A0A077Z2W8_TRITR Loading...

EF-hand 7 and EF-hand 8 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z2W8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 192 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.6	Very low	38	Very low	204 Å²	204	112.3 Å²	112.3	100%	1.005	61%	0.607	S	S	*	*				0	2.1	0	-122	178.8	-80.7	0	0	113.1
2	T	36.6	Very low	38.3	Very low	117 Å²	117	112.8 Å²	112.8	72%	0.718	60%	0.599	S	S	*	*			trans	-106.3	-9	178.8	36.3	0	0	0	0	113.5
3	T	33.1	Very low	39	Very low	130 Å²	130	109.8 Å²	109.8	80%	0.798	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-9	179.4	4.4	0	0	0	0	114.3
4	E	36.9	Very low	39.6	Very low	131 Å²	131	104.2 Å²	104.2	61%	0.612	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-5.2	179.6	-76.2	-166.7	136.3	0	0	114.3
5	I	37.5	Very low	40	Very low	102 Å²	102	98.9 Å²	98.9	52%	0.523	53%	0.529	S	S	.	.	S	Bend	trans	-102.7	-27.9	-165	-63.3	173.7	0	0	0	112.8
6	I	37.6	Very low	39.7	Very low	85 Å²	85	98.4 Å²	98.4	44%	0.436	53%	0.526	S	S	.	.	S	Bend	trans	-87.3	-25.1	-171	-59.6	171.4	0	0	0	112.3
7	G	35.1	Very low	39.9	Very low	70 Å²	70	95.6 Å²	95.6	72%	0.722	51%	0.513	S	S	*	.	S	Bend	trans	-89.6	-11.1	175.7	0	0	0	0	0	115.5
8	R	38	Very low	39.8	Very low	153 Å²	153	92.6 Å²	92.6	58%	0.577	50%	0.503	S	S	*	.	S	Bend	trans	-103.6	-4.7	-172.2	-96.7	171.2	73.1	-174.4	2.2	115.2	F12	R8-F12 WeakPolarHBondContact O-CB 3.46Å
9	N	42.6	Very low	39.6	Very low	103 Å²	103	93.6 Å²	93.6	55%	0.551	51%	0.508	S	S	*	.	S	Bend	trans	-104.1	-21.7	-169.8	-97.3	-10.8	0	0	0	116.8	V13	N9-V13 WeakPolarHBondContact O-CB 3.37Å; N9-V13 WeakPolarHBondContact O-CG2 3.28Å
10	L	40.9	Very low	39.5	Very low	73 Å²	73	94.5 Å²	94.5	38%	0.382	52%	0.516	S	S	.	.	S	Bend	trans	-104.7	-46.4	-176.4	-79.5	142	0	0	0	113.7	F12 F14 F87 V151	L10-F12 VanDerWaalsContact C-N 3.35Å; L10-F14 PolarHBondContact O-N 3.16Å; L10-F87 HydrophobicContact CD2-CZ 4.44Å; L10-V151 HydrophobicContact CD1-CB 4.32Å; L10-V151 HydrophobicContact CD1-CG1 3.33Å; L10-V151 HydrophobicContact CD1-CG2 4Å; L10-V151 HydrophobicContact CD2-CG1 3.97Å; L10-V151 HydrophobicContact CD2-CG2 4.09Å; L10-V151 HydrophobicContact CG-CG1 4.19Å
11	L	40.8	Very low	39.5	Very low	67 Å²	67	94 Å²	94	35%	0.351	53%	0.525	S	S	.	.	H	α-helix	trans	-72.3	-31.8	176.1	-159.2	73.5	0	0	0	111.6	V15 K123 W126	L11-V15 WeakPolarHBondContact O-CB 3.5Å; L11-V15 WeakPolarHBondContact O-CG2 3.17Å; L11-V15 PolarHBondContact O-N 3.4Å; L11-V15 VanDerWaalsContact O-N 3.09Å; L11-K123 HydrophobicContact CD2-CD 4.37Å; L11-W126 HydrophobicContact CD1-CZ3 4.27Å
12	F	42.3	Very low	39.1	Very low	118 Å²	118	87 Å²	87	52%	0.518	51%	0.505	S	S	.	.	H	α-helix	trans	-74.6	-36.7	179.8	-146.6	-99.7	0	0	0	112	R8 L10 F14 L16	R8-F12 WeakPolarHBondContact O-CB 3.46Å; L10-F12 VanDerWaalsContact C-N 3.35Å; F12-F14 VanDerWaalsContact C-N 3.34Å; F12-L16 HydrophobicContact CD1-CD1 4.16Å; F12-L16 HydrophobicContact CE1-CD1 3.72Å; F12-L16 HydrophobicContact CZ-CD1 4.08Å; F12-L16 VanDerWaalsContact O-CB 3.3Å; F12-L16 WeakPolarHBondContact O-CB 3.42Å; F12-L16 PolarHBondContact O-N 3.11Å
13	V	47.2	Very low	38.8	Very low	74 Å²	74	89 Å²	89	45%	0.448	51%	0.511	S	S	.	.	H	α-helix	trans	-68.2	-34.9	175.7	170.7	0	0	0	0	111.5	N9 T17 F79	N9-V13 WeakPolarHBondContact O-CB 3.37Å; N9-V13 WeakPolarHBondContact O-CG2 3.28Å; V13-T17 PolarHBondContact O-N 3.06Å; V13-T17 PolarHBondContact O-OG1 3.02Å; V13-F79 HydrophobicContact CG1-CE1 4.12Å
14	F	47.3	Very low	38.7	Very low	32 Å²	32	91 Å²	91	14%	0.14	52%	0.516	C	S	.	.	H	α-helix	trans	-77.6	-33	-179.6	-137.2	-85.6	0	0	0	113.2	L10 F12 A18 Y75 F87 V91 L115	L10-F14 PolarHBondContact O-N 3.16Å; F12-F14 VanDerWaalsContact C-N 3.34Å; F14-A18 WeakPolarHBondContact O-CB 3.45Å; F14-Y75 HydrophobicContact CD2-CE2 4.36Å; F14-Y75 HydrophobicContact CE1-CE2 4.48Å; F14-Y75 AromaticContact CE2-CE2 3.34Å; F14-Y75 HydrophobicContact CE2-CE2 3.34Å; F14-Y75 AromaticContact CE2-CZ 3.66Å; F14-Y75 WeakPolarHBondContact CE2-OH 3.21Å; F14-Y75 HydrophobicContact CZ-CD2 4.36Å; F14-Y75 AromaticContact CZ-CE2 3.44Å; F14-Y75 HydrophobicContact CZ-CE2 3.44Å; F14-Y75 VanDerWaalsContact CZ-CE2 3.44Å; F14-F87 AromaticContact CD2-CE1 3.8Å; F14-F87 HydrophobicContact CD2-CE1 3.8Å; F14-F87 HydrophobicContact CE2-CD1 4.06Å; F14-F87 AromaticContact CE2-CE1 3.43Å; F14-F87 HydrophobicContact CE2-CE1 3.43Å; F14-F87 VanDerWaalsContact CE2-CE1 3.43Å; F14-F87 HydrophobicContact CE2-CZ 4.35Å; F14-V91 HydrophobicContact CE2-CG2 4.35Å; F14-V91 HydrophobicContact CZ-CG1 4.31Å; F14-V91 HydrophobicContact CZ-CG2 4.25Å; F14-L115 HydrophobicContact CD1-CD1 3.71Å; F14-L115 HydrophobicContact CE1-CD1 3.54Å
15	V	45.4	Very low	38.3	Very low	25 Å²	25	92 Å²	92	15%	0.152	53%	0.526	C	S	.	.	H	α-helix	trans	-84.1	-34.2	179	174.1	0	0	0	0	112	L11 L19 L115	L11-V15 WeakPolarHBondContact O-CB 3.5Å; L11-V15 WeakPolarHBondContact O-CG2 3.17Å; L11-V15 PolarHBondContact O-N 3.4Å; L11-V15 VanDerWaalsContact O-N 3.09Å; V15-L19 HydrophobicContact CG1-CD1 3.91Å; V15-L19 VanDerWaalsContact O-CD1 3.32Å; V15-L19 WeakPolarHBondContact O-CD1 3.39Å; V15-L19 VanDerWaalsContact O-CG 3.24Å; V15-L19 WeakPolarHBondContact O-CG 3.44Å; V15-L19 PolarHBondContact O-N 3.16Å; V15-L115 WeakPolarHBondContact CG2-O 3.24Å
16	L	36	Very low	38	Very low	91 Å²	91	93.5 Å²	93.5	48%	0.476	53%	0.534	S	S	.	.	H	α-helix	trans	-74.9	-37.8	-179.5	-130.9	84.8	0	0	0	113.2	F12 L19 T20	F12-L16 HydrophobicContact CD1-CD1 4.16Å; F12-L16 HydrophobicContact CE1-CD1 3.72Å; F12-L16 HydrophobicContact CZ-CD1 4.08Å; F12-L16 VanDerWaalsContact O-CB 3.3Å; F12-L16 WeakPolarHBondContact O-CB 3.42Å; F12-L16 PolarHBondContact O-N 3.11Å; L16-L19 PolarHBondContact O-N 3.36Å; L16-T20 WeakPolarHBondContact O-CG2 3.27Å; L16-T20 PolarHBondContact O-N 3.38Å; L16-T20 PolarHBondContact O-OG1 2.78Å
17	T	42.5	Very low	37.6	Very low	50 Å²	50	94.2 Å²	94.2	31%	0.307	54%	0.544	S	S	.	.	H	α-helix	trans	-70.7	-37	179.2	39.8	0	0	0	0	112.5	V13 L19 T20 F79	V13-T17 PolarHBondContact O-N 3.06Å; V13-T17 PolarHBondContact O-OG1 3.02Å; T17-L19 VanDerWaalsContact C-N 3.28Å; T17-L19 PolarHBondContact O-N 3.4Å; T17-T20 PolarHBondContact O-N 3.24Å; T17-T20 PolarHBondContact O-OG1 3.43Å; T17-F79 HydrophobicContact CG2-CE1 3.7Å; T17-F79 HydrophobicContact CG2-CZ 4.13Å; T17-F79 VanDerWaalsContact OG1-CZ 3.31Å; T17-F79 WeakPolarHBondContact OG1-CZ 3.47Å
18	A	38.3	Very low	37.3	Very low	41 Å²	41	93.9 Å²	93.9	34%	0.339	53%	0.528	S	S	.	.	H	α-helix	trans	-70.3	-20.9	176	0	0	0	0	0	113.7	F14 L116	F14-A18 WeakPolarHBondContact O-CB 3.45Å; A18-L116 HydrophobicContact CB-CD2 3.6Å
19	L	35.7	Very low	36.9	Very low	113 Å²	113	93.7 Å²	93.7	59%	0.592	54%	0.538	S	S	*	.	H	α-helix	trans	-88.4	-14.7	175.8	-72.9	169.5	0	0	0	113.7	V15 L16 T17	V15-L19 HydrophobicContact CG1-CD1 3.91Å; V15-L19 VanDerWaalsContact O-CD1 3.32Å; V15-L19 WeakPolarHBondContact O-CD1 3.39Å; V15-L19 VanDerWaalsContact O-CG 3.24Å; V15-L19 WeakPolarHBondContact O-CG 3.44Å; V15-L19 PolarHBondContact O-N 3.16Å; L16-L19 PolarHBondContact O-N 3.36Å; T17-L19 VanDerWaalsContact C-N 3.28Å; T17-L19 PolarHBondContact O-N 3.4Å
20	T	37.4	Very low	36.3	Very low	110 Å²	110	96.1 Å²	96.1	68%	0.675	55%	0.55	S	S	*	*	S	Bend	trans	-89.6	-8.3	-178.3	47.8	0	0	0	0	114.9	L16 T17 G22	L16-T20 WeakPolarHBondContact O-CG2 3.27Å; L16-T20 PolarHBondContact O-N 3.38Å; L16-T20 PolarHBondContact O-OG1 2.78Å; T17-T20 PolarHBondContact O-N 3.24Å; T17-T20 PolarHBondContact O-OG1 3.43Å; T20-G22 VanDerWaalsContact C-N 3.34Å; T20-G22 PolarHBondContact O-N 3.47Å
21	A	39.5	Very low	36	Very low	86 Å²	86	98.5 Å²	98.5	71%	0.711	56%	0.559	S	S	*	*			trans	-89.7	66.1	176.8	0	0	0	0	0	111.4
22	G	30.1	Very low	36	Very low	56 Å²	56	106.6 Å²	106.6	58%	0.577	59%	0.585	S	S	*	*			trans	-92.9	128.2	172.9	0	0	0	0	0	112	T20	T20-G22 VanDerWaalsContact C-N 3.34Å; T20-G22 PolarHBondContact O-N 3.47Å
23	N	30.6	Very low	36.4	Very low	159 Å²	159	102.9 Å²	102.9	85%	0.85	57%	0.574	S	S	*	*			trans	117.8	99.2	162.8	-63.7	-25.9	0	0	0	114.6
24	L	31.5	Very low	36.9	Very low	173 Å²	173	101.4 Å²	101.4	91%	0.906	57%	0.569	S	S	*	*			trans	-159.4	129.7	155.6	-97.7	127.1	0	0	0	111.5
25	D	28.5	Very low	37.9	Very low	151 Å²	151	102.1 Å²	102.1	81%	0.807	59%	0.586	S	S	*	*			trans	-106.3	156	-175.4	-94.3	-43.1	0	0	0	113
26	L	29.8	Very low	39.4	Very low	133 Å²	133	103.4 Å²	103.4	70%	0.696	59%	0.591	S	S	*	*			trans	81.7	157.2	162.6	-66.8	149.2	0	0	0	119.7	R55	L26-R55 VanDerWaalsContact C-CZ 3.49Å; L26-R55 VanDerWaalsContact O-CD 3.25Å; L26-R55 WeakPolarHBondContact O-CD 3.4Å; L26-R55 VanDerWaalsContact O-CZ 3.25Å; L26-R55 PolarHBondContact O-NE 3.31Å; L26-R55 PolarHBondContact O-NH1 3.28Å
27	P	29.9	Very low	41.4	Very low	101 Å²	101	103.9 Å²	103.9	66%	0.656	59%	0.594	S	S	*	*				-113.1	175.7	-84.2	13.6	11.7	0	0	0	114.7	R55	P27-R55 VanDerWaalsContact CA-NH2 3.28Å; P27-R55 PolarHBondContact O-NE 2.88Å; P27-R55 VanDerWaalsContact O-NE 3.17Å
28	V	29.5	Very low	43.2	Very low	63 Å²	63	107.7 Å²	107.7	38%	0.382	60%	0.604	S	S	.	*			trans	-75.5	139.6	-165.9	174.8	0	0	0	0	115.5	K51 R55	V28-K51 HydrophobicContact CG2-CD 3.87Å; V28-K51 HydrophobicContact CG2-CG 4.19Å; V28-R55 VanDerWaalsContact CG2-NH2 3.33Å
29	L	29.6	Very low	45.3	Very low	149 Å²	149	105.8 Å²	105.8	78%	0.78	59%	0.588	S	S	*	*			trans	-142.4	137.9	145.2	-76.4	-177.7	0	0	0	112.8	Y54	L29-Y54 WeakPolarHBondContact O-CE1 3.38Å
30	L	29	Very low	47.6	Very low	154 Å²	154	102.8 Å²	102.8	81%	0.806	57%	0.574	S	S	*	*			trans	-73.1	140.3	-165.8	-68.1	126.4	0	0	0	114.8
31	H	36.2	Very low	49.8	Very low	122 Å²	122	101.7 Å²	101.7	57%	0.565	57%	0.571	S	S	*	*			trans	-155.1	116.7	143.7	-163.1	-81.7	0	0	0	112.4	S33 Y54	H31-S33 PolarHBondContact O-N 2.99Å; H31-S33 VanDerWaalsContact O-N 3.16Å; H31-Y54 PolarHBondContact N-OH 3.14Å; H31-Y54 VanDerWaalsContact N-OH 3.12Å; H31-Y54 PolarHBondContact O-OH 3.25Å
32	R	39	Very low	51.8	Low	237 Å²	237	100.6 Å²	100.6	89%	0.894	56%	0.556	S	S	*	*			trans	7.9	83.8	162.4	-82.9	177.3	162	-172.6	-3.9	117.8
33	S	51.8	Low	54.2	Low	41 Å²	41	98.3 Å²	98.3	29%	0.287	53%	0.53	S	S	.	.	S	Bend	trans	-120.6	172.2	141	55.9	0	0	0	0	106.5	H31 G35	H31-S33 PolarHBondContact O-N 2.99Å; H31-S33 VanDerWaalsContact O-N 3.16Å; S33-G35 PolarHBondContact O-N 3.39Å
34	A	57.4	Low	56.6	Low	42 Å²	42	95.5 Å²	95.5	35%	0.347	52%	0.515	S	S	.	.	S	Bend	trans	-45.4	136.3	178.8	0	0	0	0	0	110.4	Y38 L39	A34-Y38 HydrophobicContact CB-CD1 3.18Å; A34-Y38 HydrophobicContact CB-CE1 3.8Å; A34-Y38 HydrophobicContact CB-CG 3.77Å; A34-L39 WeakPolarHBondContact O-CD1 3.29Å; A34-L39 WeakPolarHBondContact O-CG 3.41Å
35	G	68.1	Low	58.9	Low	48 Å²	48	87.6 Å²	87.6	50%	0.495	47%	0.474	S	S	.	.			trans	-49.6	147.9	-169.4	0	0	0	0	0	111.4	S33 D37 Y38 L39	S33-G35 PolarHBondContact O-N 3.39Å; G35-D37 CarbonylContact O-C 3.52Å; G35-D37 PolarHBondContact O-N 3.37Å; G35-Y38 WeakPolarHBondContact O-CA 3.24Å; G35-Y38 WeakPolarHBondContact O-CB 3.36Å; G35-Y38 PolarHBondContact O-N 3.05Å; G35-L39 PolarHBondContact O-N 3.39Å; G35-L39 VanDerWaalsContact O-N 3.15Å
36	I	76.9	Confident	61.5	Low	52 Å²	52	83 Å²	83	27%	0.267	45%	0.453	S	S	.	.	H	α-helix	trans	-49.1	-31.5	-175.3	-63	172.1	0	0	0	111.5	L39 T40 R47 V50 K51	I36-L39 PolarHBondContact O-N 2.87Å; I36-T40 VanDerWaalsContact O-CB 3.31Å; I36-T40 WeakPolarHBondContact O-CB 3.29Å; I36-T40 PolarHBondContact O-N 3.27Å; I36-T40 PolarHBondContact O-OG1 3.47Å; I36-R47 HydrophobicContact CG2-CB 4.49Å; I36-R47 HydrophobicContact CG2-CG 3.71Å; I36-V50 HydrophobicContact CG2-CB 4.45Å; I36-V50 HydrophobicContact CG2-CG1 4.23Å; I36-K51 HydrophobicContact CD1-CG 4Å
37	D	77.9	Confident	64	Low	101 Å²	101	81.9 Å²	81.9	54%	0.54	44%	0.44	S	S	.	.	H	α-helix	trans	-62.8	-44.7	176.3	-57.4	0.4	0	0	0	112.5	G35 T40 S41 R47	G35-D37 CarbonylContact O-C 3.52Å; G35-D37 PolarHBondContact O-N 3.37Å; D37-T40 PolarHBondContact O-N 3.07Å; D37-S41 WeakPolarHBondContact O-CB 3.26Å; D37-S41 PolarHBondContact O-N 3.37Å; D37-R47 IonicContact OD1-CZ 3.08Å; D37-R47 IonicContact OD1-NH1 2.73Å; D37-R47 PolarHBondContact OD1-NH1 2.86Å; D37-R47 IonicContact OD1-NH2 2.62Å; D37-R47 PolarHBondContact OD1-NH2 3.41Å; D37-R47 IonicContact OD2-NH2 3.96Å
38	Y	80.8	Confident	66.4	Low	130 Å²	130	82.8 Å²	82.8	51%	0.51	44%	0.439	S	S	.	.	H	α-helix	trans	-63.1	-47.3	173.1	175.8	-92.7	0	0	0	110.8	A34 G35 T40 S41 V42	A34-Y38 HydrophobicContact CB-CD1 3.18Å; A34-Y38 HydrophobicContact CB-CE1 3.8Å; A34-Y38 HydrophobicContact CB-CG 3.77Å; G35-Y38 WeakPolarHBondContact O-CA 3.24Å; G35-Y38 WeakPolarHBondContact O-CB 3.36Å; G35-Y38 PolarHBondContact O-N 3.05Å; Y38-T40 VanDerWaalsContact C-N 3.29Å; Y38-T40 PolarHBondContact O-N 3.34Å; Y38-S41 WeakPolarHBondContact CA-OG 3.35Å; Y38-S41 CarbonylContact O-C 3.52Å; Y38-S41 WeakPolarHBondContact O-CA 3.26Å; Y38-S41 WeakPolarHBondContact O-CB 3.47Å; Y38-S41 PolarHBondContact O-N 3.4Å; Y38-S41 PolarHBondContact O-OG 3.29Å; Y38-V42 HydrophobicContact CD1-CG1 4.38Å; Y38-V42 HydrophobicContact CD1-CG2 4.16Å; Y38-V42 HydrophobicContact CD2-CG1 4.26Å; Y38-V42 HydrophobicContact CE1-CG1 3.94Å; Y38-V42 HydrophobicContact CE1-CG2 3.86Å; Y38-V42 HydrophobicContact CE2-CG1 3.78Å; Y38-V42 WeakPolarHBondContact O-CG2 3.48Å; Y38-V42 PolarHBondContact O-N 2.91Å
39	L	82.5	Confident	68.7	Low	1 Å²	1	82.9 Å²	82.9	1%	0.005	44%	0.436	C	S	.	.	H	α-helix	trans	-61.4	-39.5	179.3	-67.8	177.4	0	0	0	112.1	A34 G35 I36 S41 V42 T43 V50 F105 D106 L109	A34-L39 WeakPolarHBondContact O-CD1 3.29Å; A34-L39 WeakPolarHBondContact O-CG 3.41Å; G35-L39 PolarHBondContact O-N 3.39Å; G35-L39 VanDerWaalsContact O-N 3.15Å; I36-L39 PolarHBondContact O-N 2.87Å; L39-S41 PolarHBondContact O-N 3.23Å; L39-V42 PolarHBondContact O-N 3.38Å; L39-T43 WeakPolarHBondContact O-CB 3.17Å; L39-T43 WeakPolarHBondContact O-CG2 3.42Å; L39-T43 PolarHBondContact O-N 2.98Å; L39-T43 VanDerWaalsContact O-N 3.1Å; L39-T43 PolarHBondContact O-OG1 3.49Å; L39-V50 HydrophobicContact CB-CG1 4.09Å; L39-V50 HydrophobicContact CD1-CG1 4.11Å; L39-F105 HydrophobicContact CD1-CD1 3.79Å; L39-F105 HydrophobicContact CD1-CE1 3.6Å; L39-D106 HydrophobicContact CD2-CB 3.83Å; L39-L109 HydrophobicContact CB-CD2 3.72Å; L39-L109 HydrophobicContact CD1-CD2 4.19Å; L39-L109 HydrophobicContact CD2-CD2 4.07Å; L39-L109 HydrophobicContact CG-CD2 4.21Å
40	T	83.8	Confident	71	Confident	49 Å²	49	75.9 Å²	75.9	30%	0.301	40%	0.399	S	S	.	.	H	α-helix	trans	-67.2	-23.8	173.2	-52.3	0	0	0	0	111.8	I36 D37 Y38 F45	I36-T40 VanDerWaalsContact O-CB 3.31Å; I36-T40 WeakPolarHBondContact O-CB 3.29Å; I36-T40 PolarHBondContact O-N 3.27Å; I36-T40 PolarHBondContact O-OG1 3.47Å; D37-T40 PolarHBondContact O-N 3.07Å; Y38-T40 VanDerWaalsContact C-N 3.29Å; Y38-T40 PolarHBondContact O-N 3.34Å; T40-F45 WeakPolarHBondContact CG2-O 3.37Å
41	S	83.3	Confident	73.3	Confident	88 Å²	88	71.3 Å²	71.3	62%	0.615	37%	0.373	S	S	*	.	H	α-helix	trans	-86.4	-25.4	179	76	0	0	0	0	114.3	D37 Y38 L39	D37-S41 WeakPolarHBondContact O-CB 3.26Å; D37-S41 PolarHBondContact O-N 3.37Å; Y38-S41 WeakPolarHBondContact CA-OG 3.35Å; Y38-S41 CarbonylContact O-C 3.52Å; Y38-S41 WeakPolarHBondContact O-CA 3.26Å; Y38-S41 WeakPolarHBondContact O-CB 3.47Å; Y38-S41 PolarHBondContact O-N 3.4Å; Y38-S41 PolarHBondContact O-OG 3.29Å; L39-S41 PolarHBondContact O-N 3.23Å
42	V	81.6	Confident	75	Confident	63 Å²	63	67.9 Å²	67.9	38%	0.382	37%	0.365	S	S	.	.	H	α-helix	trans	-104.3	-1.9	-179.5	-56.4	0	0	0	0	113.1	Y38 L39	Y38-V42 HydrophobicContact CD1-CG1 4.38Å; Y38-V42 HydrophobicContact CD1-CG2 4.16Å; Y38-V42 HydrophobicContact CD2-CG1 4.26Å; Y38-V42 HydrophobicContact CE1-CG1 3.94Å; Y38-V42 HydrophobicContact CE1-CG2 3.86Å; Y38-V42 HydrophobicContact CE2-CG1 3.78Å; Y38-V42 WeakPolarHBondContact O-CG2 3.48Å; Y38-V42 PolarHBondContact O-N 2.91Å; L39-V42 PolarHBondContact O-N 3.38Å
