 3.36Å
170	R	40	Very low	47.1	Very low	118 Å²	118	96.7 Å²	96.7	45%	0.445	47%	0.474	S	S	.	.			trans	-75.6	41.5	179.3	-154.3	177.8	-177.2	-172.2	2.2	114.8	P59 Y172 T173	P59-R170 VanDerWaalsContact CB-NH2 3.27Å; P59-R170 PolarHBondContact O-NH1 3.41Å; P59-R170 PolarHBondContact O-NH2 2.9Å; P59-R170 VanDerWaalsContact O-NH2 3.11Å; R170-Y172 VanDerWaalsContact C-N 3.3Å; R170-Y172 PolarHBondContact O-N 3.29Å; R170-T173 WeakPolarHBondContact CG-OG1 3.42Å; R170-T173 PolarHBondContact NE-OG1 3.27Å
171	K	38.3	Very low	48.6	Very low	156 Å²	156	90.3 Å²	90.3	68%	0.678	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-25.2	-171.9	-154.5	157.6	-171	162.2	0	114.4	N169	N169-K171 PolarHBondContact O-N 2.87Å; N169-K171 WeakPolarHBondContact OD1-CB 3.36Å
172	Y	42	Very low	50.2	Low	158 Å²	158	92.7 Å²	92.7	62%	0.62	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-24.1	-173.1	-102.8	-70.7	0	0	0	115.6	R170 R176	R170-Y172 VanDerWaalsContact C-N 3.3Å; R170-Y172 PolarHBondContact O-N 3.29Å; Y172-R176 HydrophobicContact CD1-CG 4.11Å; Y172-R176 VanDerWaalsContact O-CB 3.31Å; Y172-R176 WeakPolarHBondContact O-CB 3.4Å; Y172-R176 VanDerWaalsContact O-CG 3.31Å; Y172-R176 WeakPolarHBondContact O-CG 3.38Å; Y172-R176 PolarHBondContact O-N 3.47Å
173	T	51.5	Low	52.1	Low	56 Å²	56	94.2 Å²	94.2	34%	0.344	45%	0.45	S	S	.	.	H	α-helix	trans	-70	-51.3	-177.4	-35.9	0	0	0	0	111.7	R170 Q175 R176 A177	R170-T173 WeakPolarHBondContact CG-OG1 3.42Å; R170-T173 PolarHBondContact NE-OG1 3.27Å; T173-Q175 PolarHBondContact O-N 2.94Å; T173-R176 PolarHBondContact O-N 3Å; T173-A177 WeakPolarHBondContact O-CB 3.39Å; T173-A177 PolarHBondContact O-N 2.95Å
174	L	51	Low	54	Low	127 Å²	127	90 Å²	90	67%	0.665	42%	0.423	S	S	*	.	H	α-helix	trans	-64.1	-42.1	-174.2	-166.9	77.1	0	0	0	112.2	A177 L178	L174-A177 WeakPolarHBondContact O-CB 3.43Å; L174-A177 PolarHBondContact O-N 2.71Å; L174-L178 HydrophobicContact CG-CD1 4.21Å; L174-L178 WeakPolarHBondContact O-CB 3.37Å; L174-L178 WeakPolarHBondContact O-CG 3.34Å; L174-L178 PolarHBondContact O-N 2.9Å
175	Q	54.4	Low	55.9	Low	144 Å²	144	88.8 Å²	88.8	67%	0.673	42%	0.421	S	S	*	.	H	α-helix	trans	-70.6	-39.2	-180	-170.3	174.1	-20.2	0	0	112.2	T173 F179	T173-Q175 PolarHBondContact O-N 2.94Å; Q175-F179 WeakPolarHBondContact O-CB 3.44Å; Q175-F179 PolarHBondContact O-N 3.32Å; Q175-F179 VanDerWaalsContact O-N 3.08Å
176	R	56.1	Low	57.9	Low	164 Å²	164	89.8 Å²	89.8	62%	0.619	43%	0.429	S	S	*	.	H	α-helix	trans	-67.4	-35.8	171.7	-73.1	179.4	-178.8	170.6	5.7	112	Y172 T173 G180	Y172-R176 HydrophobicContact CD1-CG 4.11Å; Y172-R176 VanDerWaalsContact O-CB 3.31Å; Y172-R176 WeakPolarHBondContact O-CB 3.4Å; Y172-R176 VanDerWaalsContact O-CG 3.31Å; Y172-R176 WeakPolarHBondContact O-CG 3.38Å; Y172-R176 PolarHBondContact O-N 3.47Å; T173-R176 PolarHBondContact O-N 3Å; R176-G180 PolarHBondContact O-N 3.4Å
177	A	62.4	Low	59.8	Low	15 Å²	15	94.2 Å²	94.2	12%	0.124	45%	0.451	C	S	.	.	H	α-helix	trans	-63.8	-50.1	175.2	0	0	0	0	0	111.8	T56 T173 L174 F179 G180 L181	T56-A177 HydrophobicContact CG2-CB 3.45Å; T56-A177 VanDerWaalsContact CG2-CB 3.45Å; T173-A177 WeakPolarHBondContact O-CB 3.39Å; T173-A177 PolarHBondContact O-N 2.95Å; L174-A177 WeakPolarHBondContact O-CB 3.43Å; L174-A177 PolarHBondContact O-N 2.71Å; A177-F179 VanDerWaalsContact C-N 3.34Å; A177-F179 PolarHBondContact O-N 2.94Å; A177-G180 CarbonylContact O-C 3.59Å; A177-G180 PolarHBondContact O-N 3Å; A177-L181 WeakPolarHBondContact O-CB 3.31Å; A177-L181 VanDerWaalsContact O-CG 3.31Å; A177-L181 WeakPolarHBondContact O-CG 3.47Å; A177-L181 PolarHBondContact O-N 2.97Å
178	L	62.3	Low	61.5	Low	111 Å²	111	94.5 Å²	94.5	58%	0.581	45%	0.453	S	S	*	.	H	α-helix	trans	-59.7	-43.5	176.5	-73.1	168.1	0	0	0	111.6	L174 L181 L182	L174-L178 HydrophobicContact CG-CD1 4.21Å; L174-L178 WeakPolarHBondContact O-CB 3.37Å; L174-L178 WeakPolarHBondContact O-CG 3.34Å; L174-L178 PolarHBondContact O-N 2.9Å; L178-L181 PolarHBondContact O-N 2.86Å; L178-L182 WeakPolarHBondContact O-CB 3.47Å; L178-L182 PolarHBondContact O-N 2.89Å
179	F	65.9	Low	63.5	Low	155 Å²	155	95.3 Å²	95.3	68%	0.68	47%	0.466	S	S	*	.	H	α-helix	trans	-67.1	-37.3	175.8	-161.6	-98.9	0	0	0	112.5	Q175 A177 L182	Q175-F179 WeakPolarHBondContact O-CB 3.44Å; Q175-F179 PolarHBondContact O-N 3.32Å; Q175-F179 VanDerWaalsContact O-N 3.08Å; A177-F179 VanDerWaalsContact C-N 3.34Å; A177-F179 PolarHBondContact O-N 2.94Å; F179-L182 WeakPolarHBondContact O-CB 3.33Å; F179-L182 PolarHBondContact O-N 2.99Å
