O77234_SCHMA Loading...

Stage-specific protein SPO-1

AlphaFold DB , UniProt , Accession O77234, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene SLP, Length 117 aa.

						>O77234_SCHMA|O77234|SLP
MKVTPIIFAVFCVVGAMTLITATTLEQAPHPSEKDMELVYIDAEYEKEGGLKSICNEIKRSFRKGRHHIYKVMDKYIRKEDLGMKMLDVAKILGRRIEKRMEYIAKKLDKMMEYESS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.3	Very low	36.8	Very low	236 Å²	236	82.6 Å²	82.6	100%	1.163	45%	0.445	S	S	*	.				0	115.4	0	-72.9	175.7	73	0	0	108.7
2	K	30.8	Very low	37.1	Very low	134 Å²	134	80.7 Å²	80.7	58%	0.583	44%	0.441	S	S	*	.			trans	-168.4	30.7	163	-104.9	162.2	-164	-179.5	0	113.6	T4	K2-T4 PolarHBondContact O-N 2.61Å
3	V	32	Very low	37.2	Very low	100 Å²	100	80.7 Å²	80.7	61%	0.606	45%	0.445	S	S	*	.			trans	-78.6	74.1	169.7	-168.4	0	0	0	0	109.2
4	T	37.2	Very low	37.3	Very low	81 Å²	81	80.5 Å²	80.5	50%	0.497	45%	0.447	S	S	.	.			trans	-144.5	107.9	172	41.7	0	0	0	0	104.6	K2	K2-T4 PolarHBondContact O-N 2.61Å
5	P	39.1	Very low	37.4	Very low	24 Å²	24	76.8 Å²	76.8	16%	0.156	43%	0.434	C	S	.	.	S	Bend	cis	-153.6	46.3	47.6	25.4	5.6	0	0	0	115.6	I7 F8 I104 L108	P5-I7 PolarHBondContact O-N 3.18Å; P5-F8 PolarHBondContact O-N 3.39Å; P5-F8 VanDerWaalsContact O-N 3.13Å; P5-I104 HydrophobicContact CB-CG2 4.02Å; P5-I104 HydrophobicContact CG-CG2 3.97Å; P5-L108 HydrophobicContact CG-CD2 4.38Å; P5-L108 HydrophobicContact CG-CG 4.09Å
6	I	41.3	Very low	37.4	Very low	91 Å²	91	74.6 Å²	74.6	47%	0.467	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-32.1	172.7	-63.6	175.4	0	0	0	111.3	F8 A9 L108	I6-F8 PolarHBondContact O-N 3.4Å; I6-F8 VanDerWaalsContact O-N 3.08Å; I6-A9 WeakPolarHBondContact O-CB 3.36Å; I6-A9 PolarHBondContact O-N 3.17Å; I6-L108 HydrophobicContact CG1-CD2 3.89Å
7	I	40.1	Very low	37.1	Very low	39 Å²	39	76.7 Å²	76.7	20%	0.2	44%	0.435	C	S	.	.	H	α-helix	trans	-41.2	-37	171.7	-48.9	-161.2	0	0	0	115	P5 I54 I58	P5-I7 PolarHBondContact O-N 3.18Å; I7-I54 HydrophobicContact CB-CG2 3.72Å; I7-I54 HydrophobicContact CD1-CB 3.84Å; I7-I54 HydrophobicContact CD1-CD1 4.3Å; I7-I54 HydrophobicContact CD1-CG1 3.49Å; I7-I54 VanDerWaalsContact CD1-CG1 3.49Å; I7-I54 HydrophobicContact CD1-CG2 3.94Å; I7-I54 HydrophobicContact CG1-CB 3.79Å; I7-I54 HydrophobicContact CG1-CD1 3.91Å; I7-I54 HydrophobicContact CG1-CG1 3.56Å; I7-I54 HydrophobicContact CG1-CG2 3.38Å; I7-I54 HydrophobicContact CG2-CG2 3.88Å; I7-I58 HydrophobicContact CB-CD1 4.25Å; I7-I58 HydrophobicContact CB-CG1 4.46Å; I7-I58 HydrophobicContact CG2-CD1 3.3Å; I7-I58 HydrophobicContact CG2-CG1 3.11Å; I7-I58 WeakPolarHBondContact O-CD1 3.04Å