43	T	81.5	Confident	76.6	Confident	7 Å²	7	58.3 Å²	58.3	4%	0.043	33%	0.331	C	S	.	.	S	Bend	trans	-131.1	154.7	176	70.1	0	0	0	0	109.7	L39 F45 L109 S113	L39-T43 WeakPolarHBondContact O-CB 3.17Å; L39-T43 WeakPolarHBondContact O-CG2 3.42Å; L39-T43 PolarHBondContact O-N 2.98Å; L39-T43 VanDerWaalsContact O-N 3.1Å; L39-T43 PolarHBondContact O-OG1 3.49Å; T43-F45 PolarHBondContact O-N 2.97Å; T43-F45 VanDerWaalsContact O-N 3.13Å; T43-L109 HydrophobicContact CG2-CD2 3.86Å; T43-L109 HydrophobicContact CG2-CG 3.92Å; T43-S113 WeakPolarHBondContact CA-OG 3.49Å; T43-S113 WeakPolarHBondContact CB-OG 3.34Å
44	D	80	Confident	77.7	Confident	101 Å²	101	57.8 Å²	57.8	54%	0.54	32%	0.323	S	S	.	.	S	Bend	trans	-81.1	17.8	176.6	-74.8	-33	0	0	0	112.4	S113 R117	D44-S113 PolarHBondContact N-OG 3.39Å; D44-R117 HydrophobicContact CB-CB 3.77Å; D44-R117 HydrophobicContact CB-CG 4.28Å; D44-R117 WeakPolarHBondContact O-CD 3.32Å; D44-R117 PolarHBondContact O-NH1 2.83Å
45	F	79.3	Confident	78.3	Confident	7 Å²	7	58.7 Å²	58.7	3%	0.031	32%	0.318	C	S	.	.			trans	-91.3	136	177.7	-66.4	-59.7	0	0	0	111.8	T40 T43 E49 V50 I53 L109 F112 L116	T40-F45 WeakPolarHBondContact CG2-O 3.37Å; T43-F45 PolarHBondContact O-N 2.97Å; T43-F45 VanDerWaalsContact O-N 3.13Å; F45-E49 HydrophobicContact CB-CB 4.02Å; F45-E49 HydrophobicContact CD1-CB 4.08Å; F45-E49 HydrophobicContact CG-CB 4.4Å; F45-V50 HydrophobicContact CB-CG2 3.63Å; F45-I53 HydrophobicContact CD1-CD1 3.96Å; F45-I53 HydrophobicContact CD2-CD1 3.98Å; F45-I53 HydrophobicContact CE1-CD1 3.91Å; F45-I53 HydrophobicContact CE2-CD1 3.89Å; F45-I53 HydrophobicContact CG-CD1 4.01Å; F45-I53 HydrophobicContact CZ-CD1 3.88Å; F45-L109 HydrophobicContact CD2-CD1 3.56Å; F45-L109 HydrophobicContact CD2-CG 3.92Å; F45-L109 HydrophobicContact CE2-CD1 3.86Å; F45-L109 HydrophobicContact CE2-CG 4.26Å; F45-L109 HydrophobicContact CG-CD1 4.44Å; F45-F112 HydrophobicContact CE2-CB 4.12Å; F45-F112 HydrophobicContact CZ-CB 4.09Å; F45-L116 HydrophobicContact CE1-CD1 4.28Å; F45-L116 HydrophobicContact CZ-CD1 4.07Å
46	S	83.4	Confident	78.5	Confident	54 Å²	54	57.9 Å²	57.9	38%	0.378	31%	0.309	S	S	.	.			trans	-64.9	158.2	168.8	69.2	0	0	0	0	111.2	N48 E49 V50	S46-N48 PolarHBondContact O-N 3.48Å; S46-E49 WeakPolarHBondContact CB-OE2 3Å; S46-E49 PolarHBondContact N-OE2 3.19Å; S46-E49 WeakPolarHBondContact O-CB 3.36Å; S46-E49 PolarHBondContact O-N 3.44Å; S46-E49 VanDerWaalsContact OG-CD 3.3Å; S46-E49 VanDerWaalsContact OG-CG 3.27Å; S46-E49 WeakPolarHBondContact OG-CG 3.3Å; S46-E49 PolarHBondContact OG-N 2.97Å; S46-E49 PolarHBondContact OG-OE2 2.8Å; S46-V50 WeakPolarHBondContact O-CG2 3.27Å; S46-V50 PolarHBondContact O-N 3.01Å
47	R	83	Confident	78.3	Confident	109 Å²	109	55.6 Å²	55.6	41%	0.411	30%	0.297	S	S	.	.	H	α-helix	trans	-49.5	-36.9	174.9	-174.3	-176.3	-70.2	-81.7	7.1	113.2	I36 D37 K51	I36-R47 HydrophobicContact CG2-CB 4.49Å; I36-R47 HydrophobicContact CG2-CG 3.71Å; D37-R47 IonicContact OD1-CZ 3.08Å; D37-R47 IonicContact OD1-NH1 2.73Å; D37-R47 PolarHBondContact OD1-NH1 2.86Å; D37-R47 IonicContact OD1-NH2 2.62Å; D37-R47 PolarHBondContact OD1-NH2 3.41Å; D37-R47 IonicContact OD2-NH2 3.96Å; R47-K51 VanDerWaalsContact O-CG 3.27Å; R47-K51 WeakPolarHBondContact O-CG 3.34Å; R47-K51 PolarHBondContact O-N 3.19Å
48	N	79.9	Confident	78.3	Confident	121 Å²	121	54.6 Å²	54.6	65%	0.647	29%	0.286	S	S	*	.	H	α-helix	trans	-73.5	-40.6	-179.3	-71.1	-16.2	0	0	0	111.5	S46 K51 A52	S46-N48 PolarHBondContact O-N 3.48Å; N48-K51 PolarHBondContact O-N 2.89Å; N48-A52 PolarHBondContact O-N 3.01Å
49	E	77.9	Confident	78	Confident	65 Å²	65	55.5 Å²	55.5	30%	0.304	30%	0.295	S	S	.	.	H	α-helix	trans	-64.4	-47.1	175.1	-69.8	165.2	144.5	0	0	111	F45 S46 K51 A52 I53 R117	F45-E49 HydrophobicContact CB-CB 4.02Å; F45-E49 HydrophobicContact CD1-CB 4.08Å; F45-E49 HydrophobicContact CG-CB 4.4Å; S46-E49 WeakPolarHBondContact CB-OE2 3Å; S46-E49 PolarHBondContact N-OE2 3.19Å; S46-E49 WeakPolarHBondContact O-CB 3.36Å; S46-E49 PolarHBondContact O-N 3.44Å; S46-E49 VanDerWaalsContact OG-CD 3.3Å; S46-E49 VanDerWaalsContact OG-CG 3.27Å; S46-E49 WeakPolarHBondContact OG-CG 3.3Å; S46-E49 PolarHBondContact OG-N 2.97Å; S46-E49 PolarHBondContact OG-OE2 2.8Å; E49-K51 VanDerWaalsContact C-N 3.26Å; E49-K51 PolarHBondContact O-N 3.01Å; E49-A52 PolarHBondContact O-N 2.94Å; E49-I53 VanDerWaalsContact O-CG1 3.24Å; E49-I53 WeakPolarHBondContact O-CG1 3.16Å; E49-I53 PolarHBondContact O-N 3.17Å; E49-R117 VanDerWaalsContact CD-NH2 3.3Å; E49-R117 IonicContact OE1-CZ 3.47Å; E49-R117 IonicContact OE1-NH1 3.38Å; E49-R117 PolarHBondContact OE1-NH1 3.41Å; E49-R117 IonicContact OE1-NH2 2.65Å; E49-R117 PolarHBondContact OE1-NH2 3.18Å; E49-R117 IonicContact OE2-CZ 3.59Å; E49-R117 IonicContact OE2-NH1 2.81Å; E49-R117 PolarHBondContact OE2-NH1 3.09Å; E49-R117 IonicContact OE2-NH2 3.53Å
50	V	78.8	Confident	77.4	Confident	1 Å²	1	58 Å²	58	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-55.3	-43.7	175.3	177.3	0	0	0	0	111.1	I36 L39 F45 S46 Y54 F105 L109	I36-V50 HydrophobicContact CG2-CB 4.45Å; I36-V50 HydrophobicContact CG2-CG1 4.23Å; L39-V50 HydrophobicContact CB-CG1 4.09Å; L39-V50 HydrophobicContact CD1-CG1 4.11Å; F45-V50 HydrophobicContact CB-CG2 3.63Å; S46-V50 WeakPolarHBondContact O-CG2 3.27Å; S46-V50 PolarHBondContact O-N 3.01Å; V50-Y54 VanDerWaalsContact O-CB 3.31Å; V50-Y54 WeakPolarHBondContact O-CB 3.5Å; V50-Y54 PolarHBondContact O-N 3.21Å; V50-F105 HydrophobicContact CG1-CE1 4.09Å; V50-F105 HydrophobicContact CG1-CZ 4.29Å; V50-L109 HydrophobicContact CB-CD2 4.49Å; V50-L109 HydrophobicContact CG1-CD2 3.9Å; V50-L109 HydrophobicContact CG2-CD1 4.49Å; V50-L109 HydrophobicContact CG2-CD2 3.95Å
51	K	76.7	Confident	77.1	Confident	59 Å²	59	55.7 Å²	55.7	26%	0.257	29%	0.292	S	S	.	.	H	α-helix	trans	-64.2	-40.1	176.5	-76.4	172.3	178.1	-179.1	0	112.6	V28 I36 R47 N48 E49 R55	V28-K51 HydrophobicContact CG2-CD 3.87Å; V28-K51 HydrophobicContact CG2-CG 4.19Å; I36-K51 HydrophobicContact CD1-CG 4Å; R47-K51 VanDerWaalsContact O-CG 3.27Å; R47-K51 WeakPolarHBondContact O-CG 3.34Å; R47-K51 PolarHBondContact O-N 3.19Å; N48-K51 PolarHBondContact O-N 2.89Å; E49-K51 VanDerWaalsContact C-N 3.26Å; E49-K51 PolarHBondContact O-N 3.01Å; K51-R55 WeakPolarHBondContact O-CG 3.41Å; K51-R55 PolarHBondContact O-N 3.34Å
52	A	72	Confident	76.9	Confident	49 Å²	49	55.5 Å²	55.5	41%	0.405	29%	0.289	S	S	.	.	H	α-helix	trans	-66.9	-47.2	178.7	0	0	0	0	0	111.1	N48 E49 Y54 R55 G56	N48-A52 PolarHBondContact O-N 3.01Å; E49-A52 PolarHBondContact O-N 2.94Å; A52-Y54 VanDerWaalsContact C-N 3.31Å; A52-Y54 PolarHBondContact O-N 3.39Å; A52-R55 PolarHBondContact O-N 3.38Å; A52-R55 VanDerWaalsContact O-N 3.13Å; A52-G56 PolarHBondContact O-N 3.33Å
53	I	72.1	Confident	77	Confident	36 Å²	36	57.3 Å²	57.3	19%	0.185	30%	0.3	C	S	.	.	H	α-helix	trans	-61.4	-41.2	177.4	-60.7	166.2	0	0	0	110.3	F45 E49 R55 G56 F57 F105 F108 L109	F45-I53 HydrophobicContact CD1-CD1 3.96Å; F45-I53 HydrophobicContact CD2-CD1 3.98Å; F45-I53 HydrophobicContact CE1-CD1 3.91Å; F45-I53 HydrophobicContact CE2-CD1 3.89Å; F45-I53 HydrophobicContact CG-CD1 4.01Å; F45-I53 HydrophobicContact CZ-CD1 3.88Å; E49-I53 VanDerWaalsContact O-CG1 3.24Å; E49-I53 WeakPolarHBondContact O-CG1 3.16Å; E49-I53 PolarHBondContact O-N 3.17Å; I53-R55 VanDerWaalsContact C-N 3.3Å; I53-R55 PolarHBondContact O-N 2.78Å; I53-G56 PolarHBondContact O-N 2.6Å; I53-F57 WeakPolarHBondContact O-CB 3.29Å; I53-F57 PolarHBondContact O-N 2.99Å; I53-F105 HydrophobicContact CB-CE2 4.48Å; I53-F105 HydrophobicContact CG2-CE2 3.99Å; I53-F105 HydrophobicContact CG2-CZ 4.41Å; I53-F108 HydrophobicContact CG2-CD1 4.05Å; I53-F108 HydrophobicContact CG2-CE1 3.64Å; I53-L109 HydrophobicContact CB-CD1 4.1Å; I53-L109 HydrophobicContact CD1-CD1 3.62Å; I53-L109 HydrophobicContact CG1-CD1 4.47Å; I53-L109 HydrophobicContact CG2-CD1 3.89Å
54	Y	74.1	Confident	76.9	Confident	31 Å²	31	58 Å²	58	12%	0.122	31%	0.309	C	S	.	.	H	α-helix	trans	-59.8	-38.3	175.8	-176.8	-102.8	0	0	0	113.2	L29 H31 V50 A52 R58 F105	L29-Y54 WeakPolarHBondContact O-CE1 3.38Å; H31-Y54 PolarHBondContact N-OH 3.14Å; H31-Y54 VanDerWaalsContact N-OH 3.12Å; H31-Y54 PolarHBondContact O-OH 3.25Å; V50-Y54 VanDerWaalsContact O-CB 3.31Å; V50-Y54 WeakPolarHBondContact O-CB 3.5Å; V50-Y54 PolarHBondContact O-N 3.21Å; A52-Y54 VanDerWaalsContact C-N 3.31Å; A52-Y54 PolarHBondContact O-N 3.39Å; Y54-R58 HydrophobicContact CD1-CG 4.13Å; Y54-R58 HydrophobicContact CD2-CG 4.37Å; Y54-R58 HydrophobicContact CE1-CG 3.67Å; Y54-R58 HydrophobicContact CE2-CG 3.96Å; Y54-R58 HydrophobicContact CG-CG 4.47Å; Y54-R58 WeakPolarHBondContact O-CB 3.43Å; Y54-R58 VanDerWaalsContact O-CG 3.24Å; Y54-R58 WeakPolarHBondContact O-CG 3.26Å; Y54-R58 PolarHBondContact O-N 3.28Å; Y54-F105 VanDerWaalsContact CA-CZ 3.46Å; Y54-F105 VanDerWaalsContact CB-CZ 3.43Å; Y54-F105 HydrophobicContact CD2-CB 4.38Å; Y54-F105 AromaticContact CD2-CD1 3.59Å; Y54-F105 HydrophobicContact CD2-CD1 3.59Å; Y54-F105 AromaticContact CD2-CD2 3.8Å; Y54-F105 HydrophobicContact CD2-CD2 3.8Å; Y54-F105 AromaticContact CD2-CE1 3.68Å; Y54-F105 HydrophobicContact CD2-CE1 3.68Å; Y54-F105 AromaticContact CD2-CE2 3.94Å; Y54-F105 HydrophobicContact CD2-CE2 3.94Å; Y54-F105 AromaticContact CD2-CG 3.62Å; Y54-F105 HydrophobicContact CD2-CG 3.62Å; Y54-F105 AromaticContact CD2-CZ 3.88Å; Y54-F105 HydrophobicContact CD2-CZ 3.88Å; Y54-F105 HydrophobicContact CE2-CD1 4.28Å; Y54-F105 HydrophobicContact CE2-CG 4.22Å; Y54-F105 HydrophobicContact CG-CE1 4.23Å; Y54-F105 HydrophobicContact CG-CE2 4.36Å; Y54-F105 HydrophobicContact CG-CZ 4.15Å
55	R	70.8	Confident	77	Confident	61 Å²	61	60.2 Å²	60.2	23%	0.23	31%	0.31	C	S	.	.	H	α-helix	trans	-64.9	-51.7	177.2	-71.2	178.3	-161.3	146.5	13.6	111.1	L26 P27 V28 K51 A52 I53 F57 R58 E59	L26-R55 VanDerWaalsContact C-CZ 3.49Å; L26-R55 VanDerWaalsContact O-CD 3.25Å; L26-R55 WeakPolarHBondContact O-CD 3.4Å; L26-R55 VanDerWaalsContact O-CZ 3.25Å; L26-R55 PolarHBondContact O-NE 3.31Å; L26-R55 PolarHBondContact O-NH1 3.28Å; P27-R55 VanDerWaalsContact CA-NH2 3.28Å; P27-R55 PolarHBondContact O-NE 2.88Å; P27-R55 VanDerWaalsContact O-NE 3.17Å; V28-R55 VanDerWaalsContact CG2-NH2 3.33Å; K51-R55 WeakPolarHBondContact O-CG 3.41Å; K51-R55 PolarHBondContact O-N 3.34Å; A52-R55 PolarHBondContact O-N 3.38Å; A52-R55 VanDerWaalsContact O-N 3.13Å; I53-R55 VanDerWaalsContact C-N 3.3Å; I53-R55 PolarHBondContact O-N 2.78Å; R55-F57 VanDerWaalsContact C-N 3.28Å; R55-F57 PolarHBondContact O-N 2.97Å; R55-R58 PolarHBondContact O-N 3.06Å; R55-E59 WeakPolarHBondContact O-CG 3.48Å; R55-E59 PolarHBondContact O-N 3.3Å
56	G	71.8	Confident	77.2	Confident	31 Å²	31	59.9 Å²	59.9	32%	0.32	31%	0.308	S	S	.	.	H	α-helix	trans	-58.3	-41.3	176.7	0	0	0	0	0	112.2	A52 I53 R58 E59 E60	A52-G56 PolarHBondContact O-N 3.33Å; I53-G56 PolarHBondContact O-N 2.6Å; G56-R58 VanDerWaalsContact C-N 3.32Å; G56-R58 PolarHBondContact O-N 2.92Å; G56-E59 PolarHBondContact O-N 3.43Å; G56-E60 PolarHBondContact O-N 3.41Å; G56-E60 VanDerWaalsContact O-N 3.14Å
57	F	74.1	Confident	77.3	Confident	3 Å²	3	58.7 Å²	58.7	1%	0.013	30%	0.3	C	S	.	.	H	α-helix	trans	-60.5	-39.1	175.1	-177.1	-89.1	0	0	0	112.9	I53 R55 S61 M66 L103 F105 F108	I53-F57 WeakPolarHBondContact O-CB 3.29Å; I53-F57 PolarHBondContact O-N 2.99Å; R55-F57 VanDerWaalsContact C-N 3.28Å; R55-F57 PolarHBondContact O-N 2.97Å; F57-S61 WeakPolarHBondContact O-CA 3.44Å; F57-S61 WeakPolarHBondContact O-CB 3.25Å; F57-S61 PolarHBondContact O-N 3.41Å; F57-M66 HydrophobicContact CD2-CE 3.43Å; F57-M66 VanDerWaalsContact CD2-CE 3.43Å; F57-M66 HydrophobicContact CD2-SD 4.3Å; F57-M66 HydrophobicContact CE2-CB 3.63Å; F57-M66 HydrophobicContact CE2-CE 3.52Å; F57-M66 HydrophobicContact CE2-CG 4.44Å; F57-M66 HydrophobicContact CE2-SD 3.96Å; F57-M66 HydrophobicContact CG-CE 4.21Å; F57-M66 HydrophobicContact CZ-CB 3.72Å; F57-M66 HydrophobicContact CZ-CE 4.35Å; F57-L103 WeakPolarHBondContact CZ-O 3.4Å; F57-F105 HydrophobicContact CB-CD2 3.83Å; F57-F105 HydrophobicContact CB-CE2 4.06Å; F57-F105 HydrophobicContact CD1-CB 4.15Å; F57-F105 AromaticContact CD1-CD2 3.84Å; F57-F105 HydrophobicContact CD1-CD2 3.84Å; F57-F105 HydrophobicContact CD1-CG 4.43Å; F57-F105 HydrophobicContact CD2-CD2 4.11Å; F57-F105 HydrophobicContact CE1-CB 3.98Å; F57-F105 HydrophobicContact CE1-CD2 4.43Å; F57-F105 AromaticContact CG-CD2 3.66Å; F57-F105 HydrophobicContact CG-CD2 3.66Å; F57-F105 HydrophobicContact CG-CE2 4.36Å; F57-F105 HydrophobicContact CZ-CB 4.35Å; F57-F108 HydrophobicContact CD2-CB 3.95Å; F57-F108 AromaticContact CD2-CD1 3.73Å; F57-F108 HydrophobicContact CD2-CD1 3.73Å; F57-F108 AromaticContact CD2-CD2 3.97Å; F57-F108 HydrophobicContact CD2-CD2 3.97Å; F57-F108 HydrophobicContact CD2-CE1 4.17Å; F57-F108 HydrophobicContact CD2-CE2 4.38Å; F57-F108 AromaticContact CD2-CG 3.61Å; F57-F108 HydrophobicContact CD2-CG 3.61Å; F57-F108 HydrophobicContact CD2-CZ 4.47Å; F57-F108 HydrophobicContact CE2-CB 3.71Å; F57-F108 HydrophobicContact CE2-CD1 4.37Å; F57-F108 HydrophobicContact CE2-CD2 4.07Å; F57-F108 AromaticContact CE2-CG 3.8Å; F57-F108 HydrophobicContact CE2-CG 3.8Å
58	R	76.6	Confident	77.4	Confident	81 Å²	81	55 Å²	55	31%	0.306	29%	0.289	S	S	.	.	H	α-helix	trans	-76	-24.2	179	-73.3	-71.7	-64.9	173.8	8.8	113.6	Y54 R55 G56 S61 P62 T63 G64	Y54-R58 HydrophobicContact CD1-CG 4.13Å; Y54-R58 HydrophobicContact CD2-CG 4.37Å; Y54-R58 HydrophobicContact CE1-CG 3.67Å; Y54-R58 HydrophobicContact CE2-CG 3.96Å; Y54-R58 HydrophobicContact CG-CG 4.47Å; Y54-R58 WeakPolarHBondContact O-CB 3.43Å; Y54-R58 VanDerWaalsContact O-CG 3.24Å; Y54-R58 WeakPolarHBondContact O-CG 3.26Å; Y54-R58 PolarHBondContact O-N 3.28Å; R55-R58 PolarHBondContact O-N 3.06Å; G56-R58 VanDerWaalsContact C-N 3.32Å; G56-R58 PolarHBondContact O-N 2.92Å; R58-S61 CarbonylContact O-C 3.59Å; R58-P62 PolarHBondContact NH1-O 3.24Å; R58-P62 PolarHBondContact NH2-O 2.93Å; R58-P62 WeakPolarHBondContact O-CA 3.5Å; R58-T63 VanDerWaalsContact NH1-C 3.32Å; R58-T63 PolarHBondContact NH1-O 3.2Å; R58-G64 VanDerWaalsContact NH1-N 3.1Å
59	E	74.7	Confident	77.7	Confident	149 Å²	149	55.2 Å²	55.2	70%	0.696	29%	0.286	S	S	*	.	H	α-helix	trans	-70.6	-43.3	172	-72.7	172	-177.1	0	0	110.9	R55 G56	R55-E59 WeakPolarHBondContact O-CG 3.48Å; R55-E59 PolarHBondContact O-N 3.3Å; G56-E59 PolarHBondContact O-N 3.43Å
60	E	69.9	Low	77.9	Confident	54 Å²	54	54.3 Å²	54.3	25%	0.252	28%	0.282	S	S	.	.	H	α-helix	trans	-78.7	-29.5	177.1	-63.3	-64	152.4	0	0	112.7	G56 M66 M74 K77	G56-E60 PolarHBondContact O-N 3.41Å; G56-E60 VanDerWaalsContact O-N 3.14Å; E60-M66 HydrophobicContact CB-CE 4.06Å; E60-M74 HydrophobicContact CG-CG 4.31Å; E60-K77 IonicContact OE1-NZ 2.82Å; E60-K77 PolarHBondContact OE1-NZ 3.1Å; E60-K77 IonicContact OE2-NZ 2.72Å; E60-K77 PolarHBondContact OE2-NZ 3.25Å
61	S	76.8	Confident	77.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.284	C	S	.	.			trans	-133.9	87.3	178.6	-170.2	0	0	0	0	112	F57 R58 T63 G64 R65 M66 E70	F57-S61 WeakPolarHBondContact O-CA 3.44Å; F57-S61 WeakPolarHBondContact O-CB 3.25Å; F57-S61 PolarHBondContact O-N 3.41Å; R58-S61 CarbonylContact O-C 3.59Å; S61-T63 PolarHBondContact O-N 2.85Å; S61-T63 VanDerWaalsContact O-N 3.1Å; S61-T63 PolarHBondContact OG-OG1 3.42Å; S61-G64 PolarHBondContact O-N 2.76Å; S61-R65 PolarHBondContact OG-N 3.25Å; S61-R65 PolarHBondContact OG-O 3.05Å; S61-M66 WeakPolarHBondContact OG-CA 3.48Å; S61-M66 PolarHBondContact OG-N 3.32Å; S61-E70 WeakPolarHBondContact CB-OE2 3.45Å; S61-E70 PolarHBondContact OG-OE2 3.47Å