180	G	69.1	Low	65.9	Low	28 Å²	28	93.1 Å²	93.1	29%	0.289	46%	0.461	S	S	.	.	H	α-helix	trans	-71.5	-25.5	175.6	0	0	0	0	0	114.4	R176 A177 P184	R176-G180 PolarHBondContact O-N 3.4Å; A177-G180 CarbonylContact O-C 3.59Å; A177-G180 PolarHBondContact O-N 3Å; G180-P184 WeakPolarHBondContact O-CD 3.28Å
181	L	68.4	Low	68	Low	38 Å²	38	87.6 Å²	87.6	20%	0.199	44%	0.441	C	S	.	.	H	α-helix	trans	-84.7	-29.7	171.6	-71.5	168.9	0	0	0	112.3	F49 V52 A177 L178 W183 P184 C185	F49-L181 HydrophobicContact CD2-CD2 3.79Å; F49-L181 HydrophobicContact CE2-CD2 3.87Å; V52-L181 HydrophobicContact CB-CD2 3.94Å; V52-L181 HydrophobicContact CG1-CD2 3.6Å; V52-L181 HydrophobicContact CG1-CG 3.73Å; A177-L181 WeakPolarHBondContact O-CB 3.31Å; A177-L181 VanDerWaalsContact O-CG 3.31Å; A177-L181 WeakPolarHBondContact O-CG 3.47Å; A177-L181 PolarHBondContact O-N 2.97Å; L178-L181 PolarHBondContact O-N 2.86Å; L181-W183 PolarHBondContact O-N 3.39Å; L181-P184 WeakPolarHBondContact O-CD 3.42Å; L181-C185 PolarHBondContact O-N 2.93Å; L181-C185 PolarHBondContact O-SG 3.33Å
182	L	75.2	Confident	70.2	Confident	91 Å²	91	82.8 Å²	82.8	48%	0.476	43%	0.427	S	S	.	.	H	α-helix	trans	-56.9	-37.8	174.9	-164.6	74.8	0	0	0	111.5	L178 F179 C185 L186	L178-L182 WeakPolarHBondContact O-CB 3.47Å; L178-L182 PolarHBondContact O-N 2.89Å; F179-L182 WeakPolarHBondContact O-CB 3.33Å; F179-L182 PolarHBondContact O-N 2.99Å; L182-C185 PolarHBondContact O-N 3.48Å; L182-L186 HydrophobicContact CD2-CD1 4.49Å; L182-L186 HydrophobicContact CG-CD1 4.17Å; L182-L186 WeakPolarHBondContact O-CB 3.3Å; L182-L186 VanDerWaalsContact O-CG 3.28Å; L182-L186 WeakPolarHBondContact O-CG 3.47Å; L182-L186 PolarHBondContact O-N 3.23Å
183	W	76.1	Confident	72.3	Confident	175 Å²	175	80.5 Å²	80.5	66%	0.663	43%	0.425	S	S	*	.	H	α-helix	trans	-68.6	-49.2	-177.7	-167.2	-89.8	0	0	0	113.6	L181 C185 L186 M187	L181-W183 PolarHBondContact O-N 3.39Å; W183-C185 VanDerWaalsContact C-N 3.35Å; W183-C185 PolarHBondContact O-N 3.47Å; W183-L186 PolarHBondContact O-N 3Å; W183-M187 WeakPolarHBondContact O-CG 3.34Å; W183-M187 PolarHBondContact O-N 3.41Å
184	P	79.4	Confident	73.9	Confident	11 Å²	11	82.5 Å²	82.5	7%	0.071	43%	0.433	C	S	.	.	H	α-helix	trans	-53.4	-44.6	163.8	-28.4	34.5	0	0	0	113.8	S45 M48 F49 G180 L181 L186 M187 L188	S45-P184 WeakPolarHBondContact OG-CA 3.43Å; S45-P184 PolarHBondContact OG-O 2.89Å; M48-P184 HydrophobicContact CB-CG 4.38Å; F49-P184 HydrophobicContact CB-CB 4.19Å; G180-P184 WeakPolarHBondContact O-CD 3.28Å; L181-P184 WeakPolarHBondContact O-CD 3.42Å; P184-L186 VanDerWaalsContact C-N 3.32Å; P184-L186 PolarHBondContact O-N 3.18Å; P184-M187 PolarHBondContact O-N 3.03Å; P184-L188 WeakPolarHBondContact O-CB 2.97Å; P184-L188 PolarHBondContact O-N 3.44Å
185	C	78.1	Confident	75.4	Confident	70 Å²	70	77.7 Å²	77.7	47%	0.473	41%	0.409	S	S	.	.	H	α-helix	trans	-61.3	-40.4	179.2	-71.3	0	0	0	0	112.4	L181 L182 W183 G189	L181-C185 PolarHBondContact O-N 2.93Å; L181-C185 PolarHBondContact O-SG 3.33Å; L182-C185 PolarHBondContact O-N 3.48Å; W183-C185 VanDerWaalsContact C-N 3.35Å; W183-C185 PolarHBondContact O-N 3.47Å; C185-G189 PolarHBondContact O-N 3.29Å
186	L	79.7	Confident	76.8	Confident	111 Å²	111	72.4 Å²	72.4	58%	0.581	39%	0.393	S	S	*	.	H	α-helix	trans	-66.8	-42	174.5	-72.3	168.6	0	0	0	112.3	L182 W183 P184 G190	L182-L186 HydrophobicContact CD2-CD1 4.49Å; L182-L186 HydrophobicContact CG-CD1 4.17Å; L182-L186 WeakPolarHBondContact O-CB 3.3Å; L182-L186 VanDerWaalsContact O-CG 3.28Å; L182-L186 WeakPolarHBondContact O-CG 3.47Å; L182-L186 PolarHBondContact O-N 3.23Å; W183-L186 PolarHBondContact O-N 3Å; P184-L186 VanDerWaalsContact C-N 3.32Å; P184-L186 PolarHBondContact O-N 3.18Å; L186-G190 PolarHBondContact O-N 2.9Å
187	M	81.4	Confident	78.1	Confident	93 Å²	93	68.8 Å²	68.8	46%	0.458	39%	0.385	S	S	.	.	H	α-helix	trans	-64.3	-43.9	176.4	-76.5	-66.4	-149.5	0	0	112.5	W183 P184 G190 G191	W183-M187 WeakPolarHBondContact O-CG 3.34Å; W183-M187 PolarHBondContact O-N 3.41Å; P184-M187 PolarHBondContact O-N 3.03Å; M187-G190 PolarHBondContact O-N 3.12Å; M187-G191 PolarHBondContact O-N 3.44Å
188	L	79.4	Confident	79.2	Confident	67 Å²	67	69.6 Å²	69.6	35%	0.351	39%	0.388	S	S	.	.	H	α-helix	trans	-69.5	-39.8	179.1	-168.7	145.4	0	0	0	111.6	V46 P184 S192	V46-L188 HydrophobicContact CG2-CD1 3.7Å; P184-L188 WeakPolarHBondContact O-CB 2.97Å; P184-L188 PolarHBondContact O-N 3.44Å; L188-S192 WeakPolarHBondContact O-CB 3.47Å; L188-S192 PolarHBondContact O-N 2.93Å; L188-S192 PolarHBondContact O-OG 3.46Å