8	F	37.2	Very low	37	Very low	44 Å²	44	77.6 Å²	77.6	19%	0.193	44%	0.443	C	S	.	.	H	α-helix	trans	-84.2	-16.7	-176.4	-153.4	-100.4	0	0	0	113.4	P5 I6 V10 F11 I97 R100 M101 I104	P5-F8 PolarHBondContact O-N 3.39Å; P5-F8 VanDerWaalsContact O-N 3.13Å; I6-F8 PolarHBondContact O-N 3.4Å; I6-F8 VanDerWaalsContact O-N 3.08Å; F8-V10 PolarHBondContact O-N 3.32Å; F8-F11 HydrophobicContact CD1-CB 4.28Å; F8-F11 HydrophobicContact CD2-CB 3.9Å; F8-F11 AromaticContact CD2-CD2 3.97Å; F8-F11 HydrophobicContact CD2-CD2 3.97Å; F8-F11 AromaticContact CD2-CG 3.94Å; F8-F11 HydrophobicContact CD2-CG 3.94Å; F8-F11 HydrophobicContact CE1-CB 4.49Å; F8-F11 HydrophobicContact CE1-CD1 4.03Å; F8-F11 HydrophobicContact CE1-CG 4.3Å; F8-F11 HydrophobicContact CE2-CB 4.11Å; F8-F11 AromaticContact CE2-CD1 3.94Å; F8-F11 HydrophobicContact CE2-CD1 3.94Å; F8-F11 AromaticContact CE2-CD2 3.55Å; F8-F11 HydrophobicContact CE2-CD2 3.55Å; F8-F11 HydrophobicContact CE2-CE1 4.22Å; F8-F11 AromaticContact CE2-CE2 3.84Å; F8-F11 HydrophobicContact CE2-CE2 3.84Å; F8-F11 AromaticContact CE2-CG 3.62Å; F8-F11 HydrophobicContact CE2-CG 3.62Å; F8-F11 HydrophobicContact CE2-CZ 4.19Å; F8-F11 HydrophobicContact CG-CB 4Å; F8-F11 HydrophobicContact CG-CG 4.39Å; F8-F11 HydrophobicContact CZ-CB 4.4Å; F8-F11 AromaticContact CZ-CD1 3.64Å; F8-F11 HydrophobicContact CZ-CD1 3.64Å; F8-F11 HydrophobicContact CZ-CD2 4.12Å; F8-F11 AromaticContact CZ-CE1 3.83Å; F8-F11 HydrophobicContact CZ-CE1 3.83Å; F8-F11 HydrophobicContact CZ-CE2 4.27Å; F8-F11 AromaticContact CZ-CG 3.82Å; F8-F11 HydrophobicContact CZ-CG 3.82Å; F8-F11 HydrophobicContact CZ-CZ 4.16Å; F8-F11 WeakPolarHBondContact O-CB 3.15Å; F8-F11 PolarHBondContact O-N 3.43Å; F8-F11 VanDerWaalsContact O-N 3.11Å; F8-I97 HydrophobicContact CE1-CG2 4.5Å; F8-R100 HydrophobicContact CE1-CB 4.39Å; F8-R100 HydrophobicContact CE1-CG 4.24Å; F8-R100 HydrophobicContact CZ-CG 4.28Å; F8-M101 HydrophobicContact CD1-CE 3.98Å; F8-M101 HydrophobicContact CD1-CG 3.76Å; F8-M101 HydrophobicContact