62	P	80.8	Confident	78	Confident	84 Å²	84	53.2 Å²	53.2	55%	0.545	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.4	-179.9	-24.8	34.7	0	0	0	114	R58 G64	R58-P62 PolarHBondContact NH1-O 3.24Å; R58-P62 PolarHBondContact NH2-O 2.93Å; R58-P62 WeakPolarHBondContact O-CA 3.5Å; P62-G64 VanDerWaalsContact C-N 3.3Å
63	T	82.7	Confident	78.2	Confident	101 Å²	101	56 Å²	56	62%	0.62	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-22.1	176.6	68.3	0	0	0	0	111.8	R58 S61 R65	R58-T63 VanDerWaalsContact NH1-C 3.32Å; R58-T63 PolarHBondContact NH1-O 3.2Å; S61-T63 PolarHBondContact O-N 2.85Å; S61-T63 VanDerWaalsContact O-N 3.1Å; S61-T63 PolarHBondContact OG-OG1 3.42Å; T63-R65 VanDerWaalsContact C-N 3.28Å; T63-R65 PolarHBondContact OG1-N 2.81Å; T63-R65 VanDerWaalsContact OG1-N 3.07Å; T63-R65 PolarHBondContact OG1-O 3Å
64	G	79.1	Confident	78.2	Confident	21 Å²	21	55.7 Å²	55.7	22%	0.216	28%	0.284	C	S	.	.	S	Bend	trans	80.4	10.3	-170.4	0	0	0	0	0	113.5	R58 S61 P62	R58-G64 VanDerWaalsContact NH1-N 3.1Å; S61-G64 PolarHBondContact O-N 2.76Å; P62-G64 VanDerWaalsContact C-N 3.3Å
65	R	83.3	Confident	77.8	Confident	148 Å²	148	55.2 Å²	55.2	56%	0.558	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.9	107.2	176.6	-84.8	-169.1	158.2	102.2	1.7	108.3	S61 T63 S67	S61-R65 PolarHBondContact OG-N 3.25Å; S61-R65 PolarHBondContact OG-O 3.05Å; T63-R65 VanDerWaalsContact C-N 3.28Å; T63-R65 PolarHBondContact OG1-N 2.81Å; T63-R65 VanDerWaalsContact OG1-N 3.07Å; T63-R65 PolarHBondContact OG1-O 3Å; R65-S67 PolarHBondContact O-N 2.79Å
66	M	82.6	Confident	77.6	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	117.1	-173.2	-176.2	167.3	-76.5	0	0	110.9	F57 E60 S61 E70 F71 M74 F92 S102 L103 F108	F57-M66 HydrophobicContact CD2-CE 3.43Å; F57-M66 VanDerWaalsContact CD2-CE 3.43Å; F57-M66 HydrophobicContact CD2-SD 4.3Å; F57-M66 HydrophobicContact CE2-CB 3.63Å; F57-M66 HydrophobicContact CE2-CE 3.52Å; F57-M66 HydrophobicContact CE2-CG 4.44Å; F57-M66 HydrophobicContact CE2-SD 3.96Å; F57-M66 HydrophobicContact CG-CE 4.21Å; F57-M66 HydrophobicContact CZ-CB 3.72Å; F57-M66 HydrophobicContact CZ-CE 4.35Å; E60-M66 HydrophobicContact CB-CE 4.06Å; S61-M66 WeakPolarHBondContact OG-CA 3.48Å; S61-M66 PolarHBondContact OG-N 3.32Å; M66-E70 VanDerWaalsContact CA-OE2 3.23Å; M66-E70 WeakPolarHBondContact CA-OE2 3.03Å; M66-E70 HydrophobicContact CG-CB 4Å; M66-F71 HydrophobicContact CG-CB 4.13Å; M66-F71 HydrophobicContact SD-CB 4.16Å; M66-F71 HydrophobicContact SD-CD2 3.88Å; M66-M74 HydrophobicContact CE-CE 3.12Å; M66-M74 HydrophobicContact SD-CE 3.22Å; M66-M74 WeakPolarHBondContact SD-CE 3.22Å; M66-F92 WeakPolarHBondContact O-CE2 3.15Å; M66-F92 WeakPolarHBondContact O-CZ 3.41Å; M66-S102 CarbonylContact O-C 3.44Å; M66-S102 VanDerWaalsContact O-CA 3.27Å; M66-S102 WeakPolarHBondContact O-CA 3.42Å; M66-L103 HydrophobicContact CB-CB 4.3Å; M66-L103 PolarHBondContact N-O 3.1Å; M66-L103 PolarHBondContact O-N 3.13Å; M66-F108 HydrophobicContact CE-CE2 4.45Å; M66-F108 HydrophobicContact SD-CD2 4.08Å; M66-F108 HydrophobicContact SD-CE2 4.11Å
67	S	86.4	Confident	77.3	Confident	29 Å²	29	58.5 Å²	58.5	20%	0.203	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	166.2	174.4	90.7	0	0	0	0	111.6	R65 E69 E70 F71	R65-S67 PolarHBondContact O-N 2.79Å; S67-E69 WeakPolarHBondContact CB-OE2 3.36Å; S67-E69 PolarHBondContact O-N 3.36Å; S67-E69 PolarHBondContact OG-N 2.86Å; S67-E69 PolarHBondContact OG-OE2 2.96Å; S67-E70 PolarHBondContact N-OE2 3.12Å; S67-E70 PolarHBondContact O-N 3.13Å; S67-E70 PolarHBondContact OG-N 3.32Å; S67-E70 VanDerWaalsContact OG-N 3.17Å; S67-F71 WeakPolarHBondContact O-CB 3.33Å; S67-F71 PolarHBondContact O-N 2.88Å
68	V	84.2	Confident	76.6	Confident	31 Å²	31	62.8 Å²	62.8	19%	0.188	32%	0.322	C	S	.	.	H	α-helix	trans	-57.4	-42.2	173.7	179.4	0	0	0	0	110.2	F71 M72 K89 F92	V68-F71 PolarHBondContact O-N 2.75Å; V68-M72 HydrophobicContact CG1-CG 4.35Å; V68-M72 HydrophobicContact CG1-SD 3.97Å; V68-M72 WeakPolarHBondContact O-CB 3.24Å; V68-M72 WeakPolarHBondContact O-CG 3.37Å; V68-M72 PolarHBondContact O-N 2.72Å; V68-K89 HydrophobicContact CG1-CG 3.9Å; V68-F92 HydrophobicContact CB-CD1 4.4Å; V68-F92 HydrophobicContact CB-CE1 4.39Å; V68-F92 HydrophobicContact CG2-CD1 3.47Å; V68-F92 VanDerWaalsContact CG2-CD1 3.47Å; V68-F92 HydrophobicContact CG2-CD2 4.48Å; V68-F92 HydrophobicContact CG2-CE1 3.33Å; V68-F92 HydrophobicContact CG2-CE2 4.36Å; V68-F92 HydrophobicContact CG2-CG 4.05Å; V68-F92 HydrophobicContact CG2-CZ 3.8Å
69	E	85.7	Confident	75.6	Confident	126 Å²	126	60.7 Å²	60.7	59%	0.589	32%	0.315	S	S	*	.	H	α-helix	trans	-65.6	-45.5	-179.8	-58.5	71.3	-154.4	0	0	111.2	S67 F71 M72 D73	S67-E69 WeakPolarHBondContact CB-OE2 3.36Å; S67-E69 PolarHBondContact O-N 3.36Å; S67-E69 PolarHBondContact OG-N 2.86Å; S67-E69 PolarHBondContact OG-OE2 2.96Å; E69-F71 VanDerWaalsContact C-N 3.29Å; E69-F71 PolarHBondContact O-N 3.37Å; E69-M72 PolarHBondContact O-N 3.46Å; E69-D73 PolarHBondContact O-N 3.49Å
70	E	82.2	Confident	75	Confident	46 Å²	46	57.9 Å²	57.9	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-60.8	-40.3	175.1	-68.8	174.4	159.4	0	0	111.1	S61 M66 S67 D73 M74	S61-E70 WeakPolarHBondContact CB-OE2 3.45Å; S61-E70 PolarHBondContact OG-OE2 3.47Å; M66-E70 VanDerWaalsContact CA-OE2 3.23Å; M66-E70 WeakPolarHBondContact CA-OE2 3.03Å; M66-E70 HydrophobicContact CG-CB 4Å; S67-E70 PolarHBondContact N-OE2 3.12Å; S67-E70 PolarHBondContact O-N 3.13Å; S67-E70 PolarHBondContact OG-N 3.32Å; S67-E70 VanDerWaalsContact OG-N 3.17Å; E70-D73 PolarHBondContact O-N 2.99Å; E70-M74 WeakPolarHBondContact O-CB 3.06Å; E70-M74 PolarHBondContact O-N 3.32Å
71	F	79.6	Confident	74.4	Confident	9 Å²	9	63.6 Å²	63.6	4%	0.039	34%	0.342	C	S	.	.	H	α-helix	trans	-66	-41.7	175.3	-174.2	-97.6	0	0	0	112.3	M66 S67 V68 E69 M74 Y75 A88 V91 F92	M66-F71 HydrophobicContact CG-CB 4.13Å; M66-F71 HydrophobicContact SD-CB 4.16Å; M66-F71 HydrophobicContact SD-CD2 3.88Å; S67-F71 WeakPolarHBondContact O-CB 3.33Å; S67-F71 PolarHBondContact O-N 2.88Å; V68-F71 PolarHBondContact O-N 2.75Å; E69-F71 VanDerWaalsContact C-N 3.29Å; E69-F71 PolarHBondContact O-N 3.37Å; F71-M74 HydrophobicContact CD2-CE 4.38Å; F71-M74 PolarHBondContact O-N 3.33Å; F71-Y75 HydrophobicContact CE1-CD2 4.47Å; F71-Y75 VanDerWaalsContact O-CB 3.29Å; F71-Y75 WeakPolarHBondContact O-CB 3.45Å; F71-Y75 PolarHBondContact O-N 3.37Å; F71-A88 HydrophobicContact CD1-CB 4.18Å; F71-A88 HydrophobicContact CE1-CB 4.2Å; F71-A88 WeakPolarHBondContact CE1-O 3.18Å; F71-V91 HydrophobicContact CE1-CB 4.28Å; F71-V91 HydrophobicContact CE1-CG1 4.12Å; F71-V91 HydrophobicContact CZ-CB 4.5Å; F71-V91 HydrophobicContact CZ-CG1 3.85Å; F71-F92 HydrophobicContact CB-CD2 3.58Å; F71-F92 HydrophobicContact CB-CE2 4Å; F71-F92 HydrophobicContact CD1-CB 4Å; F71-F92 AromaticContact CD1-CD2 3.99Å; F71-F92 HydrophobicContact CD1-CD2 3.99Å; F71-F92 HydrophobicContact CD2-CD2 4.26Å; F71-F92 HydrophobicContact CE1-CB 4.31Å; F71-F92 AromaticContact CG-CD2 3.69Å; F71-F92 HydrophobicContact CG-CD2 3.69Å; F71-F92 HydrophobicContact CG-CE2 4.47Å
72	M	78.5	Confident	73.5	Confident	27 Å²	27	66 Å²	66	13%	0.133	36%	0.359	C	S	.	.	H	α-helix	trans	-63.5	-42.5	176	-74.7	173.5	60.5	0	0	111.9	V68 E69 Y75 G76 E85 A88 K89	V68-M72 HydrophobicContact CG1-CG 4.35Å; V68-M72 HydrophobicContact CG1-SD 3.97Å; V68-M72 WeakPolarHBondContact O-CB 3.24Å; V68-M72 WeakPolarHBondContact O-CG 3.37Å; V68-M72 PolarHBondContact O-N 2.72Å; E69-M72 PolarHBondContact O-N 3.46Å; M72-Y75 PolarHBondContact O-N 2.8Å; M72-G76 PolarHBondContact O-N 2.89Å; M72-E85 HydrophobicContact CE-CB 3.48Å; M72-E85 VanDerWaalsContact CE-CB 3.48Å; M72-E85 HydrophobicContact CE-CG 3.54Å; M72-A88 HydrophobicContact CB-CB 4.48Å; M72-A88 HydrophobicContact CG-CB 3.89Å; M72-K89 HydrophobicContact CG-CG 4.26Å; M72-K89 HydrophobicContact SD-CD 4.04Å; M72-K89 WeakPolarHBondContact SD-CE 3.46Å; M72-K89 HydrophobicContact SD-CG 3.55Å; M72-K89 VanDerWaalsContact SD-CG 3.55Å
73	D	76.6	Confident	72.6	Confident	109 Å²	109	64.4 Å²	64.4	58%	0.583	36%	0.357	S	S	*	.	H	α-helix	trans	-62.5	-47.4	176.8	-109.6	28.5	0	0	0	110.8	E69 E70 Y75 G76 K77	E69-D73 PolarHBondContact O-N 3.49Å; E70-D73 PolarHBondContact O-N 2.99Å; D73-Y75 VanDerWaalsContact C-N 3.29Å; D73-Y75 PolarHBondContact O-N 3.41Å; D73-G76 PolarHBondContact O-N 2.82Å; D73-K77 VanDerWaalsContact O-CG 3.31Å; D73-K77 WeakPolarHBondContact O-CG 3.31Å; D73-K77 PolarHBondContact O-N 2.8Å
74	M	71.9	Confident	71.8	Confident	28 Å²	28	59.9 Å²	59.9	14%	0.138	33%	0.33	C	S	.	.	H	α-helix	trans	-57	-45.2	174.1	-171.7	-155.6	-39.5	0	0	111.2	E60 M66 E70 F71 K77 L78 F108	E60-M74 HydrophobicContact CG-CG 4.31Å; M66-M74 HydrophobicContact CE-CE 3.12Å; M66-M74 HydrophobicContact SD-CE 3.22Å; M66-M74 WeakPolarHBondContact SD-CE 3.22Å; E70-M74 WeakPolarHBondContact O-CB 3.06Å; E70-M74 PolarHBondContact O-N 3.32Å; F71-M74 HydrophobicContact CD2-CE 4.38Å; F71-M74 PolarHBondContact O-N 3.33Å; M74-K77 PolarHBondContact O-N 2.8Å; M74-L78 WeakPolarHBondContact O-CG 3.38Å; M74-L78 PolarHBondContact O-N 3.34Å; M74-F108 HydrophobicContact CE-CE2 3.8Å; M74-F108 HydrophobicContact CE-CZ 4.22Å; M74-F108 HydrophobicContact SD-CE2 4.15Å; M74-F108 HydrophobicContact SD-CZ 4.21Å
75	Y	66.4	Low	71.4	Confident	21 Å²	21	65 Å²	65	8%	0.082	35%	0.349	C	S	.	.	H	α-helix	trans	-65.1	-42.2	179.2	-162.2	-78	0	0	0	112.1	F14 F71 M72 D73 K77 L78 F79 A84 F87 A88	F14-Y75 HydrophobicContact CD2-CE2 4.36Å; F14-Y75 HydrophobicContact CE1-CE2 4.48Å; F14-Y75 AromaticContact CE2-CE2 3.34Å; F14-Y75 HydrophobicContact CE2-CE2 3.34Å; F14-Y75 AromaticContact CE2-CZ 3.66Å; F14-Y75 WeakPolarHBondContact CE2-OH 3.21Å; F14-Y75 HydrophobicContact CZ-CD2 4.36Å; F14-Y75 AromaticContact CZ-CE2 3.44Å; F14-Y75 HydrophobicContact CZ-CE2 3.44Å; F14-Y75 VanDerWaalsContact CZ-CE2 3.44Å; F71-Y75 HydrophobicContact CE1-CD2 4.47Å; F71-Y75 VanDerWaalsContact O-CB 3.29Å; F71-Y75 WeakPolarHBondContact O-CB 3.45Å; F71-Y75 PolarHBondContact O-N 3.37Å; M72-Y75 PolarHBondContact O-N 2.8Å; D73-Y75 VanDerWaalsContact C-N 3.29Å; D73-Y75 PolarHBondContact O-N 3.41Å; Y75-K77 VanDerWaalsContact C-N 3.32Å; Y75-K77 PolarHBondContact O-N 2.97Å; Y75-L78 WeakPolarHBondContact O-CB 3.22Å; Y75-L78 PolarHBondContact O-N 3.41Å; Y75-L78 VanDerWaalsContact O-N 3.12Å; Y75-F79 AromaticContact CD1-CD2 3.75Å; Y75-F79 HydrophobicContact CD1-CD2 3.75Å; Y75-F79 HydrophobicContact CD1-CE2 4.36Å; Y75-F79 HydrophobicContact CD2-CE2 4.5Å; Y75-F79 HydrophobicContact CE1-CB 4.45Å; Y75-F79 AromaticContact CE1-CD2 3.28Å; Y75-F79 HydrophobicContact CE1-CD2 3.28Å; Y75-F79 AromaticContact CE1-CE2 3.72Å; Y75-F79 HydrophobicContact CE1-CE2 3.72Å; Y75-F79 HydrophobicContact CE1-CG 4.11Å; Y75-F79 HydrophobicContact CE2-CD2 4.21Å; Y75-F79 AromaticContact CE2-CE2 3.86Å; Y75-F79 HydrophobicContact CE2-CE2 3.86Å; Y75-F79 HydrophobicContact CG-CD2 4.4Å; Y75-F79 AromaticContact CZ-CD2 3.57Å; Y75-F79 AromaticContact CZ-CE2 3.46Å; Y75-F79 VanDerWaalsContact CZ-CE2 3.46Å; Y75-F79 WeakPolarHBondContact O-CD2 3.27Å; Y75-F79 PolarHBondContact O-N 3.02Å; Y75-F79 VanDerWaalsContact O-N 3.08Å; Y75-A84 HydrophobicContact CD1-CB 3.37Å; Y75-A84 HydrophobicContact CE1-CB 3.25Å; Y75-F87 WeakPolarHBondContact OH-CD1 3.24Å; Y75-A88 HydrophobicContact CD1-CB 4.19Å; Y75-A88 HydrophobicContact CD2-CB 4.3Å; Y75-A88 HydrophobicContact CG-CB 3.83Å
76	G	65	Low	70.7	Confident	35 Å²	35	61.6 Å²	61.6	36%	0.361	35%	0.348	S	S	.	.	H	α-helix	trans	-63	-36.1	177.1	0	0	0	0	0	112.7	M72 D73 L78 F79	M72-G76 PolarHBondContact O-N 2.89Å; D73-G76 PolarHBondContact O-N 2.82Å; G76-L78 VanDerWaalsContact C-N 3.3Å; G76-L78 PolarHBondContact O-N 3.07Å; G76-F79 CarbonylContact O-C 3.54Å; G76-F79 VanDerWaalsContact O-C 3.26Å; G76-F79 PolarHBondContact O-N 2.85Å
77	K	66.7	Low	70.1	Confident	127 Å²	127	62.4 Å²	62.4	55%	0.552	35%	0.351	S	S	*	.	H	α-helix	trans	-63.9	-34.4	172.9	-68.5	170.3	-165.1	171.3	0	112.5	E60 D73 M74 Y75	E60-K77 IonicContact OE1-NZ 2.82Å; E60-K77 PolarHBondContact OE1-NZ 3.1Å; E60-K77 IonicContact OE2-NZ 2.72Å; E60-K77 PolarHBondContact OE2-NZ 3.25Å; D73-K77 VanDerWaalsContact O-CG 3.31Å; D73-K77 WeakPolarHBondContact O-CG 3.31Å; D73-K77 PolarHBondContact O-N 2.8Å; M74-K77 PolarHBondContact O-N 2.8Å; Y75-K77 VanDerWaalsContact C-N 3.32Å; Y75-K77 PolarHBondContact O-N 2.97Å
78	L	59.5	Low	69.4	Low	93 Å²	93	61 Å²	61	49%	0.487	34%	0.341	S	S	.	.	H	α-helix	trans	-75.4	-31.1	177.8	-66.3	174.1	0	0	0	112.6	M74 Y75 G76 P80	M74-L78 WeakPolarHBondContact O-CG 3.38Å; M74-L78 PolarHBondContact O-N 3.34Å; Y75-L78 WeakPolarHBondContact O-CB 3.22Å; Y75-L78 PolarHBondContact O-N 3.41Å; Y75-L78 VanDerWaalsContact O-N 3.12Å; G76-L78 VanDerWaalsContact C-N 3.3Å; G76-L78 PolarHBondContact O-N 3.07Å; L78-P80 VanDerWaalsContact C-CD 3.45Å; L78-P80 WeakPolarHBondContact O-CD 3.02Å
79	F	56	Low	69.1	Low	37 Å²	37	65 Å²	65	16%	0.162	36%	0.356	C	S	.	.	S	Bend	trans	-128.9	65.7	-177.3	-57.2	-83.8	0	0	0	111.8	V13 T17 Y75 G76 N81 S82	V13-F79 HydrophobicContact CG1-CE1 4.12Å; T17-F79 HydrophobicContact CG2-CE1 3.7Å; T17-F79 HydrophobicContact CG2-CZ 4.13Å; T17-F79 VanDerWaalsContact OG1-CZ 3.31Å; T17-F79 WeakPolarHBondContact OG1-CZ 3.47Å; Y75-F79 AromaticContact CD1-CD2 3.75Å; Y75-F79 HydrophobicContact CD1-CD2 3.75Å; Y75-F79 HydrophobicContact CD1-CE2 4.36Å; Y75-F79 HydrophobicContact CD2-CE2 4.5Å; Y75-F79 HydrophobicContact CE1-CB 4.45Å; Y75-F79 AromaticContact CE1-CD2 3.28Å; Y75-F79 HydrophobicContact CE1-CD2 3.28Å; Y75-F79 AromaticContact CE1-CE2 3.72Å; Y75-F79 HydrophobicContact CE1-CE2 3.72Å; Y75-F79 HydrophobicContact CE1-CG 4.11Å; Y75-F79 HydrophobicContact CE2-CD2 4.21Å; Y75-F79 AromaticContact CE2-CE2 3.86Å; Y75-F79 HydrophobicContact CE2-CE2 3.86Å; Y75-F79 HydrophobicContact CG-CD2 4.4Å; Y75-F79 AromaticContact CZ-CD2 3.57Å; Y75-F79 AromaticContact CZ-CE2 3.46Å; Y75-F79 VanDerWaalsContact CZ-CE2 3.46Å; Y75-F79 WeakPolarHBondContact O-CD2 3.27Å; Y75-F79 PolarHBondContact O-N 3.02Å; Y75-F79 VanDerWaalsContact O-N 3.08Å; G76-F79 CarbonylContact O-C 3.54Å; G76-F79 VanDerWaalsContact O-C 3.26Å; G76-F79 PolarHBondContact O-N 2.85Å; F79-N81 PolarHBondContact O-N 3.29Å; F79-S82 WeakPolarHBondContact CB-OG 3.2Å; F79-S82 WeakPolarHBondContact O-CB 3.45Å; F79-S82 PolarHBondContact O-N 3.49Å; F79-S82 VanDerWaalsContact O-N 3.09Å; F79-S82 PolarHBondContact O-OG 2.99Å
80	P	60.6	Low	68.4	Low	89 Å²	89	60.8 Å²	60.8	58%	0.578	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	133.8	177	23.7	-31.9	0	0	0	109.8	L78	L78-P80 VanDerWaalsContact C-CD 3.45Å; L78-P80 WeakPolarHBondContact O-CD 3.02Å
81	N	59.1	Low	68	Low	174 Å²	174	58.7 Å²	58.7	93%	0.93	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	11.4	-175.9	-41.8	-59.5	0	0	0	116.5	F79	F79-N81 PolarHBondContact O-N 3.29Å
82	S	57.4	Low	68	Low	51 Å²	51	58.5 Å²	58.5	36%	0.357	33%	0.325	S	S	.	.	S	Bend	trans	-91.5	143	166.9	66.2	0	0	0	0	110.1	F79 A84	F79-S82 WeakPolarHBondContact CB-OG 3.2Å; F79-S82 WeakPolarHBondContact O-CB 3.45Å; F79-S82 PolarHBondContact O-N 3.49Å; F79-S82 VanDerWaalsContact O-N 3.09Å; F79-S82 PolarHBondContact O-OG 2.99Å; S82-A84 PolarHBondContact O-N 3.28Å; S82-A84 WeakPolarHBondContact OG-CB 3.2Å
83	G	62.2	Low	67.9	Low	50 Å²	50	59 Å²	59	52%	0.515	34%	0.338	S	S	.	.			trans	-69.7	33.4	169.5	0	0	0	0	0	112.8	E85 L154	G83-E85 PolarHBondContact O-N 3.36Å; G83-E85 VanDerWaalsContact O-N 3.11Å; G83-L154 WeakPolarHBondContact O-CD2 3.27Å
84	A	65	Low	67.6	Low	6 Å²	6	54 Å²	54	5%	0.05	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.4	-163.1	0	0	0	0	0	115.3	Y75 S82 S86 F87 A88	Y75-A84 HydrophobicContact CD1-CB 3.37Å; Y75-A84 HydrophobicContact CE1-CB 3.25Å; S82-A84 PolarHBondContact O-N 3.28Å; S82-A84 WeakPolarHBondContact OG-CB 3.2Å; A84-S86 VanDerWaalsContact C-N 3.26Å; A84-S86 PolarHBondContact O-N 3.09Å; A84-F87 CarbonylContact O-C 3.26Å; A84-F87 PolarHBondContact O-N 3.35Å; A84-A88 WeakPolarHBondContact O-CB 3.48Å; A84-A88 PolarHBondContact O-N 3.23Å