189	G	85.4	Confident	80.2	Confident	37 Å²	37	69.2 Å²	69.2	38%	0.381	38%	0.382	S	S	.	.	H	α-helix	trans	-62.1	-45.3	171	0	0	0	0	0	112.3	C185 S192 L193	C185-G189 PolarHBondContact O-N 3.29Å; G189-S192 PolarHBondContact O-N 3.45Å; G189-L193 WeakPolarHBondContact O-CB 3.34Å; G189-L193 PolarHBondContact O-N 3.4Å
190	G	87.4	Confident	81.1	Confident	31 Å²	31	66.9 Å²	66.9	32%	0.32	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-47.5	176.5	0	0	0	0	0	113.1	L186 M187 S192 L193 L194	L186-G190 PolarHBondContact O-N 2.9Å; M187-G190 PolarHBondContact O-N 3.12Å; G190-S192 VanDerWaalsContact C-N 3.34Å; G190-S192 PolarHBondContact O-N 3.35Å; G190-L193 PolarHBondContact O-N 3.42Å; G190-L194 WeakPolarHBondContact O-CG 3.38Å; G190-L194 PolarHBondContact O-N 3Å
191	G	84.9	Confident	81.8	Confident	2 Å²	2	69.7 Å²	69.7	2%	0.021	39%	0.388	C	S	.	.	H	α-helix	trans	-60.5	-41.9	174.9	0	0	0	0	0	112.6	M187 L194 V195	M187-G191 PolarHBondContact O-N 3.44Å; G191-L194 PolarHBondContact O-N 2.87Å; G191-V195 WeakPolarHBondContact O-CG2 3.46Å; G191-V195 PolarHBondContact O-N 3.27Å; G191-V195 VanDerWaalsContact O-N 3.12Å
192	S	84.2	Confident	82.5	Confident	54 Å²	54	70.3 Å²	70.3	38%	0.378	39%	0.39	S	S	.	.	H	α-helix	trans	-63.6	-43.6	175.8	-57.5	0	0	0	0	112.2	M42 L188 G189 G190 G196	M42-S192 VanDerWaalsContact CE-CA 3.47Å; L188-S192 WeakPolarHBondContact O-CB 3.47Å; L188-S192 PolarHBondContact O-N 2.93Å; L188-S192 PolarHBondContact O-OG 3.46Å; G189-S192 PolarHBondContact O-N 3.45Å; G190-S192 VanDerWaalsContact C-N 3.34Å; G190-S192 PolarHBondContact O-N 3.35Å; S192-G196 PolarHBondContact O-N 2.69Å
193	L	86.1	Confident	82.7	Confident	111 Å²	111	69.6 Å²	69.6	58%	0.581	39%	0.392	S	S	*	.	H	α-helix	trans	-65.2	-41.2	177.9	-175.1	62.8	0	0	0	111.7	G189 G190 G196 L197	G189-L193 WeakPolarHBondContact O-CB 3.34Å; G189-L193 PolarHBondContact O-N 3.4Å; G190-L193 PolarHBondContact O-N 3.42Å; L193-G196 PolarHBondContact O-N 3.47Å; L193-L197 HydrophobicContact CD1-CD1 4.22Å; L193-L197 HydrophobicContact CD1-CG 4.21Å; L193-L197 HydrophobicContact CG-CD1 3.94Å; L193-L197 HydrophobicContact CG-CG 4.36Å; L193-L197 VanDerWaalsContact O-CB 3.31Å; L193-L197 WeakPolarHBondContact O-CB 3.29Å; L193-L197 WeakPolarHBondContact O-CG 3.25Å; L193-L197 PolarHBondContact O-N 3.28Å
194	L	84.1	Confident	83	Confident	98 Å²	98	66.8 Å²	66.8	51%	0.513	39%	0.389	S	S	.	.	H	α-helix	trans	-61.2	-49.5	176.2	-74.5	168.7	0	0	0	112.1	G190 G191 L197 V198	G190-L194 WeakPolarHBondContact O-CG 3.38Å; G190-L194 PolarHBondContact O-N 3Å; G191-L194 PolarHBondContact O-N 2.87Å; L194-L197 PolarHBondContact O-N 2.85Å; L194-V198 WeakPolarHBondContact O-CG2 3.31Å; L194-V198 PolarHBondContact O-N 2.97Å
195	V	83.1	Confident	83.1	Confident	26 Å²	26	68.8 Å²	68.8	16%	0.158	41%	0.407	C	S	.	.	H	α-helix	trans	-65.2	-40.3	177.9	176.8	0	0	0	0	111.1	M42 G191 V198 K199	M42-V195 HydrophobicContact CE-CB 4.5Å; M42-V195 HydrophobicContact CE-CG2 4.19Å; G191-V195 WeakPolarHBondContact O-CG2 3.46Å; G191-V195 PolarHBondContact O-N 3.27Å; G191-V195 VanDerWaalsContact O-N 3.12Å; V195-V198 PolarHBondContact O-N 2.96Å; V195-K199 WeakPolarHBondContact O-CG 3.45Å; V195-K199 PolarHBondContact O-N 3.26Å
196	G	84.9	Confident	83.3	Confident	32 Å²	32	74 Å²	74	33%	0.33	42%	0.417	S	S	.	.	H	α-helix	trans	-61.8	-45.7	175.7	0	0	0	0	0	113.1	S192 L193 K199 L200	S192-G196 PolarHBondContact O-N 2.69Å; L193-G196 PolarHBondContact O-N 3.47Å; G196-K199 PolarHBondContact O-N 3.16Å; G196-L200 WeakPolarHBondContact O-CB 3.36Å; G196-L200 WeakPolarHBondContact O-CG 3.49Å; G196-L200 PolarHBondContact O-N 3.02Å
197	L	83.3	Confident	83.4	Confident	88 Å²	88	73.7 Å²	73.7	46%	0.461	42%	0.415	S	S	.	.	H	α-helix	trans	-63	-42.1	175.9	-74.6	170.3	0	0	0	111.8	L193 L194 K199 L200 T201	L193-L197 HydrophobicContact CD1-CD1 4.22Å; L193-L197 HydrophobicContact CD1-CG 4.21Å; L193-L197 HydrophobicContact CG-CD1 3.94Å; L193-L197 HydrophobicContact CG-CG 4.36Å; L193-L197 VanDerWaalsContact O-CB 3.31Å; L193-L197 WeakPolarHBondContact O-CB 3.29Å; L193-L197 WeakPolarHBondContact O-CG 3.25Å; L193-L197 PolarHBondContact O-N 3.28Å; L194-L197 PolarHBondContact O-N 2.85Å; L197-K199 VanDerWaalsContact C-N 3.33Å; L197-K199 PolarHBondContact O-N 3.08Å; L197-L200 PolarHBondContact O-N 3.43Å; L197-T201 WeakPolarHBondContact O-CG2 3.41Å; L197-T201 PolarHBondContact O-N 2.83Å; L197-T201 PolarHBondContact O-OG1 3.02Å