CE1-CE 3.69Å; F8-M101 HydrophobicContact CE1-CG 3.71Å; F8-I104 HydrophobicContact CB-CD1 3.52Å; F8-I104 HydrophobicContact CB-CG2 4.19Å; F8-I104 HydrophobicContact CD1-CD1 3.41Å; F8-I104 VanDerWaalsContact CD1-CD1 3.41Å; F8-I104 HydrophobicContact CD2-CD1 4.01Å; F8-I104 HydrophobicContact CE1-CD1 4.05Å; F8-I104 HydrophobicContact CG-CD1 3.37Å
9	A	39.3	Very low	36.7	Very low	65 Å²	65	80.5 Å²	80.5	54%	0.537	46%	0.456	S	S	.	.	H	α-helix	trans	-64.4	-36.3	172	0	0	0	0	0	110.8	I6 F11 C12	I6-A9 WeakPolarHBondContact O-CB 3.36Å; I6-A9 PolarHBondContact O-N 3.17Å; A9-F11 VanDerWaalsContact C-N 3.27Å; A9-F11 PolarHBondContact O-N 2.89Å; A9-C12 PolarHBondContact O-N 3.45Å
10	V	39.3	Very low	36.3	Very low	45 Å²	45	81.9 Å²	81.9	27%	0.273	46%	0.461	S	S	.	.	H	α-helix	trans	-69.4	-24.4	174.7	-171.7	0	0	0	0	112	F8 C12 V13 V14 I58	F8-V10 PolarHBondContact O-N 3.32Å; V10-C12 PolarHBondContact O-N 3.44Å; V10-V13 PolarHBondContact O-N 3.43Å; V10-V14 HydrophobicContact CG1-CB 4.37Å; V10-V14 HydrophobicContact CG1-CG2 3.58Å; V10-V14 PolarHBondContact O-N 3.01Å; V10-I58 HydrophobicContact CB-CD1 4.37Å
11	F	39.7	Very low	36	Very low	50 Å²	50	83.3 Å²	83.3	22%	0.219	47%	0.472	C	S	.	.	H	α-helix	trans	-58	-35.1	173.1	-172	-84.3	0	0	0	111.6	F8 A9 F62 I97 M101	F8-F11 HydrophobicContact CD1-CB 4.28Å; F8-F11 HydrophobicContact CD2-CB 3.9Å; F8-F11 AromaticContact CD2-CD2 3.97Å; F8-F11 HydrophobicContact CD2-CD2 3.97Å; F8-F11 AromaticContact CD2-CG 3.94Å; F8-F11 HydrophobicContact CD2-CG 3.94Å; F8-F11 HydrophobicContact CE1-CB 4.49Å; F8-F11 HydrophobicContact CE1-CD1 4.03Å; F8-F11 HydrophobicContact CE1-CG 4.3Å; F8-F11 HydrophobicContact CE2-CB 4.11Å; F8-F11 AromaticContact CE2-CD1 3.94Å; F8-F11 HydrophobicContact CE2-CD1 3.94Å; F8-F11 AromaticContact CE2-CD2 3.55Å; F8-F11 HydrophobicContact CE2-CD2 3.55Å; F8-F11 HydrophobicContact CE2-CE1 4.22Å; F8-F11 AromaticContact CE2-CE2 3.84Å; F8-F11 HydrophobicContact CE2-CE2 3.84Å; F8-F11 AromaticContact CE2-CG 3.62Å; F8-F11 HydrophobicContact CE2-CG 3.62Å; F8-F11 HydrophobicContact CE2-CZ 4.19Å; F8-F11 HydrophobicContact CG-CB 4Å; F8-F11 HydrophobicContact CG-CG 4.39Å; F8-F11 HydrophobicContact CZ-CB 4.4Å; F8-F11 AromaticContact CZ-CD1 3.64Å; F8-F11 HydrophobicContact CZ-CD1 3.64Å; F8-F11 HydrophobicContact CZ-CD2 4.12Å; F8-F11 