85	E	70.7	Confident	67.5	Low	129 Å²	129	54.4 Å²	54.4	60%	0.603	31%	0.312	S	S	*	.	H	α-helix	trans	-50.5	-46.6	179.7	-69.7	-172.7	-170	0	0	112.7	M72 G83 F87 A88 K89	M72-E85 HydrophobicContact CE-CB 3.48Å; M72-E85 VanDerWaalsContact CE-CB 3.48Å; M72-E85 HydrophobicContact CE-CG 3.54Å; G83-E85 PolarHBondContact O-N 3.36Å; G83-E85 VanDerWaalsContact O-N 3.11Å; E85-F87 VanDerWaalsContact C-N 3.3Å; E85-F87 PolarHBondContact O-N 3.13Å; E85-A88 PolarHBondContact O-N 3.09Å; E85-K89 WeakPolarHBondContact O-CG 3.35Å; E85-K89 PolarHBondContact O-N 2.95Å
86	S	69.3	Low	67.9	Low	77 Å²	77	54.4 Å²	54.4	54%	0.538	31%	0.314	S	S	.	.	H	α-helix	trans	-65.5	-36.2	-179.4	-61.7	0	0	0	0	111.9	A84 F90	A84-S86 VanDerWaalsContact C-N 3.26Å; A84-S86 PolarHBondContact O-N 3.09Å; S86-F90 WeakPolarHBondContact O-CB 3.3Å; S86-F90 PolarHBondContact O-N 3.17Å
87	F	69.2	Low	67.7	Low	16 Å²	16	58.3 Å²	58.3	7%	0.07	33%	0.326	C	S	.	.	H	α-helix	trans	-77.2	-38.7	177.7	-167.5	-125.5	0	0	0	112.6	L10 F14 Y75 A84 E85 K89 F90 V91 L154	L10-F87 HydrophobicContact CD2-CZ 4.44Å; F14-F87 AromaticContact CD2-CE1 3.8Å; F14-F87 HydrophobicContact CD2-CE1 3.8Å; F14-F87 HydrophobicContact CE2-CD1 4.06Å; F14-F87 AromaticContact CE2-CE1 3.43Å; F14-F87 HydrophobicContact CE2-CE1 3.43Å; F14-F87 VanDerWaalsContact CE2-CE1 3.43Å; F14-F87 HydrophobicContact CE2-CZ 4.35Å; Y75-F87 WeakPolarHBondContact OH-CD1 3.24Å; A84-F87 CarbonylContact O-C 3.26Å; A84-F87 PolarHBondContact O-N 3.35Å; E85-F87 VanDerWaalsContact C-N 3.3Å; E85-F87 PolarHBondContact O-N 3.13Å; F87-K89 VanDerWaalsContact C-N 3.31Å; F87-K89 PolarHBondContact O-N 2.69Å; F87-F90 HydrophobicContact CD2-CD1 4.19Å; F87-F90 HydrophobicContact CE2-CD1 4.2Å; F87-F90 CarbonylContact O-C 3.58Å; F87-F90 WeakPolarHBondContact O-CB 3.36Å; F87-F90 PolarHBondContact O-N 3.09Å; F87-F90 VanDerWaalsContact O-N 3.09Å; F87-V91 HydrophobicContact CD1-CG2 4.11Å; F87-V91 HydrophobicContact CD2-CG2 4.41Å; F87-V91 HydrophobicContact CE1-CG2 3.93Å; F87-V91 HydrophobicContact CE2-CG2 4.2Å; F87-V91 HydrophobicContact CG-CG2 4.36Å; F87-V91 HydrophobicContact CZ-CG2 3.94Å; F87-V91 WeakPolarHBondContact O-CB 3.05Å; F87-V91 WeakPolarHBondContact O-CG2 3.45Å; F87-V91 PolarHBondContact O-N 3.2Å; F87-L154 HydrophobicContact CB-CD1 3.35Å; F87-L154 HydrophobicContact CB-CD2 3.49Å; F87-L154 VanDerWaalsContact CB-CD2 3.49Å; F87-L154 HydrophobicContact CB-CG 3.98Å; F87-L154 HydrophobicContact CD1-CD1 4.11Å; F87-L154 HydrophobicContact CD2-CD1 3.62Å; F87-L154 HydrophobicContact CE2-CD1 4.43Å; F87-L154 HydrophobicContact CG-CD1 3.44Å; F87-L154 VanDerWaalsContact CG-CD1 3.44Å; F87-L154 HydrophobicContact CG-CD2 4.49Å
88	A	72	Confident	67.7	Low	0 Å²	0	57.5 Å²	57.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-59.4	-44.5	174.9	0	0	0	0	0	110.4	F71 M72 Y75 A84 E85 F90 V91 F92	F71-A88 HydrophobicContact CD1-CB 4.18Å; F71-A88 HydrophobicContact CE1-CB 4.2Å; F71-A88 WeakPolarHBondContact CE1-O 3.18Å; M72-A88 HydrophobicContact CB-CB 4.48Å; M72-A88 HydrophobicContact CG-CB 3.89Å; Y75-A88 HydrophobicContact CD1-CB 4.19Å; Y75-A88 HydrophobicContact CD2-CB 4.3Å; Y75-A88 HydrophobicContact CG-CB 3.83Å; A84-A88 WeakPolarHBondContact O-CB 3.48Å; A84-A88 PolarHBondContact O-N 3.23Å; E85-A88 PolarHBondContact O-N 3.09Å; A88-F90 VanDerWaalsContact C-N 3.31Å; A88-F90 PolarHBondContact O-N 3.38Å; A88-V91 PolarHBondContact O-N 3.46Å; A88-F92 VanDerWaalsContact O-CB 3.29Å; A88-F92 WeakPolarHBondContact O-CB 3.3Å; A88-F92 PolarHBondContact O-N 2.74Å
89	K	77.7	Confident	68.2	Low	115 Å²	115	60.6 Å²	60.6	50%	0.5	34%	0.337	S	S	.	.	H	α-helix	trans	-58.2	-43.3	172.1	-73.7	179.6	-178	177.4	0	112.3	V68 M72 E85 F87 F92 G93	V68-K89 HydrophobicContact CG1-CG 3.9Å; M72-K89 HydrophobicContact CG-CG 4.26Å; M72-K89 HydrophobicContact SD-CD 4.04Å; M72-K89 WeakPolarHBondContact SD-CE 3.46Å; M72-K89 HydrophobicContact SD-CG 3.55Å; M72-K89 VanDerWaalsContact SD-CG 3.55Å; E85-K89 WeakPolarHBondContact O-CG 3.35Å; E85-K89 PolarHBondContact O-N 2.95Å; F87-K89 VanDerWaalsContact C-N 3.31Å; F87-K89 PolarHBondContact O-N 2.69Å; K89-F92 PolarHBondContact O-N 3.01Å; K89-G93 PolarHBondContact O-N 2.93Å
90	F	72	Confident	69.1	Low	38 Å²	38	62.1 Å²	62.1	17%	0.167	35%	0.347	C	S	.	.	H	α-helix	trans	-66.3	-45.8	-179.5	-177.9	-110.8	0	0	0	112.2	S86 F87 A88 G93 S94 L130 T133 I147	S86-F90 WeakPolarHBondContact O-CB 3.3Å; S86-F90 PolarHBondContact O-N 3.17Å; F87-F90 HydrophobicContact CD2-CD1 4.19Å; F87-F90 HydrophobicContact CE2-CD1 4.2Å; F87-F90 CarbonylContact O-C 3.58Å; F87-F90 WeakPolarHBondContact O-CB 3.36Å; F87-F90 PolarHBondContact O-N 3.09Å; F87-F90 VanDerWaalsContact O-N 3.09Å; A88-F90 VanDerWaalsContact C-N 3.31Å; A88-F90 PolarHBondContact O-N 3.38Å; F90-G93 PolarHBondContact O-N 2.69Å; F90-S94 PolarHBondContact O-N 3.29Å; F90-L130 HydrophobicContact CD1-CD1 3.53Å; F90-L130 HydrophobicContact CD1-CD2 4.47Å; F90-L130 HydrophobicContact CD1-CG 4.05Å; F90-L130 HydrophobicContact CE1-CD1 3.29Å; F90-L130 HydrophobicContact CE1-CD2 3.86Å; F90-L130 HydrophobicContact CE1-CG 3.32Å; F90-L130 HydrophobicContact CG-CD1 4.3Å; F90-L130 HydrophobicContact CZ-CD1 3.85Å; F90-L130 HydrophobicContact CZ-CG 3.79Å; F90-L130 WeakPolarHBondContact CZ-O 3.42Å; F90-T133 HydrophobicContact CE2-CG2 3.9Å; F90-I147 HydrophobicContact CE1-CD1 4.12Å; F90-I147 HydrophobicContact CE1-CG1 3.96Å; F90-I147 HydrophobicContact CE1-CG2 4.04Å; F90-I147 HydrophobicContact CE2-CD1 3.98Å; F90-I147 HydrophobicContact CE2-CG1 3.85Å; F90-I147 HydrophobicContact CZ-CB 4.45Å; F90-I147 HydrophobicContact CZ-CD1 3.3Å; F90-I147 HydrophobicContact CZ-CG1 3.36Å; F90-I147 HydrophobicContact CZ-CG2 4.29Å
91	V	73.8	Confident	70	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.006	34%	0.336	C	S	.	.	H	α-helix	trans	-61	-45.1	173.8	172	0	0	0	0	110.5	F14 F71 F87 A88 G93 S94 W126 L130	F14-V91 HydrophobicContact CE2-CG2 4.35Å; F14-V91 HydrophobicContact CZ-CG1 4.31Å; F14-V91 HydrophobicContact CZ-CG2 4.25Å; F71-V91 HydrophobicContact CE1-CB 4.28Å; F71-V91 HydrophobicContact CE1-CG1 4.12Å; F71-V91 HydrophobicContact CZ-CB 4.5Å; F71-V91 HydrophobicContact CZ-CG1 3.85Å; F87-V91 HydrophobicContact CD1-CG2 4.11Å; F87-V91 HydrophobicContact CD2-CG2 4.41Å; F87-V91 HydrophobicContact CE1-CG2 3.93Å; F87-V91 HydrophobicContact CE2-CG2 4.2Å; F87-V91 HydrophobicContact CG-CG2 4.36Å; F87-V91 HydrophobicContact CZ-CG2 3.94Å; F87-V91 WeakPolarHBondContact O-CB 3.05Å; F87-V91 WeakPolarHBondContact O-CG2 3.45Å; F87-V91 PolarHBondContact O-N 3.2Å; A88-V91 PolarHBondContact O-N 3.46Å; V91-G93 PolarHBondContact O-N 2.84Å; V91-S94 WeakPolarHBondContact O-CB 3.43Å; V91-S94 PolarHBondContact O-N 2.64Å; V91-S94 VanDerWaalsContact O-N 3.1Å; V91-S94 PolarHBondContact O-OG 3.16Å; V91-W126 HydrophobicContact CG1-CZ2 4.41Å; V91-L130 HydrophobicContact CG2-CD1 4.43Å
92	F	77.9	Confident	71.1	Confident	5 Å²	5	52.1 Å²	52.1	2%	0.022	30%	0.298	C	S	.	.	H	α-helix	trans	-58.4	-46.6	177.3	-170.9	-81.1	0	0	0	111.8	M66 V68 F71 A88 K89 S94 F95 D96 L103	M66-F92 WeakPolarHBondContact O-CE2 3.15Å; M66-F92 WeakPolarHBondContact O-CZ 3.41Å; V68-F92 HydrophobicContact CB-CD1 4.4Å; V68-F92 HydrophobicContact CB-CE1 4.39Å; V68-F92 HydrophobicContact CG2-CD1 3.47Å; V68-F92 VanDerWaalsContact CG2-CD1 3.47Å; V68-F92 HydrophobicContact CG2-CD2 4.48Å; V68-F92 HydrophobicContact CG2-CE1 3.33Å; V68-F92 HydrophobicContact CG2-CE2 4.36Å; V68-F92 HydrophobicContact CG2-CG 4.05Å; V68-F92 HydrophobicContact CG2-CZ 3.8Å; F71-F92 HydrophobicContact CB-CD2 3.58Å; F71-F92 HydrophobicContact CB-CE2 4Å; F71-F92 HydrophobicContact CD1-CB 4Å; F71-F92 AromaticContact CD1-CD2 3.99Å; F71-F92 HydrophobicContact CD1-CD2 3.99Å; F71-F92 HydrophobicContact CD2-CD2 4.26Å; F71-F92 HydrophobicContact CE1-CB 4.31Å; F71-F92 AromaticContact CG-CD2 3.69Å; F71-F92 HydrophobicContact CG-CD2 3.69Å; F71-F92 HydrophobicContact CG-CE2 4.47Å; A88-F92 VanDerWaalsContact O-CB 3.29Å; A88-F92 WeakPolarHBondContact O-CB 3.3Å; A88-F92 PolarHBondContact O-N 2.74Å; K89-F92 PolarHBondContact O-N 3.01Å; F92-S94 PolarHBondContact O-N 2.99Å; F92-S94 VanDerWaalsContact O-N 3.12Å; F92-F95 PolarHBondContact O-N 3.17Å; F92-D96 HydrophobicContact CD1-CB 4Å; F92-D96 HydrophobicContact CE1-CB 3.72Å; F92-D96 PolarHBondContact O-N 2.83Å; F92-L103 HydrophobicContact CE2-CB 3.97Å; F92-L103 HydrophobicContact CZ-CB 4.22Å
93	G	76.8	Confident	72.2	Confident	38 Å²	38	50 Å²	50	39%	0.392	28%	0.283	S	S	.	.	H	α-helix	trans	-63	-16.8	177.8	0	0	0	0	0	114.6	K89 F90 V91 F95	K89-G93 PolarHBondContact O-N 2.93Å; F90-G93 PolarHBondContact O-N 2.69Å; V91-G93 PolarHBondContact O-N 2.84Å; G93-F95 VanDerWaalsContact C-N 3.32Å
94	S	70.2	Confident	73.2	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-75.7	-19.4	172.7	76.8	0	0	0	0	113.9	F90 V91 F92 W126	F90-S94 PolarHBondContact O-N 3.29Å; V91-S94 WeakPolarHBondContact O-CB 3.43Å; V91-S94 PolarHBondContact O-N 2.64Å; V91-S94 VanDerWaalsContact O-N 3.1Å; V91-S94 PolarHBondContact O-OG 3.16Å; F92-S94 PolarHBondContact O-N 2.99Å; F92-S94 VanDerWaalsContact O-N 3.12Å; S94-W126 PolarHBondContact OG-NE1 2.68Å
95	F	70.5	Confident	74.1	Confident	38 Å²	38	49.5 Å²	49.5	17%	0.167	27%	0.269	C	S	.	.	H	α-helix	trans	-115.1	-22.5	-177.3	-73.1	-79.5	0	0	0	115	F92 G93 L97 L103 L111 W126	F92-F95 PolarHBondContact O-N 3.17Å; G93-F95 VanDerWaalsContact C-N 3.32Å; F95-L97 PolarHBondContact O-N 3.41Å; F95-L103 HydrophobicContact CB-CD1 3.88Å; F95-L111 HydrophobicContact CD1-CB 3.8Å; F95-L111 HydrophobicContact CD2-CB 4.17Å; F95-L111 HydrophobicContact CD2-CD1 3.97Å; F95-L111 HydrophobicContact CD2-CD2 3.56Å; F95-L111 HydrophobicContact CD2-CG 4.02Å; F95-L111 HydrophobicContact CE1-CB 3.46Å; F95-L111 VanDerWaalsContact CE1-CB 3.46Å; F95-L111 HydrophobicContact CE1-CD1 4.11Å; F95-L111 HydrophobicContact CE1-CG 4.17Å; F95-L111 HydrophobicContact CE2-CB 3.82Å; F95-L111 HydrophobicContact CE2-CD1 3.06Å; F95-L111 HydrophobicContact CE2-CD2 3.57Å; F95-L111 HydrophobicContact CE2-CG 3.56Å; F95-L111 HydrophobicContact CG-CB 4.14Å; F95-L111 HydrophobicContact CG-CD2 4.07Å; F95-L111 HydrophobicContact CG-CG 4.46Å; F95-L111 HydrophobicContact CZ-CB 3.44Å; F95-L111 VanDerWaalsContact CZ-CB 3.44Å; F95-L111 HydrophobicContact CZ-CD1 3.15Å; F95-L111 HydrophobicContact CZ-CD2 4.15Å; F95-L111 HydrophobicContact CZ-CG 3.65Å; F95-W126 AromaticContact CD2-NE1 3.91Å; F95-W126 AromaticContact CE1-CD1 3.86Å; F95-W126 AromaticContact CE2-CD1 3.57Å; F95-W126 AromaticContact CE2-CE2 3.62Å; F95-W126 HydrophobicContact CE2-CZ2 4.05Å; F95-W126 AromaticContact CE2-NE1 2.86Å; F95-W126 AromaticContact CZ-CD1 3.07Å; F95-W126 HydrophobicContact CZ-CD2 4.47Å; F95-W126 AromaticContact CZ-CE2 3.82Å; F95-W126 HydrophobicContact CZ-CG 4.05Å; F95-W126 AromaticContact CZ-NE1 2.93Å
96	D	73.6	Confident	74.6	Confident	20 Å²	20	46.2 Å²	46.2	11%	0.107	26%	0.255	C	S	.	.			trans	-71.6	62.6	168.4	-172.4	19	0	0	0	110.2	F92 D98 K99 N100 G101	F92-D96 HydrophobicContact CD1-CB 4Å; F92-D96 HydrophobicContact CE1-CB 3.72Å; F92-D96 PolarHBondContact O-N 2.83Å; D96-D98 PolarHBondContact O-N 3.3Å; D96-K99 PolarHBondContact O-N 3.36Å; D96-K99 WeakPolarHBondContact OD1-CA 3.33Å; D96-K99 PolarHBondContact OD1-N 3.37Å; D96-K99 WeakPolarHBondContact OD2-CA 3.5Å; D96-N100 PolarHBondContact OD1-N 3.39Å; D96-N100 PolarHBondContact OD2-N 2.65Å; D96-G101 PolarHBondContact OD1-N 3.49Å; D96-G101 VanDerWaalsContact OD2-CA 3.32Å; D96-G101 WeakPolarHBondContact OD2-CA 3.39Å; D96-G101 PolarHBondContact OD2-N 2.96Å
97	L	62.4	Low	75.2	Confident	118 Å²	118	43.4 Å²	43.4	62%	0.618	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-30.6	-174.2	-66	179	0	0	0	111.8	F95 K99	F95-L97 PolarHBondContact O-N 3.41Å; L97-K99 VanDerWaalsContact C-N 3.32Å
98	D	65.9	Low	75.6	Confident	110 Å²	110	43 Å²	43	59%	0.588	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	2.4	175.9	62.2	-18.5	0	0	0	113.1	D96 N100	D96-D98 PolarHBondContact O-N 3.3Å; D98-N100 PolarHBondContact O-N 3.46Å; D98-N100 VanDerWaalsContact O-N 3.1Å; D98-N100 PolarHBondContact OD1-ND2 3.41Å; D98-N100 VanDerWaalsContact OD1-ND2 3.07Å; D98-N100 PolarHBondContact OD2-ND2 2.64Å
99	K	69.6	Low	76.1	Confident	157 Å²	157	43 Å²	43	68%	0.683	24%	0.237	S	C	*	.			trans	49.6	35.3	178.6	-60.1	-174.5	178.7	-178.7	0	111.9	D96 L97	D96-K99 PolarHBondContact O-N 3.36Å; D96-K99 WeakPolarHBondContact OD1-CA 3.33Å; D96-K99 PolarHBondContact OD1-N 3.37Å; D96-K99 WeakPolarHBondContact OD2-CA 3.5Å; L97-K99 VanDerWaalsContact C-N 3.32Å
100	N	75.5	Confident	76.2	Confident	69 Å²	69	40.3 Å²	40.3	37%	0.369	23%	0.23	S	C	.	.	S	Bend	trans	-84.8	-5.7	-177	79	27.8	0	0	0	111.3	D96 D98 S102	D96-N100 PolarHBondContact OD1-N 3.39Å; D96-N100 PolarHBondContact OD2-N 2.65Å; D98-N100 PolarHBondContact O-N 3.46Å; D98-N100 VanDerWaalsContact O-N 3.1Å; D98-N100 PolarHBondContact OD1-ND2 3.41Å; D98-N100 VanDerWaalsContact OD1-ND2 3.07Å; D98-N100 PolarHBondContact OD2-ND2 2.64Å; N100-S102 VanDerWaalsContact C-N 3.33Å; N100-S102 VanDerWaalsContact OD1-CA 3.23Å; N100-S102 WeakPolarHBondContact OD1-CA 3.5Å; N100-S102 WeakPolarHBondContact OD1-CB 3.04Å; N100-S102 PolarHBondContact OD1-N 2.78Å; N100-S102 PolarHBondContact OD1-O 3.03Å; N100-S102 PolarHBondContact OD1-OG 2.65Å
101	G	78.4	Confident	76.3	Confident	35 Å²	35	38.7 Å²	38.7	36%	0.361	22%	0.223	S	C	.	.	S	Bend	trans	79.7	11.7	-179.2	0	0	0	0	0	114	D96	D96-G101 PolarHBondContact OD1-N 3.49Å; D96-G101 VanDerWaalsContact OD2-CA 3.32Å; D96-G101 WeakPolarHBondContact OD2-CA 3.39Å; D96-G101 PolarHBondContact OD2-N 2.96Å
102	S	83	Confident	76.4	Confident	19 Å²	19	40.9 Å²	40.9	13%	0.133	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	135.5	-175.4	74.7	0	0	0	0	113.3	M66 N100	M66-S102 CarbonylContact O-C 3.44Å; M66-S102 VanDerWaalsContact O-CA 3.27Å; M66-S102 WeakPolarHBondContact O-CA 3.42Å; N100-S102 VanDerWaalsContact C-N 3.33Å; N100-S102 VanDerWaalsContact OD1-CA 3.23Å; N100-S102 WeakPolarHBondContact OD1-CA 3.5Å; N100-S102 WeakPolarHBondContact OD1-CB 3.04Å; N100-S102 PolarHBondContact OD1-N 2.78Å; N100-S102 PolarHBondContact OD1-O 3.03Å; N100-S102 PolarHBondContact OD1-OG 2.65Å
103	L	79.6	Confident	76.4	Confident	7 Å²	7	41 Å²	41	4%	0.037	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	124.5	174.7	-172.9	61.7	0	0	0	109.7	F57 M66 F92 F95 F108 L111	F57-L103 WeakPolarHBondContact CZ-O 3.4Å; M66-L103 HydrophobicContact CB-CB 4.3Å; M66-L103 PolarHBondContact N-O 3.1Å; M66-L103 PolarHBondContact O-N 3.13Å; F92-L103 HydrophobicContact CE2-CB 3.97Å; F92-L103 HydrophobicContact CZ-CB 4.22Å; F95-L103 HydrophobicContact CB-CD1 3.88Å; L103-F108 HydrophobicContact CD2-CB 3.83Å; L103-F108 HydrophobicContact CD2-CD2 3.96Å; L103-F108 HydrophobicContact CD2-CG 4.41Å; L103-F108 HydrophobicContact CG-CB 4.08Å; L103-L111 HydrophobicContact CD2-CD2 4.34Å
104	T	84.2	Confident	76.1	Confident	38 Å²	38	40.5 Å²	40.5	23%	0.233	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	159	171.7	60.2	0	0	0	0	110.7	D106 G107 F108	T104-D106 VanDerWaalsContact C-N 3.26Å; T104-D106 WeakPolarHBondContact CB-OD1 3.47Å; T104-D106 PolarHBondContact O-N 3Å; T104-D106 PolarHBondContact OG1-OD1 3.47Å; T104-D106 PolarHBondContact OG1-OD2 3.38Å; T104-G107 PolarHBondContact O-N 2.97Å; T104-G107 VanDerWaalsContact O-N 3.12Å; T104-G107 PolarHBondContact OG1-N 2.73Å; T104-F108 PolarHBondContact O-N 3.4Å