198	V	84.6	Confident	83.4	Confident	32 Å²	32	72.5 Å²	72.5	19%	0.194	42%	0.416	C	S	.	.	H	α-helix	trans	-63.4	-37	175.3	167.8	0	0	0	0	111.8	E31 I35 L194 V195 T201 Q202	E31-V198 HydrophobicContact CG-CG1 3.81Å; I35-V198 HydrophobicContact CD1-CG1 4.05Å; I35-V198 HydrophobicContact CG1-CG1 4.01Å; L194-V198 WeakPolarHBondContact O-CG2 3.31Å; L194-V198 PolarHBondContact O-N 2.97Å; V195-V198 PolarHBondContact O-N 2.96Å; V198-T201 PolarHBondContact O-OG1 2.98Å; V198-T201 VanDerWaalsContact O-OG1 3.08Å; V198-Q202 VanDerWaalsContact O-CG 3.25Å; V198-Q202 WeakPolarHBondContact O-CG 3.21Å; V198-Q202 PolarHBondContact O-N 3.46Å; V198-Q202 VanDerWaalsContact O-N 3.16Å
199	K	83.1	Confident	83.4	Confident	103 Å²	103	72.6 Å²	72.6	45%	0.448	42%	0.419	S	S	.	.	H	α-helix	trans	-74.4	-32.9	174.5	-70.1	-70.3	160.6	-160	0	113	V195 G196 L197 C203	V195-K199 WeakPolarHBondContact O-CG 3.45Å; V195-K199 PolarHBondContact O-N 3.26Å; G196-K199 PolarHBondContact O-N 3.16Å; L197-K199 VanDerWaalsContact C-N 3.33Å; L197-K199 PolarHBondContact O-N 3.08Å; K199-C203 VanDerWaalsContact O-CB 3.29Å; K199-C203 WeakPolarHBondContact O-CB 3.39Å; K199-C203 PolarHBondContact O-N 3.4Å
200	L	84.4	Confident	83.1	Confident	106 Å²	106	74.1 Å²	74.1	56%	0.555	42%	0.418	S	S	*	.	H	α-helix	trans	-64.7	-45.2	172.3	-79.4	163.4	0	0	0	111.8	G196 L197 C203 L204	G196-L200 WeakPolarHBondContact O-CB 3.36Å; G196-L200 WeakPolarHBondContact O-CG 3.49Å; G196-L200 PolarHBondContact O-N 3.02Å; L197-L200 PolarHBondContact O-N 3.43Å; L200-C203 PolarHBondContact O-N 2.89Å; L200-L204 WeakPolarHBondContact O-CB 3.3Å; L200-L204 VanDerWaalsContact O-CG 3.28Å; L200-L204 WeakPolarHBondContact O-CG 3.49Å; L200-L204 PolarHBondContact O-N 3Å
201	T	84.6	Confident	82.9	Confident	87 Å²	87	76.8 Å²	76.8	53%	0.534	43%	0.429	S	S	.	.	H	α-helix	trans	-66.8	-38.7	177.8	54.6	0	0	0	0	112.3	L197 V198 A205	L197-T201 WeakPolarHBondContact O-CG2 3.41Å; L197-T201 PolarHBondContact O-N 2.83Å; L197-T201 PolarHBondContact O-OG1 3.02Å; V198-T201 PolarHBondContact O-OG1 2.98Å; V198-T201 VanDerWaalsContact O-OG1 3.08Å; T201-A205 VanDerWaalsContact O-CB 3.3Å; T201-A205 WeakPolarHBondContact O-CB 3.28Å; T201-A205 PolarHBondContact O-N 3.25Å
202	Q	82.2	Confident	82.4	Confident	51 Å²	51	84.9 Å²	84.9	24%	0.238	46%	0.458	C	S	.	.	H	α-helix	trans	-58.8	-45.6	169.8	-74	172.9	33.8	0	0	112.5	E31 V198 A205 R206	E31-Q202 VanDerWaalsContact OE1-CD 3.24Å; E31-Q202 PolarHBondContact OE1-NE2 2.89Å; E31-Q202 PolarHBondContact OE2-NE2 2.92Å; V198-Q202 VanDerWaalsContact O-CG 3.25Å; V198-Q202 WeakPolarHBondContact O-CG 3.21Å; V198-Q202 PolarHBondContact O-N 3.46Å; V198-Q202 VanDerWaalsContact O-N 3.16Å; Q202-A205 PolarHBondContact O-N 3.35Å; Q202-R206 PolarHBondContact O-N 3.23Å
203	C	81.1	Confident	82	Confident	77 Å²	77	85.3 Å²	85.3	52%	0.52	46%	0.461	S	S	.	.	H	α-helix	trans	-65.6	-45.8	-179	-167.4	0	0	0	0	111.3	K199 L200 A205 R206 L207	K199-C203 VanDerWaalsContact O-CB 3.29Å; K199-C203 WeakPolarHBondContact O-CB 3.39Å; K199-C203 PolarHBondContact O-N 3.4Å; L200-C203 PolarHBondContact O-N 2.89Å; C203-A205 VanDerWaalsContact C-N 3.33Å; C203-A205 PolarHBondContact O-N 2.74Å; C203-R206 PolarHBondContact O-N 3.25Å; C203-L207 PolarHBondContact O-N 2.88Å
204	L	81.4	Confident	81.6	Confident	115 Å²	115	88.6 Å²	88.6	60%	0.602	47%	0.467	S	S	*	.	H	α-helix	trans	-60.8	-40.1	174.1	-71.7	168.7	0	0	0	112.1	L200 L207 S208	L200-L204 WeakPolarHBondContact O-CB 3.3Å; L200-L204 VanDerWaalsContact O-CG 3.28Å; L200-L204 WeakPolarHBondContact O-CG 3.49Å; L200-L204 PolarHBondContact O-N 3Å; L204-L207 PolarHBondContact O-N 2.94Å; L204-S208 WeakPolarHBondContact O-CB 3.42Å; L204-S208 PolarHBondContact O-N 3.28Å
205	A	82.8	Confident	81.1	Confident	54 Å²	54	87 Å²	87	45%	0.446	46%	0.464	S	S	.	.	H	α-helix	trans	-60.3	-49.3	175.1	0	0	0	0	0	111.2	T201 Q202 C203 S208 T209	T201-A205 VanDerWaalsContact O-CB 3.3Å; T201-A205 WeakPolarHBondContact O-CB 3.28Å; T201-A205 PolarHBondContact O-N 3.25Å; Q202-A205 PolarHBondContact O-N 3.35Å; C203-A205 VanDerWaalsContact C-N 3.33Å; C203-A205 PolarHBondContact O-N 2.74Å; A205-S208 PolarHBondContact O-N 3.34Å; A205-S208 PolarHBondContact O-OG 3.28Å; A205-T209 PolarHBondContact O-N 2.72Å; A205-T209 PolarHBondContact O-OG1 3.37Å
206	R	80.8	Confident	80.5	Confident	180 Å²	180	94 Å²	94	68%	0.679	49%	0.488	S	S	*	.	H	α-helix	trans	-59.5	-48.7	175.8	-178.4	178.7	-72	-151.3	-1.4	112	Q202 C203 S208 T209 D210	Q202-R206 PolarHBondContact O-N 3.23Å; C203-R206 PolarHBondContact O-N 3.25Å; R206-S208 PolarHBondContact O-N 3.05Å; R206-T209 WeakPolarHBondContact CA-OG1 3.37Å; R206-T209 PolarHBondContact O-N 2.91Å; R206-T209 VanDerWaalsContact O-N 3.08Å; R206-T209 PolarHBondContact O-OG1 3.08Å; R206-D210 VanDerWaalsContact O-CG 3.27Å; R206-D210 PolarHBondContact O-N 3.45Å
207	L	82.9	Confident	79.9	Confident	103 Å²	103	94.2 Å²	94.2	54%	0.539	49%	0.49	S	S	.	.	H	α-helix	trans	-58.3	-39.8	178.2	-134.4	82.6	0	0	0	111.4	C203 L204 D210 V211	C203-L207 PolarHBondContact O-N 2.88Å; L204-L207 PolarHBondContact O-N 2.94Å; L207-D210 PolarHBondContact O-N 2.99Å; L207-V211 WeakPolarHBondContact O-CB 3.48Å; L207-V211 WeakPolarHBondContact O-CG2 3.41Å; L207-V211 PolarHBondContact O-N 2.69Å
208	S	81.8	Confident	79.3	Confident	69 Å²	69	91.8 Å²	91.8	48%	0.483	49%	0.487	S	S	.	.	H	α-helix	trans	-66.4	-36.1	177.3	84.2	0	0	0	0	112.9	L204 A205 R206 R212	L204-S208 WeakPolarHBondContact O-CB 3.42Å; L204-S208 PolarHBondContact O-N 3.28Å; A205-S208 PolarHBondContact O-N 3.34Å; A205-S208 PolarHBondContact O-OG 3.28Å; R206-S208 PolarHBondContact O-N 3.05Å; S208-R212 WeakPolarHBondContact O-CB 3.06Å; S208-R212 PolarHBondContact O-N 2.94Å
209	T	78.4	Confident	78.7	Confident	69 Å²	69	98.8 Å²	98.8	42%	0.423	51%	0.51	S	S	.	.	H	α-helix	trans	-69.9	-38.9	174	44.8	0	0	0	0	111.8	A205 R206 R212 S213	A205-T209 PolarHBondContact O-N 2.72Å; A205-T209 PolarHBondContact O-OG1 3.37Å; R206-T209 WeakPolarHBondContact CA-OG1 3.37Å; R206-T209 PolarHBondContact O-N 2.91Å; R206-T209 VanDerWaalsContact O-N 3.08Å; R206-T209 PolarHBondContact O-OG1 3.08Å; T209-R212 CarbonylContact O-C 3.54Å; T209-R212 PolarHBondContact O-N 3.45Å; T209-S213 WeakPolarHBondContact O-CB 3.34Å; T209-S213 PolarHBondContact O-N 2.82Å
210	D	80.3	Confident	78.1	Confident	68 Å²	68	103.4 Å²	103.4	36%	0.364	52%	0.524	S	S	.	.	H	α-helix	trans	-66.5	-51.4	179.2	-64.1	-18.9	0	0	0	110.7	R206 L207 R212 S213 Y214	R206-D210 VanDerWaalsContact O-CG 3.27Å; R206-D210 PolarHBondContact O-N 3.45Å; L207-D210 PolarHBondContact O-N 2.99Å; D210-R212 VanDerWaalsContact C-N 3.27Å; D210-R212 PolarHBondContact O-N 3.3Å; D210-S213 WeakPolarHBondContact O-CA 3.34Å; D210-S213 WeakPolarHBondContact O-CB 3.27Å; D210-S213 PolarHBondContact O-N 3.06Å; D210-S213 PolarHBondContact O-OG 3.34Å; D210-Y214 HydrophobicContact CB-CE2 4.27Å; D210-Y214 WeakPolarHBondContact O-CD2 3.42Å; D210-Y214 PolarHBondContact O-N 2.88Å
211	V	82.6	Confident	77.4	Confident	88 Å²	88	102.5 Å²	102.5	53%	0.533	52%	0.523	S	S	.	.	H	α-helix	trans	-57.6	-40	174.8	172.4	0	0	0	0	111.5	L207 S213 S215	L207-V211 WeakPolarHBondContact O-CB 3.48Å; L207-V211 WeakPolarHBondContact O-CG2 3.41Å; L207-V211 PolarHBondContact O-N 2.69Å; V211-S213 VanDerWaalsContact C-N 3.34Å; V211-S215 VanDerWaalsContact O-CB 3.31Å; V211-S215 WeakPolarHBondContact O-CB 3.49Å; V211-S215 PolarHBondContact O-N 3.17Å; V211-S215 PolarHBondContact O-OG 2.83Å
212	R	74.9	Confident	76.9	Confident	171 Å²	171	103.7 Å²	103.7	65%	0.645	53%	0.526	S	S	*	.	H	α-helix	trans	-67.6	-31.4	174.4	-179.9	175.7	-80.8	-178.7	-4.2	112.4	S208 T209 D210 R216	S208-R212 WeakPolarHBondContact O-CB 3.06Å; S208-R212 PolarHBondContact O-N 2.94Å; T209-R212 CarbonylContact O-C 3.54Å; T209-R212 PolarHBondContact O-N 3.45Å; D210-R212 VanDerWaalsContact C-N 3.27Å; D210-R212 PolarHBondContact O-N 3.3Å; R212-R216 WeakPolarHBondContact O-CB 3.11Å; R212-R216 VanDerWaalsContact O-CG 3.27Å; R212-R216 WeakPolarHBondContact O-CG 3.31Å; R212-R216 PolarHBondContact O-N 3.35Å
213	S	73.9	Confident	76.5	Confident	63 Å²	63	110.1 Å²	110.1	44%	0.441	55%	0.548	S	S	.	.	H	α-helix	trans	-69.2	-50.1	175.9	84.5	0	0	0	0	111.3	T209 D210 V211 S215 R216 G217	T209-S213 WeakPolarHBondContact O-CB 3.34Å; T209-S213 PolarHBondContact O-N 2.82Å; D210-S213 WeakPolarHBondContact O-CA 3.34Å; D210-S213 WeakPolarHBondContact O-CB 3.27Å; D210-S213 PolarHBondContact O-N 3.06Å; D210-S213 PolarHBondContact O-OG 3.34Å; V211-S213 VanDerWaalsContact C-N 3.34Å; S213-S215 VanDerWaalsContact C-N 3.31Å; S213-S215 PolarHBondContact O-N 2.95Å; S213-R216 CarbonylContact O-C 3.53Å; S213-R216 PolarHBondContact O-N 3.05Å; S213-G217 PolarHBondContact O-N 3.37Å
214	Y	78.3	Confident	76.1	Confident	180 Å²	180	114 Å²	114	71%	0.706	55%	0.552	S	S	*	*	H	α-helix	trans	-58.3	-44	175	-65.7	-63.7	0	0	0	111.1	D210 R216 G217 G218	D210-Y214 HydrophobicContact CB-CE2 4.27Å; D210-Y214 WeakPolarHBondContact O-CD2 3.42Å; D210-Y214 PolarHBondContact O-N 2.88Å; Y214-R216 VanDerWaalsContact C-N 3.31Å; Y214-R216 PolarHBondContact O-N 3.05Å; Y214-G217 PolarHBondContact O-N 2.71Å; Y214-G218 PolarHBondContact O-N 2.97Å