105	F	82.9	Confident	75.9	Confident	6 Å²	6	40.7 Å²	40.7	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-58.3	-39.1	177.7	178.2	-112.2	0	0	0	113	L39 V50 I53 Y54 F57 F108 L109	L39-F105 HydrophobicContact CD1-CD1 3.79Å; L39-F105 HydrophobicContact CD1-CE1 3.6Å; V50-F105 HydrophobicContact CG1-CE1 4.09Å; V50-F105 HydrophobicContact CG1-CZ 4.29Å; I53-F105 HydrophobicContact CB-CE2 4.48Å; I53-F105 HydrophobicContact CG2-CE2 3.99Å; I53-F105 HydrophobicContact CG2-CZ 4.41Å; Y54-F105 VanDerWaalsContact CA-CZ 3.46Å; Y54-F105 VanDerWaalsContact CB-CZ 3.43Å; Y54-F105 HydrophobicContact CD2-CB 4.38Å; Y54-F105 AromaticContact CD2-CD1 3.59Å; Y54-F105 HydrophobicContact CD2-CD1 3.59Å; Y54-F105 AromaticContact CD2-CD2 3.8Å; Y54-F105 HydrophobicContact CD2-CD2 3.8Å; Y54-F105 AromaticContact CD2-CE1 3.68Å; Y54-F105 HydrophobicContact CD2-CE1 3.68Å; Y54-F105 AromaticContact CD2-CE2 3.94Å; Y54-F105 HydrophobicContact CD2-CE2 3.94Å; Y54-F105 AromaticContact CD2-CG 3.62Å; Y54-F105 HydrophobicContact CD2-CG 3.62Å; Y54-F105 AromaticContact CD2-CZ 3.88Å; Y54-F105 HydrophobicContact CD2-CZ 3.88Å; Y54-F105 HydrophobicContact CE2-CD1 4.28Å; Y54-F105 HydrophobicContact CE2-CG 4.22Å; Y54-F105 HydrophobicContact CG-CE1 4.23Å; Y54-F105 HydrophobicContact CG-CE2 4.36Å; Y54-F105 HydrophobicContact CG-CZ 4.15Å; F57-F105 HydrophobicContact CB-CD2 3.83Å; F57-F105 HydrophobicContact CB-CE2 4.06Å; F57-F105 HydrophobicContact CD1-CB 4.15Å; F57-F105 AromaticContact CD1-CD2 3.84Å; F57-F105 HydrophobicContact CD1-CD2 3.84Å; F57-F105 HydrophobicContact CD1-CG 4.43Å; F57-F105 HydrophobicContact CD2-CD2 4.11Å; F57-F105 HydrophobicContact CE1-CB 3.98Å; F57-F105 HydrophobicContact CE1-CD2 4.43Å; F57-F105 AromaticContact CG-CD2 3.66Å; F57-F105 HydrophobicContact CG-CD2 3.66Å; F57-F105 HydrophobicContact CG-CE2 4.36Å; F57-F105 HydrophobicContact CZ-CB 4.35Å; F105-F108 PolarHBondContact O-N 2.97Å; F105-L109 HydrophobicContact CE1-CD2 4.28Å; F105-L109 HydrophobicContact CZ-CB 4.39Å; F105-L109 HydrophobicContact CZ-CD1 4.05Å; F105-L109 HydrophobicContact CZ-CD2 4.42Å; F105-L109 VanDerWaalsContact O-CB 3.28Å; F105-L109 WeakPolarHBondContact O-CB 3.41Å; F105-L109 PolarHBondContact O-N 3.48Å
106	D	83	Confident	75.8	Confident	60 Å²	60	40.6 Å²	40.6	32%	0.321	23%	0.225	S	C	.	.	H	α-helix	trans	-62.3	-41.9	175.3	46.8	-67.3	0	0	0	112.1	L39 T104 T110	L39-D106 HydrophobicContact CD2-CB 3.83Å; T104-D106 VanDerWaalsContact C-N 3.26Å; T104-D106 WeakPolarHBondContact CB-OD1 3.47Å; T104-D106 PolarHBondContact O-N 3Å; T104-D106 PolarHBondContact OG1-OD1 3.47Å; T104-D106 PolarHBondContact OG1-OD2 3.38Å; D106-T110 WeakPolarHBondContact O-CB 3.42Å; D106-T110 PolarHBondContact O-N 3.12Å; D106-T110 PolarHBondContact O-OG1 3.34Å
107	G	80.2	Confident	75.8	Confident	18 Å²	18	44.4 Å²	44.4	19%	0.186	24%	0.238	C	C	.	.	H	α-helix	trans	-62.7	-47.4	172.8	0	0	0	0	0	112.2	T104 L109 T110 L111	T104-G107 PolarHBondContact O-N 2.97Å; T104-G107 VanDerWaalsContact O-N 3.12Å; T104-G107 PolarHBondContact OG1-N 2.73Å; G107-L109 PolarHBondContact O-N 3.36Å; G107-T110 PolarHBondContact O-N 3.1Å; G107-L111 WeakPolarHBondContact O-CB 3.33Å; G107-L111 PolarHBondContact O-N 2.96Å
108	F	78.7	Confident	76	Confident	9 Å²	9	39.1 Å²	39.1	4%	0.039	21%	0.212	C	C	.	.	H	α-helix	trans	-58.8	-46.7	176.2	-178.6	-92.8	0	0	0	112.4	I53 F57 M66 M74 L103 T104 F105 L111 F112	I53-F108 HydrophobicContact CG2-CD1 4.05Å; I53-F108 HydrophobicContact CG2-CE1 3.64Å; F57-F108 HydrophobicContact CD2-CB 3.95Å; F57-F108 AromaticContact CD2-CD1 3.73Å; F57-F108 HydrophobicContact CD2-CD1 3.73Å; F57-F108 AromaticContact CD2-CD2 3.97Å; F57-F108 HydrophobicContact CD2-CD2 3.97Å; F57-F108 HydrophobicContact CD2-CE1 4.17Å; F57-F108 HydrophobicContact CD2-CE2 4.38Å; F57-F108 AromaticContact CD2-CG 3.61Å; F57-F108 HydrophobicContact CD2-CG 3.61Å; F57-F108 HydrophobicContact CD2-CZ 4.47Å; F57-F108 HydrophobicContact CE2-CB 3.71Å; F57-F108 HydrophobicContact CE2-CD1 4.37Å; F57-F108 HydrophobicContact CE2-CD2 4.07Å; F57-F108 AromaticContact CE2-CG 3.8Å; F57-F108 HydrophobicContact CE2-CG 3.8Å; M66-F108 HydrophobicContact CE-CE2 4.45Å; M66-F108 HydrophobicContact SD-CD2 4.08Å; M66-F108 HydrophobicContact SD-CE2 4.11Å; M74-F108 HydrophobicContact CE-CE2 3.8Å; M74-F108 HydrophobicContact CE-CZ 4.22Å; M74-F108 HydrophobicContact SD-CE2 4.15Å; M74-F108 HydrophobicContact SD-CZ 4.21Å; L103-F108 HydrophobicContact CD2-CB 3.83Å; L103-F108 HydrophobicContact CD2-CD2 3.96Å; L103-F108 HydrophobicContact CD2-CG 4.41Å; L103-F108 HydrophobicContact CG-CB 4.08Å; T104-F108 PolarHBondContact O-N 3.4Å; F105-F108 PolarHBondContact O-N 2.97Å; F108-L111 WeakPolarHBondContact O-CB 3.39Å; F108-L111 PolarHBondContact O-N 3.43Å; F108-F112 HydrophobicContact CD1-CD2 4.12Å; F108-F112 HydrophobicContact CD1-CE2 4.34Å; F108-F112 HydrophobicContact CD2-CD2 4.15Å; F108-F112 AromaticContact CD2-CE2 3.8Å; F108-F112 HydrophobicContact CD2-CE2 3.8Å; F108-F112 AromaticContact CE1-CD2 3.84Å; F108-F112 HydrophobicContact CE1-CD2 3.84Å; F108-F112 HydrophobicContact CE1-CE1 4.42Å; F108-F112 AromaticContact CE1-CE2 3.78Å; F108-F112 HydrophobicContact CE1-CE2 3.78Å; F108-F112 HydrophobicContact CE1-CG 4.23Å; F108-F112 HydrophobicContact CE1-CZ 4.08Å; F108-F112 AromaticContact CE2-CD2 3.88Å; F108-F112 HydrophobicContact CE2-CD2 3.88Å; F108-F112 AromaticContact CE2-CE2 3.17Å; F108-F112 HydrophobicContact CE2-CE2 3.17Å; F108-F112 AromaticContact CE2-CZ 3.68Å; F108-F112 HydrophobicContact CE2-CZ 3.68Å; F108-F112 HydrophobicContact CG-CD2 4.27Å; F108-F112 HydrophobicContact CG-CE2 4.35Å; F108-F112 HydrophobicContact CZ-CD1 4.49Å; F108-F112 AromaticContact CZ-CD2 3.73Å; F108-F112 HydrophobicContact CZ-CD2 3.73Å; F108-F112 HydrophobicContact CZ-CE1 4Å; F108-F112 AromaticContact CZ-CE2 3.16Å; F108-F112 HydrophobicContact CZ-CE2 3.16Å; F108-F112 HydrophobicContact CZ-CG 4.38Å; F108-F112 AromaticContact CZ-CZ 3.31Å; F108-F112 HydrophobicContact CZ-CZ 3.31Å; F108-F112 VanDerWaalsContact O-CD2 3.29Å; F108-F112 WeakPolarHBondContact O-CD2 3.21Å; F108-F112 PolarHBondContact O-N 2.68Å
109	L	82.1	Confident	76.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66.5	-40.7	-179.4	-168.8	75	0	0	0	111.8	L39 T43 F45 V50 I53 F105 G107 L111 F112 S113	L39-L109 HydrophobicContact CB-CD2 3.72Å; L39-L109 HydrophobicContact CD1-CD2 4.19Å; L39-L109 HydrophobicContact CD2-CD2 4.07Å; L39-L109 HydrophobicContact CG-CD2 4.21Å; T43-L109 HydrophobicContact CG2-CD2 3.86Å; T43-L109 HydrophobicContact CG2-CG 3.92Å; F45-L109 HydrophobicContact CD2-CD1 3.56Å; F45-L109 HydrophobicContact CD2-CG 3.92Å; F45-L109 HydrophobicContact CE2-CD1 3.86Å; F45-L109 HydrophobicContact CE2-CG 4.26Å; F45-L109 HydrophobicContact CG-CD1 4.44Å; V50-L109 HydrophobicContact CB-CD2 4.49Å; V50-L109 HydrophobicContact CG1-CD2 3.9Å; V50-L109 HydrophobicContact CG2-CD1 4.49Å; V50-L109 HydrophobicContact CG2-CD2 3.95Å; I53-L109 HydrophobicContact CB-CD1 4.1Å; I53-L109 HydrophobicContact CD1-CD1 3.62Å; I53-L109 HydrophobicContact CG1-CD1 4.47Å; I53-L109 HydrophobicContact CG2-CD1 3.89Å; F105-L109 HydrophobicContact CE1-CD2 4.28Å; F105-L109 HydrophobicContact CZ-CB 4.39Å; F105-L109 HydrophobicContact CZ-CD1 4.05Å; F105-L109 HydrophobicContact CZ-CD2 4.42Å; F105-L109 VanDerWaalsContact O-CB 3.28Å; F105-L109 WeakPolarHBondContact O-CB 3.41Å; F105-L109 PolarHBondContact O-N 3.48Å; G107-L109 PolarHBondContact O-N 3.36Å; L109-L111 VanDerWaalsContact C-N 3.34Å; L109-F112 PolarHBondContact O-N 2.98Å; L109-S113 WeakPolarHBondContact O-CB 3.34Å; L109-S113 PolarHBondContact O-N 2.84Å
110	T	79	Confident	76.1	Confident	58 Å²	58	33.6 Å²	33.6	36%	0.356	20%	0.196	S	C	.	.	H	α-helix	trans	-64.3	-41.1	177	-55.1	0	0	0	0	111.2	D106 G107 S113 T114	D106-T110 WeakPolarHBondContact O-CB 3.42Å; D106-T110 PolarHBondContact O-N 3.12Å; D106-T110 PolarHBondContact O-OG1 3.34Å; G107-T110 PolarHBondContact O-N 3.1Å; T110-S113 PolarHBondContact O-N 3.3Å; T110-T114 WeakPolarHBondContact O-CB 3.48Å; T110-T114 PolarHBondContact O-N 3.43Å; T110-T114 PolarHBondContact O-OG1 2.85Å
111	L	74.9	Confident	75.7	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.016	20%	0.201	C	C	.	.	H	α-helix	trans	-55.3	-56.2	171.3	155.8	46.8	0	0	0	110.9	F95 L103 G107 F108 L109 S113 T114 L115	F95-L111 HydrophobicContact CD1-CB 3.8Å; F95-L111 HydrophobicContact CD2-CB 4.17Å; F95-L111 HydrophobicContact CD2-CD1 3.97Å; F95-L111 HydrophobicContact CD2-CD2 3.56Å; F95-L111 HydrophobicContact CD2-CG 4.02Å; F95-L111 HydrophobicContact CE1-CB 3.46Å; F95-L111 VanDerWaalsContact CE1-CB 3.46Å; F95-L111 HydrophobicContact CE1-CD1 4.11Å; F95-L111 HydrophobicContact CE1-CG 4.17Å; F95-L111 HydrophobicContact CE2-CB 3.82Å; F95-L111 HydrophobicContact CE2-CD1 3.06Å; F95-L111 HydrophobicContact CE2-CD2 3.57Å; F95-L111 HydrophobicContact CE2-CG 3.56Å; F95-L111 HydrophobicContact CG-CB 4.14Å; F95-L111 HydrophobicContact CG-CD2 4.07Å; F95-L111 HydrophobicContact CG-CG 4.46Å; F95-L111 HydrophobicContact CZ-CB 3.44Å; F95-L111 VanDerWaalsContact CZ-CB 3.44Å; F95-L111 HydrophobicContact CZ-CD1 3.15Å; F95-L111 HydrophobicContact CZ-CD2 4.15Å; F95-L111 HydrophobicContact CZ-CG 3.65Å; L103-L111 HydrophobicContact CD2-CD2 4.34Å; G107-L111 WeakPolarHBondContact O-CB 3.33Å; G107-L111 PolarHBondContact O-N 2.96Å; F108-L111 WeakPolarHBondContact O-CB 3.39Å; F108-L111 PolarHBondContact O-N 3.43Å; L109-L111 VanDerWaalsContact C-N 3.34Å; L111-S113 VanDerWaalsContact C-N 3.29Å; L111-S113 PolarHBondContact O-N 3.35Å; L111-T114 WeakPolarHBondContact O-CB 3.32Å; L111-T114 PolarHBondContact O-N 2.96Å; L111-T114 VanDerWaalsContact O-N 3.17Å; L111-L115 HydrophobicContact CD1-CD1 3.37Å; L111-L115 HydrophobicContact CD1-CD2 4.4Å; L111-L115 HydrophobicContact CD1-CG 3.58Å; L111-L115 WeakPolarHBondContact O-CG 3.31Å; L111-L115 PolarHBondContact O-N 3.41Å
112	F	75.5	Confident	75.1	Confident	47 Å²	47	37.3 Å²	37.3	21%	0.206	20%	0.201	C	C	.	.	H	α-helix	trans	-62.9	-37.2	-178.6	-87.8	-115.1	0	0	0	111.9	F45 F108 L109 L115 L116	F45-F112 HydrophobicContact CE2-CB 4.12Å; F45-F112 HydrophobicContact CZ-CB 4.09Å; F108-F112 HydrophobicContact CD1-CD2 4.12Å; F108-F112 HydrophobicContact CD1-CE2 4.34Å; F108-F112 HydrophobicContact CD2-CD2 4.15Å; F108-F112 AromaticContact CD2-CE2 3.8Å; F108-F112 HydrophobicContact CD2-CE2 3.8Å; F108-F112 AromaticContact CE1-CD2 3.84Å; F108-F112 HydrophobicContact CE1-CD2 3.84Å; F108-F112 HydrophobicContact CE1-CE1 4.42Å; F108-F112 AromaticContact CE1-CE2 3.78Å; F108-F112 HydrophobicContact CE1-CE2 3.78Å; F108-F112 HydrophobicContact CE1-CG 4.23Å; F108-F112 HydrophobicContact CE1-CZ 4.08Å; F108-F112 AromaticContact CE2-CD2 3.88Å; F108-F112 HydrophobicContact CE2-CD2 3.88Å; F108-F112 AromaticContact CE2-CE2 3.17Å; F108-F112 HydrophobicContact CE2-CE2 3.17Å; F108-F112 AromaticContact CE2-CZ 3.68Å; F108-F112 HydrophobicContact CE2-CZ 3.68Å; F108-F112 HydrophobicContact CG-CD2 4.27Å; F108-F112 HydrophobicContact CG-CE2 4.35Å; F108-F112 HydrophobicContact CZ-CD1 4.49Å; F108-F112 AromaticContact CZ-CD2 3.73Å; F108-F112 HydrophobicContact CZ-CD2 3.73Å; F108-F112 HydrophobicContact CZ-CE1 4Å; F108-F112 AromaticContact CZ-CE2 3.16Å; F108-F112 HydrophobicContact CZ-CE2 3.16Å; F108-F112 HydrophobicContact CZ-CG 4.38Å; F108-F112 AromaticContact CZ-CZ 3.31Å; F108-F112 HydrophobicContact CZ-CZ 3.31Å; F108-F112 VanDerWaalsContact O-CD2 3.29Å; F108-F112 WeakPolarHBondContact O-CD2 3.21Å; F108-F112 PolarHBondContact O-N 2.68Å; L109-F112 PolarHBondContact O-N 2.98Å; F112-L115 PolarHBondContact O-N 2.78Å; F112-L116 HydrophobicContact CD1-CD1 4.26Å; F112-L116 VanDerWaalsContact O-CB 3.26Å; F112-L116 WeakPolarHBondContact O-CB 3.12Å; F112-L116 VanDerWaalsContact O-CG 3.25Å; F112-L116 WeakPolarHBondContact O-CG 3.45Å; F112-L116 PolarHBondContact O-N 3.02Å
113	S	77.5	Confident	74.3	Confident	9 Å²	9	38.2 Å²	38.2	6%	0.063	20%	0.203	C	C	.	.	H	α-helix	trans	-61.1	-46.8	175.3	-169.8	0	0	0	0	110.8	T43 D44 L109 T110 L111 L115 R117 G118	T43-S113 WeakPolarHBondContact CA-OG 3.49Å; T43-S113 WeakPolarHBondContact CB-OG 3.34Å; D44-S113 PolarHBondContact N-OG 3.39Å; L109-S113 WeakPolarHBondContact O-CB 3.34Å; L109-S113 PolarHBondContact O-N 2.84Å; T110-S113 PolarHBondContact O-N 3.3Å; L111-S113 VanDerWaalsContact C-N 3.29Å; L111-S113 PolarHBondContact O-N 3.35Å; S113-L115 PolarHBondContact O-N 2.87Å; S113-R117 CarbonylContact O-C 3.6Å; S113-R117 WeakPolarHBondContact O-CA 3.48Å; S113-R117 PolarHBondContact O-N 3.34Å; S113-G118 PolarHBondContact O-N 3.44Å
114	T	71.2	Confident	73.5	Confident	26 Å²	26	40.1 Å²	40.1	16%	0.16	21%	0.213	C	C	.	.	H	α-helix	trans	-62.3	-44.8	178.8	-55.2	0	0	0	0	111.4	T110 L111 G118 E122 K123 W126	T110-T114 WeakPolarHBondContact O-CB 3.48Å; T110-T114 PolarHBondContact O-N 3.43Å; T110-T114 PolarHBondContact O-OG1 2.85Å; L111-T114 WeakPolarHBondContact O-CB 3.32Å; L111-T114 PolarHBondContact O-N 2.96Å; L111-T114 VanDerWaalsContact O-N 3.17Å; T114-G118 VanDerWaalsContact O-CA 3.31Å; T114-G118 WeakPolarHBondContact O-CA 3.4Å; T114-G118 PolarHBondContact O-N 3.01Å; T114-G118 VanDerWaalsContact O-N 3.16Å; T114-E122 HydrophobicContact CG2-CB 4.21Å; T114-K123 VanDerWaalsContact O-CE 3.22Å; T114-K123 WeakPolarHBondContact O-CE 3.26Å; T114-K123 WeakPolarHBondContact O-CG 3.25Å; T114-W126 HydrophobicContact CG2-CB 3.88Å; T114-W126 HydrophobicContact CG2-CG 4.5Å
115	L	67	Low	72.7	Confident	8 Å²	8	43.5 Å²	43.5	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-68.9	-45.4	-179.9	-67.9	-172.4	0	0	0	112.9	F14 V15 L111 F112 S113 K123 W126	F14-L115 HydrophobicContact CD1-CD1 3.71Å; F14-L115 HydrophobicContact CE1-CD1 3.54Å; V15-L115 WeakPolarHBondContact CG2-O 3.24Å; L111-L115 HydrophobicContact CD1-CD1 3.37Å; L111-L115 HydrophobicContact CD1-CD2 4.4Å; L111-L115 HydrophobicContact CD1-CG 3.58Å; L111-L115 WeakPolarHBondContact O-CG 3.31Å; L111-L115 PolarHBondContact O-N 3.41Å; F112-L115 PolarHBondContact O-N 2.78Å; S113-L115 PolarHBondContact O-N 2.87Å; L115-K123 WeakPolarHBondContact O-CE 3.29Å; L115-K123 PolarHBondContact O-NZ 3.39Å; L115-W126 HydrophobicContact CD2-CD2 3.88Å; L115-W126 HydrophobicContact CD2-CE3 3.46Å; L115-W126 VanDerWaalsContact CD2-CE3 3.46Å; L115-W126 HydrophobicContact CD2-CH2 3.68Å; L115-W126 HydrophobicContact CD2-CZ2 4.09Å; L115-W126 HydrophobicContact CD2-CZ3 3.37Å
116	L	66.9	Low	72.2	Confident	36 Å²	36	44 Å²	44	19%	0.188	23%	0.228	C	C	.	.	H	α-helix	trans	-83.5	-40.1	-172.6	-61.6	-178.4	0	0	0	112.5	A18 F45 F112	A18-L116 HydrophobicContact CB-CD2 3.6Å; F45-L116 HydrophobicContact CE1-CD1 4.28Å; F45-L116 HydrophobicContact CZ-CD1 4.07Å; F112-L116 HydrophobicContact CD1-CD1 4.26Å; F112-L116 VanDerWaalsContact O-CB 3.26Å; F112-L116 WeakPolarHBondContact O-CB 3.12Å; F112-L116 VanDerWaalsContact O-CG 3.25Å; F112-L116 WeakPolarHBondContact O-CG 3.45Å; F112-L116 PolarHBondContact O-N 3.02Å
117	R	74.5	Confident	71.3	Confident	99 Å²	99	42.7 Å²	42.7	37%	0.374	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-14.2	-167.7	-61.4	-175.2	-178.6	-174.8	0.6	114.3	D44 E49 S113	D44-R117 HydrophobicContact CB-CB 3.77Å; D44-R117 HydrophobicContact CB-CG 4.28Å; D44-R117 WeakPolarHBondContact O-CD 3.32Å; D44-R117 PolarHBondContact O-NH1 2.83Å; E49-R117 VanDerWaalsContact CD-NH2 3.3Å; E49-R117 IonicContact OE1-CZ 3.47Å; E49-R117 IonicContact OE1-NH1 3.38Å; E49-R117 PolarHBondContact OE1-NH1 3.41Å; E49-R117 IonicContact OE1-NH2 2.65Å; E49-R117 PolarHBondContact OE1-NH2 3.18Å; E49-R117 IonicContact OE2-CZ 3.59Å; E49-R117 IonicContact OE2-NH1 2.81Å; E49-R117 PolarHBondContact OE2-NH1 3.09Å; E49-R117 IonicContact OE2-NH2 3.53Å; S113-R117 CarbonylContact O-C 3.6Å; S113-R117 WeakPolarHBondContact O-CA 3.48Å; S113-R117 PolarHBondContact O-N 3.34Å