215	S	73.8	Confident	75.9	Confident	65 Å²	65	112.2 Å²	112.2	46%	0.455	55%	0.547	S	S	.	.	H	α-helix	trans	-59.3	-37.4	174.9	-59.7	0	0	0	0	113.3	V211 S213 R219	V211-S215 VanDerWaalsContact O-CB 3.31Å; V211-S215 WeakPolarHBondContact O-CB 3.49Å; V211-S215 PolarHBondContact O-N 3.17Å; V211-S215 PolarHBondContact O-OG 2.83Å; S213-S215 VanDerWaalsContact C-N 3.31Å; S213-S215 PolarHBondContact O-N 2.95Å; S215-R219 VanDerWaalsContact O-CB 3.24Å; S215-R219 WeakPolarHBondContact O-CB 3.5Å; S215-R219 PolarHBondContact O-N 3.49Å
216	R	70.4	Confident	75.7	Confident	173 Å²	173	114.4 Å²	114.4	65%	0.653	55%	0.548	S	S	*	.	H	α-helix	trans	-77.3	-32.7	176	-72.6	170.2	85.6	112.1	-5.4	112	R212 S213 Y214 R220	R212-R216 WeakPolarHBondContact O-CB 3.11Å; R212-R216 VanDerWaalsContact O-CG 3.27Å; R212-R216 WeakPolarHBondContact O-CG 3.31Å; R212-R216 PolarHBondContact O-N 3.35Å; S213-R216 CarbonylContact O-C 3.53Å; S213-R216 PolarHBondContact O-N 3.05Å; Y214-R216 VanDerWaalsContact C-N 3.31Å; Y214-R216 PolarHBondContact O-N 3.05Å; R216-R220 WeakPolarHBondContact O-CB 3.42Å; R216-R220 WeakPolarHBondContact O-CG 3.45Å; R216-R220 PolarHBondContact O-N 3.39Å
217	G	72.6	Confident	75.5	Confident	36 Å²	36	107.4 Å²	107.4	37%	0.371	53%	0.531	S	S	.	.	H	α-helix	trans	-62.1	-57.7	172.4	0	0	0	0	0	111.8	S213 Y214 R219 R220 T221	S213-G217 PolarHBondContact O-N 3.37Å; Y214-G217 PolarHBondContact O-N 2.71Å; G217-R219 VanDerWaalsContact C-N 3.31Å; G217-R219 PolarHBondContact O-N 3.01Å; G217-R220 WeakPolarHBondContact O-CA 3.41Å; G217-R220 WeakPolarHBondContact O-CB 3.48Å; G217-R220 PolarHBondContact O-N 2.94Å; G217-T221 PolarHBondContact O-N 3.19Å; G217-T221 PolarHBondContact O-OG1 3.48Å
218	G	71.5	Confident	75.3	Confident	38 Å²	38	108.4 Å²	108.4	39%	0.392	53%	0.531	S	S	.	.	H	α-helix	trans	-58.5	-38.4	177.2	0	0	0	0	0	113.4	Y214 R220 T221 L222	Y214-G218 PolarHBondContact O-N 2.97Å; G218-R220 VanDerWaalsContact C-N 3.32Å; G218-R220 PolarHBondContact O-N 3.01Å; G218-T221 WeakPolarHBondContact CA-OG1 3.29Å; G218-T221 PolarHBondContact O-N 3.06Å; G218-T221 PolarHBondContact O-OG1 2.98Å; G218-T221 VanDerWaalsContact O-OG1 3.06Å; G218-L222 VanDerWaalsContact O-CB 3.29Å; G218-L222 WeakPolarHBondContact O-CB 3.41Å; G218-L222 PolarHBondContact O-N 3.31Å
219	R	71.1	Confident	75.1	Confident	179 Å²	179	110.9 Å²	110.9	68%	0.675	54%	0.537	S	S	*	.	H	α-helix	trans	-70.8	-25.5	175.6	-163.3	176.8	-65	-166.5	-1	113.1	S215 G217 R223	S215-R219 VanDerWaalsContact O-CB 3.24Å; S215-R219 WeakPolarHBondContact O-CB 3.5Å; S215-R219 PolarHBondContact O-N 3.49Å; G217-R219 VanDerWaalsContact C-N 3.31Å; G217-R219 PolarHBondContact O-N 3.01Å; R219-R223 WeakPolarHBondContact O-CG 3.5Å; R219-R223 PolarHBondContact O-N 3.44Å
220	R	69.6	Low	74.9	Confident	199 Å²	199	115.1 Å²	115.1	75%	0.751	55%	0.546	S	S	*	.	H	α-helix	trans	-75.6	-46.6	171.1	-85.5	177.3	165.8	173.5	-5.9	111.7	R216 G217 G218 L222 R223 Y224	R216-R220 WeakPolarHBondContact O-CB 3.42Å; R216-R220 WeakPolarHBondContact O-CG 3.45Å; R216-R220 PolarHBondContact O-N 3.39Å; G217-R220 WeakPolarHBondContact O-CA 3.41Å; G217-R220 WeakPolarHBondContact O-CB 3.48Å; G217-R220 PolarHBondContact O-N 2.94Å; G218-R220 VanDerWaalsContact C-N 3.32Å; G218-R220 PolarHBondContact O-N 3.01Å; R220-L222 PolarHBondContact O-N 3.32Å; R220-R223 PolarHBondContact O-N 3.03Å; R220-Y224 WeakPolarHBondContact O-CB 3.24Å; R220-Y224 PolarHBondContact O-N 3.46Å
221	T	71.5	Confident	74.7	Confident	87 Å²	87	120.2 Å²	120.2	53%	0.534	56%	0.56	S	S	.	*	H	α-helix	trans	-64.1	-40.7	178.7	52.3	0	0	0	0	111.7	G217 G218 R223 Y224 T225	G217-T221 PolarHBondContact O-N 3.19Å; G217-T221 PolarHBondContact O-OG1 3.48Å; G218-T221 WeakPolarHBondContact CA-OG1 3.29Å; G218-T221 PolarHBondContact O-N 3.06Å; G218-T221 PolarHBondContact O-OG1 2.98Å; G218-T221 VanDerWaalsContact O-OG1 3.06Å; T221-R223 PolarHBondContact O-N 3.45Å; T221-Y224 WeakPolarHBondContact O-CB 3.47Å; T221-Y224 PolarHBondContact O-N 2.91Å; T221-Y224 VanDerWaalsContact O-N 3.17Å; T221-T225 PolarHBondContact O-N 2.92Å; T221-T225 PolarHBondContact O-OG1 3.25Å
222	L	73.7	Confident	74.6	Confident	112 Å²	112	120.8 Å²	120.8	59%	0.586	56%	0.56	S	S	*	*	H	α-helix	trans	-59.7	-45.1	174	-173.3	70.6	0	0	0	112.6	G218 R220 Y224 T225 Q226	G218-L222 VanDerWaalsContact O-CB 3.29Å; G218-L222 WeakPolarHBondContact O-CB 3.41Å; G218-L222 PolarHBondContact O-N 3.31Å; R220-L222 PolarHBondContact O-N 3.32Å; L222-Y224 VanDerWaalsContact C-N 3.3Å; L222-Y224 PolarHBondContact O-N 3.49Å; L222-T225 PolarHBondContact O-N 3.07Å; L222-T225 PolarHBondContact O-OG1 2.98Å; L222-T225 VanDerWaalsContact O-OG1 3.07Å; L222-Q226 VanDerWaalsContact O-CB 3.28Å; L222-Q226 WeakPolarHBondContact O-CB 3.4Å; L222-Q226 PolarHBondContact O-N 2.97Å