118	G	66.4	Low	70.7	Confident	7 Å²	7	42.8 Å²	42.8	7%	0.072	22%	0.217	C	C	.	.			trans	-57.4	146.2	178.6	0	0	0	0	0	113.1	S113 T114 E122 K123	S113-G118 PolarHBondContact O-N 3.44Å; T114-G118 VanDerWaalsContact O-CA 3.31Å; T114-G118 WeakPolarHBondContact O-CA 3.4Å; T114-G118 PolarHBondContact O-N 3.01Å; T114-G118 VanDerWaalsContact O-N 3.16Å; G118-E122 VanDerWaalsContact CA-OE2 3.29Å; G118-E122 WeakPolarHBondContact CA-OE2 3.46Å; G118-K123 WeakPolarHBondContact O-CD 3.43Å; G118-K123 WeakPolarHBondContact O-CE 3.43Å; G118-K123 PolarHBondContact O-NZ 2.65Å; G118-K123 VanDerWaalsContact O-NZ 3.07Å
119	T	74.2	Confident	70.4	Confident	70 Å²	70	47.4 Å²	47.4	43%	0.429	24%	0.237	S	C	.	.			trans	-56.2	164.4	166.7	59.4	0	0	0	0	111.2	E121 E122 K123	T119-E121 PolarHBondContact O-N 2.81Å; T119-E122 WeakPolarHBondContact CB-OE2 3.37Å; T119-E122 WeakPolarHBondContact CG2-OE2 3.36Å; T119-E122 PolarHBondContact N-OE2 3.41Å; T119-E122 PolarHBondContact O-N 3.4Å; T119-E122 WeakPolarHBondContact OG1-CB 3.38Å; T119-E122 VanDerWaalsContact OG1-CG 3.25Å; T119-E122 WeakPolarHBondContact OG1-CG 3.46Å; T119-E122 PolarHBondContact OG1-N 2.76Å; T119-E122 VanDerWaalsContact OG1-N 3.13Å; T119-E122 PolarHBondContact OG1-OE2 3.02Å; T119-K123 WeakPolarHBondContact O-CB 3.43Å; T119-K123 WeakPolarHBondContact O-CG 3.47Å; T119-K123 PolarHBondContact O-N 3.24Å
120	V	63.7	Low	69.8	Low	82 Å²	82	48 Å²	48	50%	0.497	24%	0.24	S	C	.	.	H	α-helix	trans	-58.5	-38.1	174.7	174.7	0	0	0	0	109.9	K123 L124	V120-K123 PolarHBondContact O-N 3.11Å; V120-L124 HydrophobicContact CG1-CD1 3.8Å; V120-L124 HydrophobicContact CG1-CG 4.33Å; V120-L124 WeakPolarHBondContact O-CB 3.35Å; V120-L124 WeakPolarHBondContact O-CD1 3.42Å; V120-L124 WeakPolarHBondContact O-CG 3.39Å; V120-L124 PolarHBondContact O-N 3.41Å
121	E	66.3	Low	69.2	Low	102 Å²	102	47.4 Å²	47.4	48%	0.477	23%	0.231	S	C	.	.	H	α-helix	trans	-64.2	-47.5	178.7	-68.2	63.1	-140.1	0	0	111.8	T119 L124 Q125 R179	T119-E121 PolarHBondContact O-N 2.81Å; E121-L124 PolarHBondContact O-N 3.38Å; E121-Q125 WeakPolarHBondContact O-CG 3.38Å; E121-Q125 PolarHBondContact O-N 2.91Å; E121-R179 IonicContact OE1-NH1 3.63Å
122	E	67.1	Low	69.2	Low	79 Å²	79	47.7 Å²	47.7	37%	0.369	23%	0.233	S	C	.	.	H	α-helix	trans	-64.5	-41.8	177.3	-72	163.9	131.1	0	0	111.8	T114 G118 T119 L124 Q125 W126	T114-E122 HydrophobicContact CG2-CB 4.21Å; G118-E122 VanDerWaalsContact CA-OE2 3.29Å; G118-E122 WeakPolarHBondContact CA-OE2 3.46Å; T119-E122 WeakPolarHBondContact CB-OE2 3.37Å; T119-E122 WeakPolarHBondContact CG2-OE2 3.36Å; T119-E122 PolarHBondContact N-OE2 3.41Å; T119-E122 PolarHBondContact O-N 3.4Å; T119-E122 WeakPolarHBondContact OG1-CB 3.38Å; T119-E122 VanDerWaalsContact OG1-CG 3.25Å; T119-E122 WeakPolarHBondContact OG1-CG 3.46Å; T119-E122 PolarHBondContact OG1-N 2.76Å; T119-E122 VanDerWaalsContact OG1-N 3.13Å; T119-E122 PolarHBondContact OG1-OE2 3.02Å; E122-L124 VanDerWaalsContact C-N 3.32Å; E122-L124 PolarHBondContact O-N 2.9Å; E122-Q125 PolarHBondContact O-N 3.34Å; E122-W126 WeakPolarHBondContact O-CB 3.48Å; E122-W126 PolarHBondContact O-N 3.35Å
123	K	66	Low	68.8	Low	38 Å²	38	48 Å²	48	17%	0.165	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-40.4	175.2	-73.6	168.6	175	167.6	0	111.5	L11 T114 L115 G118 T119 V120 W126 V127	L11-K123 HydrophobicContact CD2-CD 4.37Å; T114-K123 VanDerWaalsContact O-CE 3.22Å; T114-K123 WeakPolarHBondContact O-CE 3.26Å; T114-K123 WeakPolarHBondContact O-CG 3.25Å; L115-K123 WeakPolarHBondContact O-CE 3.29Å; L115-K123 PolarHBondContact O-NZ 3.39Å; G118-K123 WeakPolarHBondContact O-CD 3.43Å; G118-K123 WeakPolarHBondContact O-CE 3.43Å; G118-K123 PolarHBondContact O-NZ 2.65Å; G118-K123 VanDerWaalsContact O-NZ 3.07Å; T119-K123 WeakPolarHBondContact O-CB 3.43Å; T119-K123 WeakPolarHBondContact O-CG 3.47Å; T119-K123 PolarHBondContact O-N 3.24Å; V120-K123 PolarHBondContact O-N 3.11Å; K123-W126 PolarHBondContact O-N 3.08Å; K123-V127 VanDerWaalsContact O-CB 3.27Å; K123-V127 WeakPolarHBondContact O-CB 3.37Å; K123-V127 WeakPolarHBondContact O-CG2 3.36Å; K123-V127 PolarHBondContact O-N 3.17Å
124	L	61.3	Low	68.5	Low	47 Å²	47	51.5 Å²	51.5	25%	0.246	26%	0.257	C	S	.	.	H	α-helix	trans	-68.2	-39.9	176.2	-75.8	169.6	0	0	0	112.6	V120 E121 E122 W126 V127 F128 F182	V120-L124 HydrophobicContact CG1-CD1 3.8Å; V120-L124 HydrophobicContact CG1-CG 4.33Å; V120-L124 WeakPolarHBondContact O-CB 3.35Å; V120-L124 WeakPolarHBondContact O-CD1 3.42Å; V120-L124 WeakPolarHBondContact O-CG 3.39Å; V120-L124 PolarHBondContact O-N 3.41Å; E121-L124 PolarHBondContact O-N 3.38Å; E122-L124 VanDerWaalsContact C-N 3.32Å; E122-L124 PolarHBondContact O-N 2.9Å; L124-W126 VanDerWaalsContact C-N 3.3Å; L124-V127 WeakPolarHBondContact O-CB 3.49Å; L124-V127 PolarHBondContact O-N 3.09Å; L124-F128 WeakPolarHBondContact O-CB 3.47Å; L124-F128 PolarHBondContact O-N 3.34Å; L124-F182 HydrophobicContact CB-CE2 4.32Å; L124-F182 HydrophobicContact CB-CZ 4.01Å
125	Q	67.8	Low	68.6	Low	109 Å²	109	54 Å²	54	51%	0.509	27%	0.265	S	S	.	.	H	α-helix	trans	-62.6	-40.8	173.2	-74.5	177.5	-2.4	0	0	111.2	E121 E122 F128 K129 F182	E121-Q125 WeakPolarHBondContact O-CG 3.38Å; E121-Q125 PolarHBondContact O-N 2.91Å; E122-Q125 PolarHBondContact O-N 3.34Å; Q125-F128 PolarHBondContact O-N 2.68Å; Q125-K129 WeakPolarHBondContact O-CG 3.37Å; Q125-K129 PolarHBondContact O-N 3.33Å; Q125-F182 HydrophobicContact CG-CZ 4.19Å
126	W	72.3	Confident	69	Low	18 Å²	18	57.2 Å²	57.2	7%	0.068	28%	0.283	C	S	.	.	H	α-helix	trans	-64.3	-49.4	174.5	170.9	63.3	0	0	0	111.9	L11 V91 S94 F95 T114 L115 E122 K123 L124 F128 K129 L130	L11-W126 HydrophobicContact CD1-CZ3 4.27Å; V91-W126 HydrophobicContact CG1-CZ2 4.41Å; S94-W126 PolarHBondContact OG-NE1 2.68Å; F95-W126 AromaticContact CD2-NE1 3.91Å; F95-W126 AromaticContact CE1-CD1 3.86Å; F95-W126 AromaticContact CE2-CD1 3.57Å; F95-W126 AromaticContact CE2-CE2 3.62Å; F95-W126 HydrophobicContact CE2-CZ2 4.05Å; F95-W126 AromaticContact CE2-NE1 2.86Å; F95-W126 AromaticContact CZ-CD1 3.07Å; F95-W126 HydrophobicContact CZ-CD2 4.47Å; F95-W126 AromaticContact CZ-CE2 3.82Å; F95-W126 HydrophobicContact CZ-CG 4.05Å; F95-W126 AromaticContact CZ-NE1 2.93Å; T114-W126 HydrophobicContact CG2-CB 3.88Å; T114-W126 HydrophobicContact CG2-CG 4.5Å; L115-W126 HydrophobicContact CD2-CD2 3.88Å; L115-W126 HydrophobicContact CD2-CE3 3.46Å; L115-W126 VanDerWaalsContact CD2-CE3 3.46Å; L115-W126 HydrophobicContact CD2-CH2 3.68Å; L115-W126 HydrophobicContact CD2-CZ2 4.09Å; L115-W126 HydrophobicContact CD2-CZ3 3.37Å; E122-W126 WeakPolarHBondContact O-CB 3.48Å; E122-W126 PolarHBondContact O-N 3.35Å; K123-W126 PolarHBondContact O-N 3.08Å; L124-W126 VanDerWaalsContact C-N 3.3Å; W126-F128 PolarHBondContact O-N 3.19Å; W126-K129 CarbonylContact O-C 3.55Å; W126-K129 WeakPolarHBondContact O-CA 3.49Å; W126-K129 WeakPolarHBondContact O-CB 3.41Å; W126-K129 PolarHBondContact O-N 2.76Å; W126-L130 HydrophobicContact CH2-CD2 3.76Å; W126-L130 HydrophobicContact CZ2-CB 4.42Å; W126-L130 HydrophobicContact CZ2-CD1 4.34Å; W126-L130 HydrophobicContact CZ2-CD2 3.96Å; W126-L130 HydrophobicContact CZ2-CG 4.47Å; W126-L130 HydrophobicContact CZ3-CD2 4.25Å; W126-L130 WeakPolarHBondContact O-CB 3.5Å; W126-L130 PolarHBondContact O-N 2.8Å
127	V	65.7	Low	69.3	Low	31 Å²	31	57.5 Å²	57.5	19%	0.188	29%	0.294	C	S	.	.	H	α-helix	trans	-49.2	-51.2	172	153	0	0	0	0	108.5	K123 L124 K129 L130 Y131	K123-V127 VanDerWaalsContact O-CB 3.27Å; K123-V127 WeakPolarHBondContact O-CB 3.37Å; K123-V127 WeakPolarHBondContact O-CG2 3.36Å; K123-V127 PolarHBondContact O-N 3.17Å; L124-V127 WeakPolarHBondContact O-CB 3.49Å; L124-V127 PolarHBondContact O-N 3.09Å; V127-K129 PolarHBondContact O-N 3.36Å; V127-L130 CarbonylContact O-C 3.58Å; V127-L130 WeakPolarHBondContact O-CA 3.05Å; V127-L130 WeakPolarHBondContact O-CB 3.03Å; V127-L130 PolarHBondContact O-N 3Å; V127-Y131 HydrophobicContact CB-CD2 4.45Å; V127-Y131 HydrophobicContact CB-CE2 4.28Å; V127-Y131 HydrophobicContact CG1-CD2 3.61Å; V127-Y131 HydrophobicContact CG1-CE2 3.35Å; V127-Y131 WeakPolarHBondContact O-CD2 3.42Å; V127-Y131 PolarHBondContact O-N 2.9Å
128	F	67.4	Low	69.2	Low	21 Å²	21	55.3 Å²	55.3	9%	0.092	29%	0.29	C	S	.	.	H	α-helix	trans	-57.5	-45.6	177.8	-171.1	-84.3	0	0	0	113.5	L124 Q125 W126 L130 Y131 D132 G137 L139 F182	L124-F128 WeakPolarHBondContact O-CB 3.47Å; L124-F128 PolarHBondContact O-N 3.34Å; Q125-F128 PolarHBondContact O-N 2.68Å; W126-F128 PolarHBondContact O-N 3.19Å; F128-L130 PolarHBondContact O-N 3Å; F128-Y131 CarbonylContact O-C 3.59Å; F128-Y131 PolarHBondContact O-N 3.1Å; F128-Y131 VanDerWaalsContact O-N 3.12Å; F128-D132 HydrophobicContact CD1-CB 4.37Å; F128-D132 HydrophobicContact CE1-CB 4.3Å; F128-D132 VanDerWaalsContact O-CB 3.26Å; F128-D132 WeakPolarHBondContact O-CB 3.35Å; F128-D132 PolarHBondContact O-N 3.02Å; F128-G137 WeakPolarHBondContact CE1-O 3.29Å; F128-G137 VanDerWaalsContact CZ-O 3.26Å; F128-G137 WeakPolarHBondContact CZ-O 3.49Å; F128-L139 HydrophobicContact CB-CD1 4.37Å; F128-L139 HydrophobicContact CD1-CG 4.42Å; F128-L139 HydrophobicContact CD2-CB 4.46Å; F128-L139 HydrophobicContact CD2-CD1 3.11Å; F128-L139 HydrophobicContact CD2-CD2 4.5Å; F128-L139 HydrophobicContact CD2-CG 3.47Å; F128-L139 VanDerWaalsContact CD2-CG 3.47Å; F128-L139 HydrophobicContact CE1-CG 4.23Å; F128-L139 HydrophobicContact CE2-CB 3.92Å; F128-L139 HydrophobicContact CE2-CD1 3.44Å; F128-L139 VanDerWaalsContact CE2-CD1 3.44Å; F128-L139 HydrophobicContact CE2-CD2 4.49Å; F128-L139 HydrophobicContact CE2-CG 3.29Å; F128-L139 HydrophobicContact CG-CD1 3.82Å; F128-L139 HydrophobicContact CG-CG 4.08Å; F128-L139 HydrophobicContact CZ-CB 4.33Å; F128-L139 HydrophobicContact CZ-CD1 4.29Å; F128-L139 HydrophobicContact CZ-CG 3.69Å; F128-F182 HydrophobicContact CB-CD1 4.07Å; F128-F182 HydrophobicContact CB-CE1 3.5Å; F128-F182 VanDerWaalsContact CB-CE1 3.5Å; F128-F182 AromaticContact CD2-CD1 3.18Å; F128-F182 HydrophobicContact CD2-CD1 3.18Å; F128-F182 AromaticContact CD2-CE1 3.57Å; F128-F182 HydrophobicContact CD2-CE1 3.57Å; F128-F182 HydrophobicContact CD2-CG 4.34Å; F128-F182 AromaticContact CE2-CD1 3.66Å; F128-F182 HydrophobicContact CE2-CD1 3.66Å; F128-F182 HydrophobicContact CE2-CE1 4.4Å; F128-F182 AromaticContact CG-CD1 3.78Å; F128-F182 HydrophobicContact CG-CD1 3.78Å; F128-F182 AromaticContact CG-CE1 3.67Å; F128-F182 HydrophobicContact CG-CE1 3.67Å
129	K	71	Confident	69.5	Low	106 Å²	106	55 Å²	55	46%	0.461	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-33	174.4	-70.5	174.6	-179	178.3	0	112.7	Q125 W126 V127 K135	Q125-K129 WeakPolarHBondContact O-CG 3.37Å; Q125-K129 PolarHBondContact O-N 3.33Å; W126-K129 CarbonylContact O-C 3.55Å; W126-K129 WeakPolarHBondContact O-CA 3.49Å; W126-K129 WeakPolarHBondContact O-CB 3.41Å; W126-K129 PolarHBondContact O-N 2.76Å; V127-K129 PolarHBondContact O-N 3.36Å; K129-K135 PolarHBondContact O-NZ 3.49Å
130	L	69.9	Low	69.5	Low	11 Å²	11	52.6 Å²	52.6	6%	0.058	27%	0.272	C	S	.	.	H	α-helix	trans	-66.5	-46.2	173	176.4	73.7	0	0	0	109.6	F90 V91 W126 V127 F128	F90-L130 HydrophobicContact CD1-CD1 3.53Å; F90-L130 HydrophobicContact CD1-CD2 4.47Å; F90-L130 HydrophobicContact CD1-CG 4.05Å; F90-L130 HydrophobicContact CE1-CD1 3.29Å; F90-L130 HydrophobicContact CE1-CD2 3.86Å; F90-L130 HydrophobicContact CE1-CG 3.32Å; F90-L130 HydrophobicContact CG-CD1 4.3Å; F90-L130 HydrophobicContact CZ-CD1 3.85Å; F90-L130 HydrophobicContact CZ-CG 3.79Å; F90-L130 WeakPolarHBondContact CZ-O 3.42Å; V91-L130 HydrophobicContact CG2-CD1 4.43Å; W126-L130 HydrophobicContact CH2-CD2 3.76Å; W126-L130 HydrophobicContact CZ2-CB 4.42Å; W126-L130 HydrophobicContact CZ2-CD1 4.34Å; W126-L130 HydrophobicContact CZ2-CD2 3.96Å; W126-L130 HydrophobicContact CZ2-CG 4.47Å; W126-L130 HydrophobicContact CZ3-CD2 4.25Å; W126-L130 WeakPolarHBondContact O-CB 3.5Å; W126-L130 PolarHBondContact O-N 2.8Å; V127-L130 CarbonylContact O-C 3.58Å; V127-L130 WeakPolarHBondContact O-CA 3.05Å; V127-L130 WeakPolarHBondContact O-CB 3.03Å; V127-L130 PolarHBondContact O-N 3Å; F128-L130 PolarHBondContact O-N 3Å
131	Y	67.6	Low	69.9	Low	46 Å²	46	51.4 Å²	51.4	18%	0.18	26%	0.261	C	S	.	.	H	α-helix	trans	-70.4	-32.5	179.6	-69.4	-91.8	0	0	0	113.4	V127 F128 T133 L139 D143 L144 I147	V127-Y131 HydrophobicContact CB-CD2 4.45Å; V127-Y131 HydrophobicContact CB-CE2 4.28Å; V127-Y131 HydrophobicContact CG1-CD2 3.61Å; V127-Y131 HydrophobicContact CG1-CE2 3.35Å; V127-Y131 WeakPolarHBondContact O-CD2 3.42Å; V127-Y131 PolarHBondContact O-N 2.9Å; F128-Y131 CarbonylContact O-C 3.59Å; F128-Y131 PolarHBondContact O-N 3.1Å; F128-Y131 VanDerWaalsContact O-N 3.12Å; Y131-T133 PolarHBondContact O-N 2.88Å; Y131-L139 HydrophobicContact CG-CD1 4.49Å; Y131-D143 WeakPolarHBondContact O-CB 3.23Å; Y131-L144 HydrophobicContact CD1-CD2 3.55Å; Y131-L144 HydrophobicContact CE1-CD2 4.1Å; Y131-L144 HydrophobicContact CG-CD2 4.1Å; Y131-I147 HydrophobicContact CD1-CB 3.82Å; Y131-I147 HydrophobicContact CD1-CD1 3.12Å; Y131-I147 HydrophobicContact CD1-CG1 4.05Å; Y131-I147 HydrophobicContact CD1-CG2 3.77Å; Y131-I147 HydrophobicContact CE1-CB 3.73Å; Y131-I147 HydrophobicContact CE1-CD1 3.89Å; Y131-I147 HydrophobicContact CE1-CG1 4.41Å; Y131-I147 HydrophobicContact CE1-CG2 3.25Å; Y131-I147 HydrophobicContact CG-CD1 3.64Å
132	D	73.7	Confident	70.2	Confident	10 Å²	10	49.1 Å²	49.1	5%	0.053	26%	0.256	C	S	.	.			trans	-78.1	86.4	-178.6	178.2	3.8	0	0	0	109.2	F128 N134 K135 D136 G137 L139	F128-D132 HydrophobicContact CD1-CB 4.37Å; F128-D132 HydrophobicContact CE1-CB 4.3Å; F128-D132 VanDerWaalsContact O-CB 3.26Å; F128-D132 WeakPolarHBondContact O-CB 3.35Å; F128-D132 PolarHBondContact O-N 3.02Å; D132-N134 PolarHBondContact OD1-OD1 3.31Å; D132-K135 WeakPolarHBondContact O-CD 3.28Å; D132-K135 WeakPolarHBondContact O-CE 3.46Å; D132-K135 PolarHBondContact O-NZ 2.85Å; D132-K135 WeakPolarHBondContact OD1-CA 3.31Å; D132-K135 PolarHBondContact OD1-N 3.07Å; D132-K135 WeakPolarHBondContact OD2-CA 3.32Å; D132-D136 PolarHBondContact OD1-N 2.91Å; D132-D136 PolarHBondContact OD2-N 3.43Å; D132-G137 VanDerWaalsContact OD2-CA 3.27Å; D132-G137 WeakPolarHBondContact OD2-CA 3.44Å; D132-G137 PolarHBondContact OD2-N 3.47Å; D132-L139 HydrophobicContact CB-CD2 3.8Å
133	T	67.6	Low	70.4	Confident	53 Å²	53	45.6 Å²	45.6	33%	0.325	24%	0.239	S	C	.	.	S	Bend	trans	-74.7	-31.4	-174.4	63.2	0	0	0	0	112.7	F90 Y131 D143	F90-T133 HydrophobicContact CE2-CG2 3.9Å; Y131-T133 PolarHBondContact O-N 2.88Å; T133-D143 PolarHBondContact OG1-OD1 2.99Å
134	N	71.8	Confident	70.6	Confident	82 Å²	82	44 Å²	44	44%	0.439	23%	0.233	S	C	.	.	S	Bend	trans	-88.9	-8.5	178.6	64.5	-13.2	0	0	0	113.2	D132 D136	D132-N134 PolarHBondContact OD1-OD1 3.31Å; N134-D136 VanDerWaalsContact C-N 3.25Å; N134-D136 PolarHBondContact ND2-OD2 2.67Å; N134-D136 PolarHBondContact O-N 3.01Å; N134-D136 PolarHBondContact OD1-OD1 3.38Å
135	K	72.3	Confident	71.1	Confident	78 Å²	78	45.6 Å²	45.6	34%	0.339	24%	0.239	S	C	.	.			trans	62.4	29.4	177.6	-50.9	-64.2	173.5	-154.8	0	112.9	K129 D132 G137	K129-K135 PolarHBondContact O-NZ 3.49Å; D132-K135 WeakPolarHBondContact O-CD 3.28Å; D132-K135 WeakPolarHBondContact O-CE 3.46Å; D132-K135 PolarHBondContact O-NZ 2.85Å; D132-K135 WeakPolarHBondContact OD1-CA 3.31Å; D132-K135 PolarHBondContact OD1-N 3.07Å; D132-K135 WeakPolarHBondContact OD2-CA 3.32Å; K135-G137 VanDerWaalsContact C-N 3.28Å