223	R	72.9	Confident	74.6	Confident	186 Å²	186	118.1 Å²	118.1	70%	0.702	56%	0.558	S	S	*	*	H	α-helix	trans	-65	-34.4	175.1	-79.8	-173.1	174.1	-160.8	-1.4	112.4	R219 R220 T221 G227	R219-R223 WeakPolarHBondContact O-CG 3.5Å; R219-R223 PolarHBondContact O-N 3.44Å; R220-R223 PolarHBondContact O-N 3.03Å; T221-R223 PolarHBondContact O-N 3.45Å; R223-G227 PolarHBondContact O-N 3.17Å
224	Y	73.5	Confident	74.5	Confident	158 Å²	158	121.3 Å²	121.3	62%	0.62	57%	0.565	S	S	*	*	H	α-helix	trans	-69.5	-44.7	177.5	179.7	-104.1	0	0	0	112.2	R220 T221 L222 G227 K228	R220-Y224 WeakPolarHBondContact O-CB 3.24Å; R220-Y224 PolarHBondContact O-N 3.46Å; T221-Y224 WeakPolarHBondContact O-CB 3.47Å; T221-Y224 PolarHBondContact O-N 2.91Å; T221-Y224 VanDerWaalsContact O-N 3.17Å; L222-Y224 VanDerWaalsContact C-N 3.3Å; L222-Y224 PolarHBondContact O-N 3.49Å; Y224-G227 PolarHBondContact O-N 3.39Å; Y224-K228 WeakPolarHBondContact O-CB 3.28Å; Y224-K228 PolarHBondContact O-N 3.5Å
225	T	76.4	Confident	74	Confident	79 Å²	79	121.4 Å²	121.4	49%	0.485	57%	0.565	S	S	.	*	H	α-helix	trans	-66.6	-42.2	175.9	53.5	0	0	0	0	111.6	T221 L222 K228 M229	T221-T225 PolarHBondContact O-N 2.92Å; T221-T225 PolarHBondContact O-OG1 3.25Å; L222-T225 PolarHBondContact O-N 3.07Å; L222-T225 PolarHBondContact O-OG1 2.98Å; L222-T225 VanDerWaalsContact O-OG1 3.07Å; T225-K228 PolarHBondContact O-N 3.25Å; T225-M229 PolarHBondContact O-N 3.18Å
226	Q	78.5	Confident	73.6	Confident	100 Å²	100	121 Å²	121	47%	0.467	56%	0.562	S	S	.	*	H	α-helix	trans	-58.3	-50.3	172.7	-173.3	-179.7	6.2	0	0	111.6	L222 K228 M229 Y230	L222-Q226 VanDerWaalsContact O-CB 3.28Å; L222-Q226 WeakPolarHBondContact O-CB 3.4Å; L222-Q226 PolarHBondContact O-N 2.97Å; Q226-K228 PolarHBondContact O-N 3.22Å; Q226-M229 PolarHBondContact O-N 2.92Å; Q226-Y230 HydrophobicContact CG-CD2 3.95Å; Q226-Y230 HydrophobicContact CG-CE2 3.97Å; Q226-Y230 WeakPolarHBondContact O-CD2 3.45Å; Q226-Y230 PolarHBondContact O-N 3.43Å
227	G	76.4	Confident	73.1	Confident	32 Å²	32	115.6 Å²	115.6	33%	0.33	55%	0.55	S	S	.	*	H	α-helix	trans	-67.4	-17.1	178.2	0	0	0	0	0	114.9	R223 Y224 R231	R223-G227 PolarHBondContact O-N 3.17Å; Y224-G227 PolarHBondContact O-N 3.39Å; G227-R231 PolarHBondContact O-NE 3.48Å
228	K	78.8	Confident	72.4	Confident	124 Å²	124	119.8 Å²	119.8	54%	0.539	56%	0.562	S	S	.	*	H	α-helix	trans	-81.8	-45.1	169.4	-169.3	174.2	-179.9	-179	0	111	Y224 T225 Q226 R231 L232	Y224-K228 WeakPolarHBondContact O-CB 3.28Å; Y224-K228 PolarHBondContact O-N 3.5Å; T225-K228 PolarHBondContact O-N 3.25Å; Q226-K228 PolarHBondContact O-N 3.22Å; K228-R231 PolarHBondContact O-N 3.32Å; K228-L232 WeakPolarHBondContact O-CG 3.31Å; K228-L232 PolarHBondContact O-N 3.1Å; K228-L232 VanDerWaalsContact O-N 3.1Å
229	M	78	Confident	71.8	Confident	122 Å²	122	125 Å²	125	60%	0.601	58%	0.576	S	S	*	*	H	α-helix	trans	-59.9	-46.5	175.4	-74.9	-61.6	-153.7	0	0	112.4	T225 Q226 R231 L232 L233	T225-M229 PolarHBondContact O-N 3.18Å; Q226-M229 PolarHBondContact O-N 2.92Å; M229-R231 VanDerWaalsContact C-N 3.3Å; M229-R231 PolarHBondContact O-N 3.29Å; M229-L232 PolarHBondContact O-N 2.95Å; M229-L232 VanDerWaalsContact O-N 3.08Å; M229-L233 PolarHBondContact O-N 3.08Å
230	Y	73.2	Confident	71	Confident	157 Å²	157	121 Å²	121	62%	0.616	58%	0.576	S	S	*	*	H	α-helix	trans	-57.9	-40.3	176.8	-93.9	-95.1	0	0	0	112.6	Q226 L233 Q234	Q226-Y230 HydrophobicContact CG-CD2 3.95Å; Q226-Y230 HydrophobicContact CG-CE2 3.97Å; Q226-Y230 WeakPolarHBondContact O-CD2 3.45Å; Q226-Y230 PolarHBondContact O-N 3.43Å; Y230-L233 PolarHBondContact O-N 2.94Å; Y230-Q234 VanDerWaalsContact O-CB 3.31Å; Y230-Q234 WeakPolarHBondContact O-CB 3.45Å; Y230-Q234 PolarHBondContact O-N 3.16Å
231	R	76.7	Confident	70.3	Confident	176 Å²	176	117.5 Å²	117.5	66%	0.664	57%	0.57	S	S	*	*	H	α-helix	trans	-69.7	-29.8	175.9	-89.7	-171.8	-77.7	-176.9	-8.1	113.7	G227 K228 M229 R235	G227-R231 PolarHBondContact O-NE 3.48Å; K228-R231 PolarHBondContact O-N 3.32Å; M229-R231 VanDerWaalsContact C-N 3.3Å; M229-R231 PolarHBondContact O-N 3.29Å; R231-R235 WeakPolarHBondContact O-CB 3.35Å; R231-R235 PolarHBondContact O-N 2.92Å; R231-R235 VanDerWaalsContact O-N 3.16Å
232	L	79.9	Confident	69.2	Low	100 Å²	100	124.2 Å²	124.2	52%	0.524	60%	0.602	S	S	.	*	H	α-helix	trans	-70.6	-46.9	173.2	-68.5	171.5	0	0	0	110.9	K228 M229 Q234 R235 S236	K228-L232 WeakPolarHBondContact O-CG 3.31Å; K228-L232 PolarHBondContact O-N 3.1Å; K228-L232 VanDerWaalsContact O-N 3.1Å; M229-L232 PolarHBondContact O-N 2.95Å; M229-L232 VanDerWaalsContact O-N 3.08Å; L232-Q234 PolarHBondContact O-N 2.94Å; L232-R235 PolarHBondContact O-N 3.15Å; L232-R235 VanDerWaalsContact O-N 3.15Å; L232-S236 PolarHBondContact O-N 3.48Å; L232-S236 PolarHBondContact O-OG 3.36Å