136	D	76.3	Confident	71.2	Confident	77 Å²	77	45.6 Å²	45.6	41%	0.412	24%	0.237	S	C	.	.	S	Bend	trans	-86.3	-2.8	179.3	71.7	3.1	0	0	0	112.9	D132 N134 L138	D132-D136 PolarHBondContact OD1-N 2.91Å; D132-D136 PolarHBondContact OD2-N 3.43Å; N134-D136 VanDerWaalsContact C-N 3.25Å; N134-D136 PolarHBondContact ND2-OD2 2.67Å; N134-D136 PolarHBondContact O-N 3.01Å; N134-D136 PolarHBondContact OD1-OD1 3.38Å; D136-L138 VanDerWaalsContact C-N 3.28Å; D136-L138 WeakPolarHBondContact OD1-CA 3.44Å; D136-L138 VanDerWaalsContact OD1-CB 3.29Å; D136-L138 WeakPolarHBondContact OD1-CB 3.49Å; D136-L138 PolarHBondContact OD1-N 2.83Å; D136-L138 VanDerWaalsContact OD1-O 3.08Å
137	G	72.4	Confident	70.9	Confident	41 Å²	41	44.9 Å²	44.9	42%	0.423	24%	0.235	S	C	.	.	S	Bend	trans	80.2	8.4	-178	0	0	0	0	0	113.5	F128 D132 K135	F128-G137 WeakPolarHBondContact CE1-O 3.29Å; F128-G137 VanDerWaalsContact CZ-O 3.26Å; F128-G137 WeakPolarHBondContact CZ-O 3.49Å; D132-G137 VanDerWaalsContact OD2-CA 3.27Å; D132-G137 WeakPolarHBondContact OD2-CA 3.44Å; D132-G137 PolarHBondContact OD2-N 3.47Å; K135-G137 VanDerWaalsContact C-N 3.28Å
138	L	73.4	Confident	70.9	Confident	53 Å²	53	44.1 Å²	44.1	28%	0.277	23%	0.23	S	C	.	.			trans	-120.3	132.7	178.9	-58.4	173	0	0	0	109.3	D136 Y185	D136-L138 VanDerWaalsContact C-N 3.28Å; D136-L138 WeakPolarHBondContact OD1-CA 3.44Å; D136-L138 VanDerWaalsContact OD1-CB 3.29Å; D136-L138 WeakPolarHBondContact OD1-CB 3.49Å; D136-L138 PolarHBondContact OD1-N 2.83Å; D136-L138 VanDerWaalsContact OD1-O 3.08Å; L138-Y185 HydrophobicContact CD1-CD2 4.03Å; L138-Y185 HydrophobicContact CD1-CG 4.15Å
139	L	71.6	Confident	71	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	113.5	166.2	-72.8	-177.7	0	0	0	109.2	F128 Y131 D132 D143 M176 L184 Y185	F128-L139 HydrophobicContact CB-CD1 4.37Å; F128-L139 HydrophobicContact CD1-CG 4.42Å; F128-L139 HydrophobicContact CD2-CB 4.46Å; F128-L139 HydrophobicContact CD2-CD1 3.11Å; F128-L139 HydrophobicContact CD2-CD2 4.5Å; F128-L139 HydrophobicContact CD2-CG 3.47Å; F128-L139 VanDerWaalsContact CD2-CG 3.47Å; F128-L139 HydrophobicContact CE1-CG 4.23Å; F128-L139 HydrophobicContact CE2-CB 3.92Å; F128-L139 HydrophobicContact CE2-CD1 3.44Å; F128-L139 VanDerWaalsContact CE2-CD1 3.44Å; F128-L139 HydrophobicContact CE2-CD2 4.49Å; F128-L139 HydrophobicContact CE2-CG 3.29Å; F128-L139 HydrophobicContact CG-CD1 3.82Å; F128-L139 HydrophobicContact CG-CG 4.08Å; F128-L139 HydrophobicContact CZ-CB 4.33Å; F128-L139 HydrophobicContact CZ-CD1 4.29Å; F128-L139 HydrophobicContact CZ-CG 3.69Å; Y131-L139 HydrophobicContact CG-CD1 4.49Å; D132-L139 HydrophobicContact CB-CD2 3.8Å; L139-D143 HydrophobicContact CD2-CB 4.37Å; L139-M176 HydrophobicContact CB-CE 4.1Å; L139-M176 HydrophobicContact CD1-CE 3.38Å; L139-M176 HydrophobicContact CD1-SD 4.01Å; L139-M176 HydrophobicContact CG-CE 4.36Å; L139-L184 HydrophobicContact CB-CD2 3.94Å; L139-L184 WeakPolarHBondContact O-CA 3.21Å; L139-L184 WeakPolarHBondContact O-CD2 3.25Å; L139-Y185 PolarHBondContact O-N 3.1Å
140	T	73.9	Confident	70.6	Confident	20 Å²	20	42.8 Å²	42.8	12%	0.123	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	161.1	172.6	73.6	0	0	0	0	110.5	S142 D143 L144	T140-S142 PolarHBondContact O-N 3.36Å; T140-S142 PolarHBondContact OG1-N 3.37Å; T140-D143 WeakPolarHBondContact CB-OD2 3.22Å; T140-D143 PolarHBondContact N-OD2 3.04Å; T140-D143 WeakPolarHBondContact O-CB 3.47Å; T140-D143 PolarHBondContact O-N 3.15Å; T140-D143 VanDerWaalsContact O-N 3.14Å; T140-D143 PolarHBondContact OG1-N 2.9Å; T140-D143 PolarHBondContact OG1-OD2 2.75Å; T140-L144 PolarHBondContact O-N 2.82Å
141	Q	71.9	Confident	70.1	Confident	57 Å²	57	43.3 Å²	43.3	27%	0.266	23%	0.234	S	C	.	.	H	α-helix	trans	-56.5	-35.1	171.4	-171.7	178.9	-1.4	0	0	111.8	L144 E145 L169	Q141-L144 PolarHBondContact O-N 3.34Å; Q141-E145 WeakPolarHBondContact O-CB 3.46Å; Q141-E145 PolarHBondContact O-N 3.03Å; Q141-L169 HydrophobicContact CG-CD1 3.83Å; Q141-L169 HydrophobicContact CG-CD2 4.47Å
142	S	73.1	Confident	69.8	Low	54 Å²	54	43.8 Å²	43.8	38%	0.378	24%	0.236	S	C	.	.	H	α-helix	trans	-66.6	-36.5	178.4	-173.9	0	0	0	0	112.3	T140 E145 K146	T140-S142 PolarHBondContact O-N 3.36Å; T140-S142 PolarHBondContact OG1-N 3.37Å; S142-E145 PolarHBondContact O-N 2.86Å; S142-K146 WeakPolarHBondContact O-CG 3.37Å; S142-K146 PolarHBondContact O-N 3.12Å
143	D	71.8	Confident	69.1	Low	4 Å²	4	47.6 Å²	47.6	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-48.6	175.9	-66.8	-54.2	0	0	0	111.1	Y131 T133 L139 T140 E145 K146 I147	Y131-D143 WeakPolarHBondContact O-CB 3.23Å; T133-D143 PolarHBondContact OG1-OD1 2.99Å; L139-D143 HydrophobicContact CD2-CB 4.37Å; T140-D143 WeakPolarHBondContact CB-OD2 3.22Å; T140-D143 PolarHBondContact N-OD2 3.04Å; T140-D143 WeakPolarHBondContact O-CB 3.47Å; T140-D143 PolarHBondContact O-N 3.15Å; T140-D143 VanDerWaalsContact O-N 3.14Å; T140-D143 PolarHBondContact OG1-N 2.9Å; T140-D143 PolarHBondContact OG1-OD2 2.75Å; D143-E145 VanDerWaalsContact C-N 3.32Å; D143-E145 PolarHBondContact O-N 3.26Å; D143-K146 PolarHBondContact O-N 3.31Å; D143-I147 VanDerWaalsContact O-CD1 3.24Å; D143-I147 WeakPolarHBondContact O-CD1 3.43Å; D143-I147 WeakPolarHBondContact O-CG1 3.47Å; D143-I147 PolarHBondContact O-N 2.91Å
144	L	70.1	Confident	68.5	Low	4 Å²	4	46.9 Å²	46.9	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-61.8	-40	177	-64.7	-178.7	0	0	0	112.2	Y131 T140 Q141 I147 L148 L169 I172 L184	Y131-L144 HydrophobicContact CD1-CD2 3.55Å; Y131-L144 HydrophobicContact CE1-CD2 4.1Å; Y131-L144 HydrophobicContact CG-CD2 4.1Å; T140-L144 PolarHBondContact O-N 2.82Å; Q141-L144 PolarHBondContact O-N 3.34Å; L144-I147 PolarHBondContact O-N 2.85Å; L144-L148 WeakPolarHBondContact O-CG 3.43Å; L144-L148 PolarHBondContact O-N 3.31Å; L144-L169 HydrophobicContact CB-CD2 3.15Å; L144-L169 HydrophobicContact CD1-CD2 3.84Å; L144-L169 HydrophobicContact CG-CD2 4.16Å; L144-I172 HydrophobicContact CD1-CB 4.33Å; L144-I172 HydrophobicContact CD1-CG2 3.79Å; L144-I172 HydrophobicContact CD2-CG2 3.91Å; L144-L184 HydrophobicContact CD1-CD2 3.84Å
145	E	71.5	Confident	67.6	Low	82 Å²	82	45.7 Å²	45.7	38%	0.383	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-48.5	178.4	179.9	174.7	-167.8	0	0	111.9	Q141 S142 D143 I147 L148 L149 V165	Q141-E145 WeakPolarHBondContact O-CB 3.46Å; Q141-E145 PolarHBondContact O-N 3.03Å; S142-E145 PolarHBondContact O-N 2.86Å; D143-E145 VanDerWaalsContact C-N 3.32Å; D143-E145 PolarHBondContact O-N 3.26Å; E145-I147 PolarHBondContact O-N 2.9Å; E145-I147 VanDerWaalsContact O-N 3.1Å; E145-L148 PolarHBondContact O-N 3.38Å; E145-L149 HydrophobicContact CG-CD1 4.15Å; E145-L149 VanDerWaalsContact O-CG 3.3Å; E145-L149 WeakPolarHBondContact O-CG 3.27Å; E145-L149 PolarHBondContact O-N 2.77Å; E145-V165 HydrophobicContact CG-CG1 4.1Å
146	K	69.9	Low	66.7	Low	108 Å²	108	45.5 Å²	45.5	47%	0.47	29%	0.285	S	S	.	.	H	α-helix	trans	-54.6	-33.6	176.5	-72.3	168.7	-170.9	165.2	0	112.2	S142 D143 S150	S142-K146 WeakPolarHBondContact O-CG 3.37Å; S142-K146 PolarHBondContact O-N 3.12Å; D143-K146 PolarHBondContact O-N 3.31Å; K146-S150 WeakPolarHBondContact O-CB 3.24Å; K146-S150 PolarHBondContact O-N 3.29Å
147	I	65.9	Low	65.6	Low	4 Å²	4	48.4 Å²	48.4	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-87.4	-37	-173.5	-64.3	161.4	0	0	0	111.5	F90 Y131 D143 L144 E145 L149 S150 V151	F90-I147 HydrophobicContact CE1-CD1 4.12Å; F90-I147 HydrophobicContact CE1-CG1 3.96Å; F90-I147 HydrophobicContact CE1-CG2 4.04Å; F90-I147 HydrophobicContact CE2-CD1 3.98Å; F90-I147 HydrophobicContact CE2-CG1 3.85Å; F90-I147 HydrophobicContact CZ-CB 4.45Å; F90-I147 HydrophobicContact CZ-CD1 3.3Å; F90-I147 HydrophobicContact CZ-CG1 3.36Å; F90-I147 HydrophobicContact CZ-CG2 4.29Å; Y131-I147 HydrophobicContact CD1-CB 3.82Å; Y131-I147 HydrophobicContact CD1-CD1 3.12Å; Y131-I147 HydrophobicContact CD1-CG1 4.05Å; Y131-I147 HydrophobicContact CD1-CG2 3.77Å; Y131-I147 HydrophobicContact CE1-CB 3.73Å; Y131-I147 HydrophobicContact CE1-CD1 3.89Å; Y131-I147 HydrophobicContact CE1-CG1 4.41Å; Y131-I147 HydrophobicContact CE1-CG2 3.25Å; Y131-I147 HydrophobicContact CG-CD1 3.64Å; D143-I147 VanDerWaalsContact O-CD1 3.24Å; D143-I147 WeakPolarHBondContact O-CD1 3.43Å; D143-I147 WeakPolarHBondContact O-CG1 3.47Å; D143-I147 PolarHBondContact O-N 2.91Å; L144-I147 PolarHBondContact O-N 2.85Å; E145-I147 PolarHBondContact O-N 2.9Å; E145-I147 VanDerWaalsContact O-N 3.1Å; I147-L149 VanDerWaalsContact C-N 3.28Å; I147-L149 PolarHBondContact O-N 3.21Å; I147-S150 WeakPolarHBondContact CA-OG 3.38Å; I147-S150 PolarHBondContact O-N 3.46Å; I147-S150 PolarHBondContact O-OG 2.99Å; I147-V151 HydrophobicContact CG2-CG2 4.16Å; I147-V151 VanDerWaalsContact O-CB 3.24Å; I147-V151 WeakPolarHBondContact O-CB 3.29Å; I147-V151 WeakPolarHBondContact O-CG2 3.46Å; I147-V151 PolarHBondContact O-N 3.46Å
148	L	67.1	Low	64.8	Low	14 Å²	14	55.4 Å²	55.4	7%	0.073	32%	0.317	C	S	.	.	H	α-helix	trans	-55.9	-50.9	166.4	-69.7	168.2	0	0	0	108.8	L144 E145 S150 V151 Y152 V165 L169 I172	L144-L148 WeakPolarHBondContact O-CG 3.43Å; L144-L148 PolarHBondContact O-N 3.31Å; E145-L148 PolarHBondContact O-N 3.38Å; L148-S150 VanDerWaalsContact C-N 3.32Å; L148-S150 PolarHBondContact O-N 3.43Å; L148-V151 PolarHBondContact O-N 3.26Å; L148-Y152 HydrophobicContact CD2-CE2 4.1Å; L148-Y152 WeakPolarHBondContact O-CD2 3.49Å; L148-Y152 PolarHBondContact O-N 2.79Å; L148-V165 HydrophobicContact CD1-CG1 4.05Å; L148-L169 HydrophobicContact CD1-CD2 3.69Å; L148-L169 HydrophobicContact CD1-CG 3.73Å; L148-I172 HydrophobicContact CD2-CD1 4.35Å
149	L	67.9	Low	64	Low	73 Å²	73	57 Å²	57	38%	0.382	34%	0.339	S	S	.	.	H	α-helix	trans	-57	-42.4	177.6	-67.6	172.3	0	0	0	112.9	E145 I147 S153	E145-L149 HydrophobicContact CG-CD1 4.15Å; E145-L149 VanDerWaalsContact O-CG 3.3Å; E145-L149 WeakPolarHBondContact O-CG 3.27Å; E145-L149 PolarHBondContact O-N 2.77Å; I147-L149 VanDerWaalsContact C-N 3.28Å; I147-L149 PolarHBondContact O-N 3.21Å; L149-S153 WeakPolarHBondContact O-CB 3.08Å; L149-S153 PolarHBondContact O-N 2.62Å; L149-S153 VanDerWaalsContact O-N 3.09Å; L149-S153 PolarHBondContact O-OG 3.12Å
150	S	62.9	Low	63.5	Low	26 Å²	26	57.7 Å²	57.7	18%	0.182	34%	0.342	C	S	.	.	H	α-helix	trans	-68.5	-42.9	178.9	74.3	0	0	0	0	112.4	K146 I147 L148 S153 L154	K146-S150 WeakPolarHBondContact O-CB 3.24Å; K146-S150 PolarHBondContact O-N 3.29Å; I147-S150 WeakPolarHBondContact CA-OG 3.38Å; I147-S150 PolarHBondContact O-N 3.46Å; I147-S150 PolarHBondContact O-OG 2.99Å; L148-S150 VanDerWaalsContact C-N 3.32Å; L148-S150 PolarHBondContact O-N 3.43Å; S150-S153 WeakPolarHBondContact O-CB 3.45Å; S150-S153 PolarHBondContact O-N 2.73Å; S150-L154 WeakPolarHBondContact O-CG 3.23Å; S150-L154 PolarHBondContact O-N 3.38Å
151	V	59.9	Low	63.2	Low	23 Å²	23	60.7 Å²	60.7	14%	0.139	36%	0.357	C	S	.	.	H	α-helix	trans	-61.3	-47.3	177.8	160.6	0	0	0	0	111.8	L10 I147 L148 S153 L154	L10-V151 HydrophobicContact CD1-CB 4.32Å; L10-V151 HydrophobicContact CD1-CG1 3.33Å; L10-V151 HydrophobicContact CD1-CG2 4Å; L10-V151 HydrophobicContact CD2-CG1 3.97Å; L10-V151 HydrophobicContact CD2-CG2 4.09Å; L10-V151 HydrophobicContact CG-CG1 4.19Å; I147-V151 HydrophobicContact CG2-CG2 4.16Å; I147-V151 VanDerWaalsContact O-CB 3.24Å; I147-V151 WeakPolarHBondContact O-CB 3.29Å; I147-V151 WeakPolarHBondContact O-CG2 3.46Å; I147-V151 PolarHBondContact O-N 3.46Å; L148-V151 PolarHBondContact O-N 3.26Å; V151-S153 VanDerWaalsContact C-N 3.32Å; V151-L154 VanDerWaalsContact O-CB 3.3Å; V151-L154 WeakPolarHBondContact O-CB 3.23Å; V151-L154 PolarHBondContact O-N 3.3Å; V151-L154 VanDerWaalsContact O-N 3.13Å
152	Y	60	Low	63.2	Low	56 Å²	56	64.5 Å²	64.5	22%	0.22	38%	0.38	C	S	.	.	H	α-helix	trans	-71.2	-32.2	-178.7	-77.7	-81.3	0	0	0	111.8	L148 L154 G155 L160	L148-Y152 HydrophobicContact CD2-CE2 4.1Å; L148-Y152 WeakPolarHBondContact O-CD2 3.49Å; L148-Y152 PolarHBondContact O-N 2.79Å; Y152-L154 PolarHBondContact O-N 2.68Å; Y152-G155 PolarHBondContact O-N 2.7Å; Y152-G155 VanDerWaalsContact O-N 3.09Å; Y152-L160 HydrophobicContact CD1-CD1 4.33Å; Y152-L160 HydrophobicContact CD1-CD2 3.57Å; Y152-L160 HydrophobicContact CD1-CG 3.84Å; Y152-L160 HydrophobicContact CD2-CD1 3.2Å; Y152-L160 HydrophobicContact CD2-CD2 4.03Å; Y152-L160 HydrophobicContact CD2-CG 3.47Å; Y152-L160 VanDerWaalsContact CD2-CG 3.47Å; Y152-L160 HydrophobicContact CE1-CD1 4.28Å; Y152-L160 HydrophobicContact CE1-CD2 3.53Å; Y152-L160 HydrophobicContact CE1-CG 4.1Å; Y152-L160 HydrophobicContact CE2-CD1 3.2Å; Y152-L160 HydrophobicContact CE2-CD2 4.07Å; Y152-L160 HydrophobicContact CE2-CG 3.82Å; Y152-L160 HydrophobicContact CG-CD1 3.82Å; Y152-L160 HydrophobicContact CG-CD2 3.82Å; Y152-L160 HydrophobicContact CG-CG 3.5Å
153	S	60.8	Low	63.2	Low	90 Å²	90	69.3 Å²	69.3	63%	0.629	40%	0.396	S	S	*	.	H	α-helix	trans	-60.1	-25.3	170.4	-59	0	0	0	0	113.2	L149 S150 V151	L149-S153 WeakPolarHBondContact O-CB 3.08Å; L149-S153 PolarHBondContact O-N 2.62Å; L149-S153 VanDerWaalsContact O-N 3.09Å; L149-S153 PolarHBondContact O-OG 3.12Å; S150-S153 WeakPolarHBondContact O-CB 3.45Å; S150-S153 PolarHBondContact O-N 2.73Å; V151-S153 VanDerWaalsContact C-N 3.32Å
154	L	54.8	Low	63	Low	37 Å²	37	73.6 Å²	73.6	19%	0.194	42%	0.416	C	S	.	.	H	α-helix	trans	-77	-29	175.9	-60.4	159.7	0	0	0	113.4	G83 F87 S150 V151 Y152 G156	G83-L154 WeakPolarHBondContact O-CD2 3.27Å; F87-L154 HydrophobicContact CB-CD1 3.35Å; F87-L154 HydrophobicContact CB-CD2 3.49Å; F87-L154 VanDerWaalsContact CB-CD2 3.49Å; F87-L154 HydrophobicContact CB-CG 3.98Å; F87-L154 HydrophobicContact CD1-CD1 4.11Å; F87-L154 HydrophobicContact CD2-CD1 3.62Å; F87-L154 HydrophobicContact CE2-CD1 4.43Å; F87-L154 HydrophobicContact CG-CD1 3.44Å; F87-L154 VanDerWaalsContact CG-CD1 3.44Å; F87-L154 HydrophobicContact CG-CD2 4.49Å; S150-L154 WeakPolarHBondContact O-CG 3.23Å; S150-L154 PolarHBondContact O-N 3.38Å; V151-L154 VanDerWaalsContact O-CB 3.3Å; V151-L154 WeakPolarHBondContact O-CB 3.23Å; V151-L154 PolarHBondContact O-N 3.3Å; V151-L154 VanDerWaalsContact O-N 3.13Å; Y152-L154 PolarHBondContact O-N 2.68Å; L154-G156 PolarHBondContact O-N 2.85Å
155	G	52.5	Low	62.8	Low	58 Å²	58	73.8 Å²	73.8	60%	0.598	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-8.8	-177.2	0	0	0	0	0	113.6	Y152 E157	Y152-G155 PolarHBondContact O-N 2.7Å; Y152-G155 VanDerWaalsContact O-N 3.09Å; G155-E157 PolarHBondContact O-N 2.88Å; G155-E157 VanDerWaalsContact O-N 3.17Å
156	G	52.3	Low	62.7	Low	74 Å²	74	75.6 Å²	75.6	76%	0.763	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	9.1	-173	0	0	0	0	0	113.6	L154	L154-G156 PolarHBondContact O-N 2.85Å
157	E	53.2	Low	62.6	Low	138 Å²	138	73.9 Å²	73.9	65%	0.645	43%	0.425	S	S	*	.			trans	-81.4	149.8	174.6	-68.1	-167.4	153.3	0	0	110.1	G155 A159	G155-E157 PolarHBondContact O-N 2.88Å; G155-E157 VanDerWaalsContact O-N 3.17Å; E157-A159 PolarHBondContact O-N 2.82Å
158	E	55.8	Low	62.4	Low	187 Å²	187	73.9 Å²	73.9	87%	0.874	43%	0.426	S	S	*	.			trans	-50.7	139.2	174.1	-66.7	-177.2	157.5	0	0	109.9	L160	E158-L160 PolarHBondContact O-N 3.4Å
159	A	58	Low	62.3	Low	88 Å²	88	73.7 Å²	73.7	73%	0.727	43%	0.425	S	S	*	.			trans	-45.5	130.3	-179.8	0	0	0	0	0	110.3	E157 N161	E157-A159 PolarHBondContact O-N 2.82Å; A159-N161 PolarHBondContact O-N 2.93Å
160	L	60.3	Low	62.2	Low	15 Å²	15	75.7 Å²	75.7	8%	0.079	43%	0.432	C	S	.	.			trans	-50.3	136.7	177.9	-74.8	-170.3	0	0	0	110.1	Y152 E158 Q164 V165	Y152-L160 HydrophobicContact CD1-CD1 4.33Å; Y152-L160 HydrophobicContact CD1-CD2 3.57Å; Y152-L160 HydrophobicContact CD1-CG 3.84Å; Y152-L160 HydrophobicContact CD2-CD1 3.2Å; Y152-L160 HydrophobicContact CD2-CD2 4.03Å; Y152-L160 HydrophobicContact CD2-CG 3.47Å; Y152-L160 VanDerWaalsContact CD2-CG 3.47Å; Y152-L160 HydrophobicContact CE1-CD1 4.28Å; Y152-L160 HydrophobicContact CE1-CD2 3.53Å; Y152-L160 HydrophobicContact CE1-CG 4.1Å; Y152-L160 HydrophobicContact CE2-CD1 3.2Å; Y152-L160 HydrophobicContact CE2-CD2 4.07Å; Y152-L160 HydrophobicContact CE2-CG 3.82Å; Y152-L160 HydrophobicContact CG-CD1 3.82Å; Y152-L160 HydrophobicContact CG-CD2 3.82Å; Y152-L160 HydrophobicContact CG-CG 3.5Å; E158-L160 PolarHBondContact O-N 3.4Å; L160-Q164 HydrophobicContact CB-CB 4.17Å; L160-Q164 HydrophobicContact CD1-CB 4.12Å; L160-Q164 HydrophobicContact CD2-CB 3.72Å; L160-Q164 HydrophobicContact CD2-CG 4.27Å; L160-Q164 HydrophobicContact CG-CB 4.23Å; L160-V165 HydrophobicContact CB-CG2 3.57Å; L160-V165 HydrophobicContact CD1-CG2 3.68Å; L160-V165 HydrophobicContact CG-CG2 4.31Å
161	N	67.9	Low	62.4	Low	82 Å²	82	76.5 Å²	76.5	44%	0.439	44%	0.441	S	S	.	.			trans	-69.4	156.4	165.4	66.9	31.9	0	0	0	109.9	A159 E163 Q164 V165	A159-N161 PolarHBondContact O-N 2.93Å; N161-E163 PolarHBondContact O-N 3.18Å; N161-E163 WeakPolarHBondContact OD1-CB 3.27Å; N161-E163 PolarHBondContact OD1-N 3.35Å; N161-Q164 VanDerWaalsContact N-OE1 3.12Å; N161-Q164 PolarHBondContact O-N 3.27Å; N161-Q164 VanDerWaalsContact OD1-CG 3.26Å; N161-Q164 WeakPolarHBondContact OD1-CG 3.32Å; N161-Q164 PolarHBondContact OD1-N 2.93Å; N161-Q164 PolarHBondContact OD1-OE1 3.39Å; N161-V165 PolarHBondContact O-N 3.4Å
162	D	71.2	Confident	62.5	Low	138 Å²	138	77.1 Å²	77.1	74%	0.738	44%	0.442	S	S	*	.	H	α-helix	trans	-53.9	-29.4	-177.6	-65.6	-14.9	0	0	0	112.7	K166	D162-K166 WeakPolarHBondContact O-CB 3.31Å; D162-K166 PolarHBondContact O-N 3.41Å
163	E	74.2	Confident	62.5	Low	155 Å²	155	76.7 Å²	76.7	72%	0.724	45%	0.448	S	S	*	.	H	α-helix	trans	-68.9	-43.1	177.8	-64.9	-174.2	165.7	0	0	112.6	N161 K166 S167	N161-E163 PolarHBondContact O-N 3.18Å; N161-E163 WeakPolarHBondContact OD1-CB 3.27Å; N161-E163 PolarHBondContact OD1-N 3.35Å; E163-K166 PolarHBondContact O-N 3.17Å; E163-S167 VanDerWaalsContact O-CB 3.27Å; E163-S167 WeakPolarHBondContact O-CB 3.22Å; E163-S167 PolarHBondContact O-N 3.24Å
164	Q	67.5	Low	62.7	Low	93 Å²	93	81.8 Å²	81.8	44%	0.435	45%	0.453	S	S	.	.	H	α-helix	trans	-67.1	-40	177.2	-72.4	167.8	-50.5	0	0	111.5	L160 N161 S168	L160-Q164 HydrophobicContact CB-CB 4.17Å; L160-Q164 HydrophobicContact CD1-CB 4.12Å; L160-Q164 HydrophobicContact CD2-CB 3.72Å; L160-Q164 HydrophobicContact CD2-CG 4.27Å; L160-Q164 HydrophobicContact CG-CB 4.23Å; N161-Q164 VanDerWaalsContact N-OE1 3.12Å; N161-Q164 PolarHBondContact O-N 3.27Å; N161-Q164 VanDerWaalsContact OD1-CG 3.26Å; N161-Q164 WeakPolarHBondContact OD1-CG 3.32Å; N161-Q164 PolarHBondContact OD1-N 2.93Å; N161-Q164 PolarHBondContact OD1-OE1 3.39Å; Q164-S168 WeakPolarHBondContact O-CB 3.42Å; Q164-S168 PolarHBondContact O-N 2.97Å; Q164-S168 PolarHBondContact O-OG 3.37Å
165	V	64.6	Low	62.8	Low	8 Å²	8	84.1 Å²	84.1	5%	0.048	47%	0.472	C	S	.	.	H	α-helix	trans	-60.3	-53	173.5	177.7	0	0	0	0	109.1	E145 L148 L160 N161 S167 S168 L169	E145-V165 HydrophobicContact CG-CG1 4.1Å; L148-V165 HydrophobicContact CD1-CG1 4.05Å; L160-V165 HydrophobicContact CB-CG2 3.57Å; L160-V165 HydrophobicContact CD1-CG2 3.68Å; L160-V165 HydrophobicContact CG-CG2 4.31Å; N161-V165 PolarHBondContact O-N 3.4Å; V165-S167 PolarHBondContact O-N 3.38Å; V165-S168 PolarHBondContact O-N 2.95Å; V165-L169 HydrophobicContact CG1-CD1 3.82Å; V165-L169 HydrophobicContact CG1-CG 4.23Å; V165-L169 VanDerWaalsContact O-CG 3.24Å; V165-L169 WeakPolarHBondContact O-CG 3.47Å; V165-L169 PolarHBondContact O-N 2.9Å
166	K	69.2	Low	63.1	Low	121 Å²	121	82.6 Å²	82.6	53%	0.526	45%	0.45	S	S	.	.	H	α-helix	trans	-59.3	-44.5	-179	-172.3	-178.2	176.7	-169.5	0	112.8	D162 E163 S168 L169 E170	D162-K166 WeakPolarHBondContact O-CB 3.31Å; D162-K166 PolarHBondContact O-N 3.41Å; E163-K166 PolarHBondContact O-N 3.17Å; K166-S168 VanDerWaalsContact C-N 3.34Å; K166-S168 PolarHBondContact O-N 3.34Å; K166-L169 WeakPolarHBondContact O-CB 3.33Å; K166-L169 PolarHBondContact O-N 2.73Å; K166-E170 VanDerWaalsContact CE-OE1 3.28Å; K166-E170 WeakPolarHBondContact CE-OE1 3.46Å; K166-E170 WeakPolarHBondContact O-CG 3.31Å; K166-E170 PolarHBondContact O-N 3.2Å
167	S	67.8	Low	63.5	Low	71 Å²	71	83 Å²	83	50%	0.497	44%	0.441	S	S	.	.	H	α-helix	trans	-61.5	-42.2	176.9	-177.4	0	0	0	0	112	E163 V165 E170 A171	E163-S167 VanDerWaalsContact O-CB 3.27Å; E163-S167 WeakPolarHBondContact O-CB 3.22Å; E163-S167 PolarHBondContact O-N 3.24Å; V165-S167 PolarHBondContact O-N 3.38Å; S167-E170 PolarHBondContact O-N 3.22Å; S167-A171 PolarHBondContact O-N 3.33Å
168	S	62.6	Low	63.8	Low	4 Å²	4	83 Å²	83	3%	0.028	45%	0.445	C	S	.	.	H	α-helix	trans	-66.1	-40.9	176.1	-58	0	0	0	0	111.8	Q164 V165 K166 A171 I172	Q164-S168 WeakPolarHBondContact O-CB 3.42Å; Q164-S168 PolarHBondContact O-N 2.97Å; Q164-S168 PolarHBondContact O-OG 3.37Å; V165-S168 PolarHBondContact O-N 2.95Å; K166-S168 VanDerWaalsContact C-N 3.34Å; K166-S168 PolarHBondContact O-N 3.34Å; S168-A171 PolarHBondContact O-N 3.25Å; S168-I172 VanDerWaalsContact O-CG1 3.29Å; S168-I172 WeakPolarHBondContact O-CG1 3.24Å; S168-I172 PolarHBondContact O-N 3.14Å
169	L	64.6	Low	63.9	Low	11 Å²	11	79 Å²	79	6%	0.058	42%	0.422	C	S	.	.	H	α-helix	trans	-61.1	-44.7	174.6	-70.3	173.4	0	0	0	112	Q141 L144 L148 V165 K166 A171 I172 S173	Q141-L169 HydrophobicContact CG-CD1 3.83Å; Q141-L169 HydrophobicContact CG-CD2 4.47Å; L144-L169 HydrophobicContact CB-CD2 3.15Å; L144-L169 HydrophobicContact CD1-CD2 3.84Å; L144-L169 HydrophobicContact CG-CD2 4.16Å; L148-L169 HydrophobicContact CD1-CD2 3.69Å; L148-L169 HydrophobicContact CD1-CG 3.73Å; V165-L169 HydrophobicContact CG1-CD1 3.82Å; V165-L169 HydrophobicContact CG1-CG 4.23Å; V165-L169 VanDerWaalsContact O-CG 3.24Å; V165-L169 WeakPolarHBondContact O-CG 3.47Å; V165-L169 PolarHBondContact O-N 2.9Å; K166-L169 WeakPolarHBondContact O-CB 3.33Å; K166-L169 PolarHBondContact O-N 2.73Å; L169-A171 VanDerWaalsContact C-N 3.34Å; L169-A171 PolarHBondContact O-N 3.37Å; L169-I172 PolarHBondContact O-N 3.13Å; L169-S173 WeakPolarHBondContact O-CB 3.44Å; L169-S173 PolarHBondContact O-N 3.02Å
170	E	66.9	Low	63.6	Low	115 Å²	115	85 Å²	85	54%	0.537	43%	0.432	S	S	.	.	H	α-helix	trans	-62.7	-41.1	177.3	-74.3	174.4	-173	0	0	111.6	K166 S167 S173 R174	K166-E170 VanDerWaalsContact CE-OE1 3.28Å; K166-E170 WeakPolarHBondContact CE-OE1 3.46Å; K166-E170 WeakPolarHBondContact O-CG 3.31Å; K166-E170 PolarHBondContact O-N 3.2Å; S167-E170 PolarHBondContact O-N 3.22Å; E170-S173 PolarHBondContact O-N 3.48Å; E170-R174 WeakPolarHBondContact O-CB 3.45Å; E170-R174 PolarHBondContact O-N 3.16Å
171	A	65.4	Low	63.2	Low	43 Å²	43	88.2 Å²	88.2	36%	0.355	47%	0.468	S	S	.	.	H	α-helix	trans	-65.5	-45.9	177.1	0	0	0	0	0	112.5	S167 S168 L169 S173 R174 C175	S167-A171 PolarHBondContact O-N 3.33Å; S168-A171 PolarHBondContact O-N 3.25Å; L169-A171 VanDerWaalsContact C-N 3.34Å; L169-A171 PolarHBondContact O-N 3.37Å; A171-S173 VanDerWaalsContact C-N 3.3Å; A171-S173 PolarHBondContact O-N 2.88Å; A171-R174 PolarHBondContact O-N 3.29Å; A171-C175 PolarHBondContact O-N 2.86Å; A171-C175 PolarHBondContact O-SG 3.07Å; A171-C175 VanDerWaalsContact O-SG 3.37Å
172	I	62.3	Low	62.6	Low	35 Å²	35	86.4 Å²	86.4	18%	0.179	46%	0.456	C	S	.	.	H	α-helix	trans	-62	-43.4	175.1	-66.7	165.5	0	0	0	109.8	L144 L148 S168 L169 R174 C175 M176	L144-I172 HydrophobicContact CD1-CB 4.33Å; L144-I172 HydrophobicContact CD1-CG2 3.79Å; L144-I172 HydrophobicContact CD2-CG2 3.91Å; L148-I172 HydrophobicContact CD2-CD1 4.35Å; S168-I172 VanDerWaalsContact O-CG1 3.29Å; S168-I172 WeakPolarHBondContact O-CG1 3.24Å; S168-I172 PolarHBondContact O-N 3.14Å; L169-I172 PolarHBondContact O-N 3.13Å; I172-R174 VanDerWaalsContact C-N 3.33Å; I172-R174 PolarHBondContact O-N 3.12Å; I172-C175 PolarHBondContact O-N 2.72Å; I172-M176 HydrophobicContact CG2-CE 4.23Å; I172-M176 HydrophobicContact CG2-CG 4.28Å; I172-M176 WeakPolarHBondContact O-CG 3.46Å; I172-M176 PolarHBondContact O-N 3.45Å
173	S	61.4	Low	61.8	Low	48 Å²	48	82.9 Å²	82.9	34%	0.336	44%	0.443	S	S	.	.	H	α-helix	trans	-59	-45.7	-178.8	-176.8	0	0	0	0	112.5	L169 E170 A171 M176 S177	L169-S173 WeakPolarHBondContact O-CB 3.44Å; L169-S173 PolarHBondContact O-N 3.02Å; E170-S173 PolarHBondContact O-N 3.48Å; A171-S173 VanDerWaalsContact C-N 3.3Å; A171-S173 PolarHBondContact O-N 2.88Å; S173-M176 PolarHBondContact O-N 2.82Å; S173-S177 WeakPolarHBondContact O-CB 3.48Å; S173-S177 PolarHBondContact O-N 2.96Å; S173-S177 PolarHBondContact O-OG 3Å
174	R	64.7	Low	60.8	Low	196 Å²	196	77.2 Å²	77.2	74%	0.74	42%	0.417	S	S	*	.	H	α-helix	trans	-62.2	-46.4	175.1	-171.4	173.9	-179.9	161	1	112.3	E170 A171 I172 M176 S177	E170-R174 WeakPolarHBondContact O-CB 3.45Å; E170-R174 PolarHBondContact O-N 3.16Å; A171-R174 PolarHBondContact O-N 3.29Å; I172-R174 VanDerWaalsContact C-N 3.33Å; I172-R174 PolarHBondContact O-N 3.12Å; R174-M176 VanDerWaalsContact C-N 3.29Å; R174-M176 PolarHBondContact O-N 2.99Å; R174-S177 PolarHBondContact O-N 3.26Å
175	C	57	Low	60	Low	87 Å²	87	77.3 Å²	77.3	59%	0.588	41%	0.414	S	S	*	.	H	α-helix	trans	-62.7	-33.7	179.4	-76	0	0	0	0	113.5	A171 I172	A171-C175 PolarHBondContact O-N 2.86Å; A171-C175 PolarHBondContact O-SG 3.07Å; A171-C175 VanDerWaalsContact O-SG 3.37Å; I172-C175 PolarHBondContact O-N 2.72Å
176	M	57.4	Low	59.3	Low	26 Å²	26	80.2 Å²	80.2	13%	0.128	43%	0.429	C	S	.	.	H	α-helix	trans	-83.1	-32.8	-179.9	-65.3	-140.6	-67.7	0	0	112.9	L139 I172 S173 R174 D178 R179 F182 L184	L139-M176 HydrophobicContact CB-CE 4.1Å; L139-M176 HydrophobicContact CD1-CE 3.38Å; L139-M176 HydrophobicContact CD1-SD 4.01Å; L139-M176 HydrophobicContact CG-CE 4.36Å; I172-M176 HydrophobicContact CG2-CE 4.23Å; I172-M176 HydrophobicContact CG2-CG 4.28Å; I172-M176 WeakPolarHBondContact O-CG 3.46Å; I172-M176 PolarHBondContact O-N 3.45Å; S173-M176 PolarHBondContact O-N 2.82Å; R174-M176 VanDerWaalsContact C-N 3.29Å; R174-M176 PolarHBondContact O-N 2.99Å; M176-D178 PolarHBondContact O-N 3.04Å; M176-R179 PolarHBondContact O-N 3.37Å; M176-F182 HydrophobicContact CB-CB 4.48Å; M176-L184 HydrophobicContact CB-CD1 3.75Å; M176-L184 HydrophobicContact CB-CG 4.38Å; M176-L184 HydrophobicContact CE-CD1 3.79Å; M176-L184 HydrophobicContact CE-CD2 3.4Å; M176-L184 HydrophobicContact CE-CG 3.5Å
177	S	62.2	Low	58.3	Low	83 Å²	83	77.9 Å²	77.9	58%	0.58	43%	0.425	S	S	*	.	H	α-helix	trans	-60.7	-29.9	177.4	-60.4	0	0	0	0	113	S173 R174 R179	S173-S177 WeakPolarHBondContact O-CB 3.48Å; S173-S177 PolarHBondContact O-N 2.96Å; S173-S177 PolarHBondContact O-OG 3Å; R174-S177 PolarHBondContact O-N 3.26Å; S177-R179 VanDerWaalsContact C-N 3.25Å; S177-R179 PolarHBondContact O-N 3.5Å
178	D	59.8	Low	57.2	Low	136 Å²	136	83.8 Å²	83.8	73%	0.727	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-8.7	178.8	-69.4	-22.7	0	0	0	113.4	M176	M176-D178 PolarHBondContact O-N 3.04Å
179	R	57.3	Low	56.5	Low	103 Å²	103	90.9 Å²	90.9	39%	0.389	47%	0.469	S	S	.	.	S	Bend	trans	-109.4	113.7	-176.2	-61.7	-121.9	-158.8	-155.8	3.3	111.3	E121 M176 S177 G181 F182	E121-R179 IonicContact OE1-NH1 3.63Å; M176-R179 PolarHBondContact O-N 3.37Å; S177-R179 VanDerWaalsContact C-N 3.25Å; S177-R179 PolarHBondContact O-N 3.5Å; R179-G181 PolarHBondContact O-N 2.76Å; R179-F182 HydrophobicContact CB-CD2 3.83Å; R179-F182 PolarHBondContact O-N 2.83Å
180	K	51.3	Low	55.4	Low	216 Å²	216	95.9 Å²	95.9	94%	0.939	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	128.3	171.1	-69.8	-173	177.8	-177.6	0	110.3
181	G	52.6	Low	54	Low	81 Å²	81	99 Å²	99	84%	0.835	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.9	-6.6	178.1	0	0	0	0	0	115	R179	R179-G181 PolarHBondContact O-N 2.76Å
182	F	53.8	Low	52.5	Low	44 Å²	44	110 Å²	110	19%	0.193	55%	0.551	C	S	.	*			trans	-113	115.2	174.8	-67.4	-69.6	0	0	0	109.7	L124 Q125 F128 M176 R179	L124-F182 HydrophobicContact CB-CE2 4.32Å; L124-F182 HydrophobicContact CB-CZ 4.01Å; Q125-F182 HydrophobicContact CG-CZ 4.19Å; F128-F182 HydrophobicContact CB-CD1 4.07Å; F128-F182 HydrophobicContact CB-CE1 3.5Å; F128-F182 VanDerWaalsContact CB-CE1 3.5Å; F128-F182 AromaticContact CD2-CD1 3.18Å; F128-F182 HydrophobicContact CD2-CD1 3.18Å; F128-F182 AromaticContact CD2-CE1 3.57Å; F128-F182 HydrophobicContact CD2-CE1 3.57Å; F128-F182 HydrophobicContact CD2-CG 4.34Å; F128-F182 AromaticContact CE2-CD1 3.66Å; F128-F182 HydrophobicContact CE2-CD1 3.66Å; F128-F182 HydrophobicContact CE2-CE1 4.4Å; F128-F182 AromaticContact CG-CD1 3.78Å; F128-F182 HydrophobicContact CG-CD1 3.78Å; F128-F182 AromaticContact CG-CE1 3.67Å; F128-F182 HydrophobicContact CG-CE1 3.67Å; M176-F182 HydrophobicContact CB-CB 4.48Å; R179-F182 HydrophobicContact CB-CD2 3.83Å; R179-F182 PolarHBondContact O-N 2.83Å
183	S	54.5	Low	52	Low	65 Å²	65	113.7 Å²	113.7	46%	0.455	57%	0.569	S	S	.	*			trans	-104.6	111.5	173.2	-173.7	0	0	0	0	108.7
184	L	53.3	Low	51.5	Low	36 Å²	36	117.2 Å²	117.2	19%	0.188	58%	0.581	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.3	119	161	-81.6	157	0	0	0	108	L139 L144 M176 N186	L139-L184 HydrophobicContact CB-CD2 3.94Å; L139-L184 WeakPolarHBondContact O-CA 3.21Å; L139-L184 WeakPolarHBondContact O-CD2 3.25Å; L144-L184 HydrophobicContact CD1-CD2 3.84Å; M176-L184 HydrophobicContact CB-CD1 3.75Å; M176-L184 HydrophobicContact CB-CG 4.38Å; M176-L184 HydrophobicContact CE-CD1 3.79Å; M176-L184 HydrophobicContact CE-CD2 3.4Å; M176-L184 HydrophobicContact CE-CG 3.5Å; L184-N186 PolarHBondContact O-N 2.7Å
185	Y	51.5	Low	50.8	Low	94 Å²	94	112.8 Å²	112.8	37%	0.369	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.8	104.3	173.6	-164.6	-92.9	0	0	0	108.4	L138 L139 T187 N190	L138-Y185 HydrophobicContact CD1-CD2 4.03Å; L138-Y185 HydrophobicContact CD1-CG 4.15Å; L139-Y185 PolarHBondContact O-N 3.1Å; Y185-T187 HydrophobicContact CD1-CG2 3.84Å; Y185-T187 HydrophobicContact CE1-CG2 3.96Å; Y185-T187 PolarHBondContact O-N 3.17Å; Y185-N190 PolarHBondContact OH-ND2 2.87Å; Y185-N190 VanDerWaalsContact OH-ND2 3.16Å
186	N	49.7	Very low	50.5	Low	69 Å²	69	114.3 Å²	114.3	37%	0.369	57%	0.572	S	S	.	*			trans	-80.2	99	173.2	-170.8	-2.4	0	0	0	109.1	L184 R188 E189	L184-N186 PolarHBondContact O-N 2.7Å; N186-R188 PolarHBondContact O-N 3.38Å; N186-R188 VanDerWaalsContact O-N 3.11Å; N186-R188 WeakPolarHBondContact OD1-CB 3.47Å; N186-R188 PolarHBondContact OD1-N 3Å; N186-R188 VanDerWaalsContact OD1-N 3.16Å; N186-E189 PolarHBondContact O-N 2.83Å
187	T	47.7	Very low	50	Low	72 Å²	72	119.8 Å²	119.8	44%	0.442	60%	0.599	S	S	.	*	G	3₁₀ helix	trans	-61.2	-17	177.8	35.3	0	0	0	0	113.3	Y185	Y185-T187 HydrophobicContact CD1-CG2 3.84Å; Y185-T187 HydrophobicContact CE1-CG2 3.96Å; Y185-T187 PolarHBondContact O-N 3.17Å
188	R	44.5	Very low	49.2	Very low	195 Å²	195	122.3 Å²	122.3	74%	0.736	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-82.4	-10.7	-177.6	-73.9	-176	166.5	175.5	-0.3	115.5	N186	N186-R188 PolarHBondContact O-N 3.38Å; N186-R188 VanDerWaalsContact O-N 3.11Å; N186-R188 WeakPolarHBondContact OD1-CB 3.47Å; N186-R188 PolarHBondContact OD1-N 3Å; N186-R188 VanDerWaalsContact OD1-N 3.16Å
189	E	47.8	Very low	48.4	Very low	153 Å²	153	121.3 Å²	121.3	72%	0.715	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-94.5	-7.7	-179.6	-75.9	-172.5	158.8	0	0	114.8	N186	N186-E189 PolarHBondContact O-N 2.83Å
190	N	41.7	Very low	47.8	Very low	116 Å²	116	122.7 Å²	122.7	62%	0.62	61%	0.607	S	S	*	*	S	Bend	trans	-109.5	16.9	-177.4	-85	-27.9	0	0	0	115.4	Y185	Y185-N190 PolarHBondContact OH-ND2 2.87Å; Y185-N190 VanDerWaalsContact OH-ND2 3.16Å
191	E	39.2	Very low	47.5	Very low	182 Å²	182	114.9 Å²	114.9	85%	0.85	58%	0.58	S	S	*	*			trans	-109.5	32.7	174	-72.6	-170.3	155.2	0	0	114.1
192	K	33.5	Very low	47	Very low	272 Å²	272	118 Å²	118	100%	1.183	56%	0.556	S	S	*	*			trans	-121.9	0	165.2	-81.8	-171.8	178.1	179.6	0	111

Retrieved 192 of 192 residues in 625.1 ms (Link to these results)

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