233	L	75.3	Confident	69	Low	115 Å²	115	124.8 Å²	124.8	60%	0.602	60%	0.603	S	S	*	*	H	α-helix	trans	-63.2	-39.8	177.3	-68.9	170.6	0	0	0	112.7	M229 Y230 R235 S236 S237	M229-L233 PolarHBondContact O-N 3.08Å; Y230-L233 PolarHBondContact O-N 2.94Å; L233-R235 VanDerWaalsContact C-N 3.32Å; L233-R235 PolarHBondContact O-N 3.38Å; L233-S236 WeakPolarHBondContact CA-OG 3.49Å; L233-S236 PolarHBondContact O-OG 3.03Å; L233-S237 VanDerWaalsContact O-CB 3.27Å; L233-S237 WeakPolarHBondContact O-CB 3.2Å; L233-S237 PolarHBondContact O-N 3.03Å
234	Q	73.2	Confident	68.7	Low	129 Å²	129	121.6 Å²	121.6	60%	0.603	60%	0.597	S	S	*	*	H	α-helix	trans	-64.6	-37	174	-171.2	177.3	9.4	0	0	111.6	Y230 L232 M238	Y230-Q234 VanDerWaalsContact O-CB 3.31Å; Y230-Q234 WeakPolarHBondContact O-CB 3.45Å; Y230-Q234 PolarHBondContact O-N 3.16Å; L232-Q234 PolarHBondContact O-N 2.94Å; Q234-M238 WeakPolarHBondContact O-CG 3.41Å; Q234-M238 PolarHBondContact O-N 3.12Å
235	R	68	Low	68.5	Low	182 Å²	182	119.6 Å²	119.6	69%	0.687	60%	0.596	S	S	*	*	H	α-helix	trans	-70.6	-42.3	177.9	-164.3	175.5	-165.7	172.6	4.5	112.2	R231 L232 L233 M238 Q239	R231-R235 WeakPolarHBondContact O-CB 3.35Å; R231-R235 PolarHBondContact O-N 2.92Å; R231-R235 VanDerWaalsContact O-N 3.16Å; L232-R235 PolarHBondContact O-N 3.15Å; L232-R235 VanDerWaalsContact O-N 3.15Å; L233-R235 VanDerWaalsContact C-N 3.32Å; L233-R235 PolarHBondContact O-N 3.38Å; R235-M238 PolarHBondContact O-N 2.92Å; R235-Q239 WeakPolarHBondContact O-CG 3.41Å; R235-Q239 PolarHBondContact O-N 2.7Å; R235-Q239 VanDerWaalsContact O-N 3.12Å
236	S	63.6	Low	68	Low	56 Å²	56	121.9 Å²	121.9	39%	0.392	60%	0.603	S	S	.	*	H	α-helix	trans	-66.8	-37.6	174.2	58.6	0	0	0	0	111.9	L232 L233 Q239 S240	L232-S236 PolarHBondContact O-N 3.48Å; L232-S236 PolarHBondContact O-OG 3.36Å; L233-S236 WeakPolarHBondContact CA-OG 3.49Å; L233-S236 PolarHBondContact O-OG 3.03Å; S236-Q239 CarbonylContact O-C 3.58Å; S236-Q239 PolarHBondContact O-N 3.14Å; S236-Q239 VanDerWaalsContact O-N 3.17Å; S236-S240 PolarHBondContact O-N 3.17Å; S236-S240 VanDerWaalsContact O-N 3.14Å; S236-S240 PolarHBondContact O-OG 3.49Å
237	S	60.7	Low	67.4	Low	60 Å²	60	123.3 Å²	123.3	42%	0.42	61%	0.611	S	S	.	*	H	α-helix	trans	-61.1	-43.7	173.6	174.4	0	0	0	0	111.8	L233 Q239 S240 I241	L233-S237 VanDerWaalsContact O-CB 3.27Å; L233-S237 WeakPolarHBondContact O-CB 3.2Å; L233-S237 PolarHBondContact O-N 3.03Å; S237-Q239 VanDerWaalsContact C-N 3.27Å; S237-Q239 PolarHBondContact O-N 3.02Å; S237-S240 WeakPolarHBondContact O-CB 3.45Å; S237-S240 PolarHBondContact O-N 3.36Å; S237-I241 WeakPolarHBondContact O-CD1 3.46Å; S237-I241 WeakPolarHBondContact O-CG1 3.27Å
238	M	58.9	Low	66.8	Low	125 Å²	125	129.4 Å²	129.4	62%	0.616	63%	0.63	S	S	*	*	H	α-helix	trans	-65.4	-27.8	175	-66.5	-99	66.7	0	0	113.3	Q234 R235 S240	Q234-M238 WeakPolarHBondContact O-CG 3.41Å; Q234-M238 PolarHBondContact O-N 3.12Å; R235-M238 PolarHBondContact O-N 2.92Å; M238-S240 VanDerWaalsContact C-N 3.29Å
239	Q	58.1	Low	65.9	Low	148 Å²	148	129.8 Å²	129.8	69%	0.692	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-1.6	172.6	-68.6	-178	-86.2	0	0	113.8	R235 S236 S237	R235-Q239 WeakPolarHBondContact O-CG 3.41Å; R235-Q239 PolarHBondContact O-N 2.7Å; R235-Q239 VanDerWaalsContact O-N 3.12Å; S236-Q239 CarbonylContact O-C 3.58Å; S236-Q239 PolarHBondContact O-N 3.14Å; S236-Q239 VanDerWaalsContact O-N 3.17Å; S237-Q239 VanDerWaalsContact C-N 3.27Å; S237-Q239 PolarHBondContact O-N 3.02Å
240	S	54.6	Low	65	Low	95 Å²	95	130.4 Å²	130.4	66%	0.664	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	8.2	179.7	-50.5	0	0	0	0	112.8	S236 S237 M238	S236-S240 PolarHBondContact O-N 3.17Å; S236-S240 VanDerWaalsContact O-N 3.14Å; S236-S240 PolarHBondContact O-OG 3.49Å; S237-S240 WeakPolarHBondContact O-CB 3.45Å; S237-S240 PolarHBondContact O-N 3.36Å; M238-S240 VanDerWaalsContact C-N 3.29Å
241	I	54.7	Low	64.3	Low	124 Å²	124	128.2 Å²	128.2	64%	0.636	64%	0.641	S	S	*	*			trans	-129.2	21.8	-172.1	-55.5	166.6	0	0	0	109.8	S237	S237-I241 WeakPolarHBondContact O-CD1 3.46Å; S237-I241 WeakPolarHBondContact O-CG1 3.27Å
242	L	47.7	Very low	63.1	Low	228 Å²	228	123.8 Å²	123.8	100%	1.194	64%	0.639	S	S	*	*			trans	-128	0	175.8	-157.8	89.6	0	0	0	109.9

Retrieved 242 of 242 residues in 172.8 ms (Link to these results)

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