AromaticContact CZ-CE1 3.83Å; F8-F11 HydrophobicContact CZ-CE1 3.83Å; F8-F11 HydrophobicContact CZ-CE2 4.27Å; F8-F11 AromaticContact CZ-CG 3.82Å; F8-F11 HydrophobicContact CZ-CG 3.82Å; F8-F11 HydrophobicContact CZ-CZ 4.16Å; F8-F11 WeakPolarHBondContact O-CB 3.15Å; F8-F11 PolarHBondContact O-N 3.43Å; F8-F11 VanDerWaalsContact O-N 3.11Å; A9-F11 VanDerWaalsContact C-N 3.27Å; A9-F11 PolarHBondContact O-N 2.89Å; F11-F62 HydrophobicContact CD1-CZ 4.13Å; F11-F62 HydrophobicContact CD2-CD2 4.31Å; F11-F62 AromaticContact CD2-CE1 3.96Å; F11-F62 HydrophobicContact CD2-CE1 3.96Å; F11-F62 AromaticContact CD2-CE2 3.24Å; F11-F62 HydrophobicContact CD2-CE2 3.24Å; F11-F62 AromaticContact CD2-CZ 3.05Å; F11-F62 HydrophobicContact CD2-CZ 3.05Å; F11-F62 HydrophobicContact CE1-CE1 4.36Å; F11-F62 HydrophobicContact CE1-CZ 4.01Å; F11-F62 HydrophobicContact CE2-CD1 4.18Å; F11-F62 HydrophobicContact CE2-CD2 4.29Å; F11-F62 AromaticContact CE2-CE1 3.31Å; F11-F62 HydrophobicContact CE2-CE1 3.31Å; F11-F62 AromaticContact CE2-CE2 3.45Å; F11-F62 HydrophobicContact CE2-CE2 3.45Å; F11-F62 VanDerWaalsContact CE2-CE2 3.45Å; F11-F62 AromaticContact CE2-CZ 2.91Å; F11-F62 HydrophobicContact CE2-CZ 2.91Å; F11-F62 HydrophobicContact CG-CE2 4.05Å; F11-F62 AromaticContact CG-CZ 3.67Å; F11-F62 HydrophobicContact CG-CZ 3.67Å; F11-F62 AromaticContact CZ-CE1 3.53Å; F11-F62 HydrophobicContact CZ-CE1 3.53Å; F11-F62 HydrophobicContact CZ-CE2 4.38Å; F11-F62 AromaticContact CZ-CZ 3.43Å; F11-F62 HydrophobicContact CZ-CZ 3.43Å; F11-F62 VanDerWaalsContact CZ-CZ 3.43Å; F11-I97 HydrophobicContact CD1-CG2 4.38Å; F11-I97 HydrophobicContact CE1-CD1 4.05Å; F11-I97 HydrophobicContact CE1-CG1 4.15Å; F11-I97 HydrophobicContact CE1-CG2 4.16Å; F11-M101 HydrophobicContact CD1-CE 3.98Å
12	C	41.1	Very low	36	Very low	59 Å²	59	75.9 Å²	75.9	40%	0.399	45%	0.448	S	S	.	.	H	α-helix	trans	-76.8	-45.5	178.2	-132	0	0	0	0	111.6	A9 V10 A16 M101	A9-C12 PolarHBondContact O-N 3.45Å; V10-C12 PolarHBondContact O-N 3.44Å; C12-A16 WeakPolarHBondContact O-CB 3.24Å; C12-A16 PolarHBondContact O-N 2.91Å; C12-M101 HydrophobicContact CB-CE 3.39Å; C12-M101 HydrophobicContact CB-SD 3.98Å; C12-M101 WeakPolarHBondContact SG-CE 3.48Å; C12-M101 PolarHBondContact SG-SD 2.78Å
13	V	38.7	Very low	35.9	Very low	81 Å²	81	74 Å²	74	49%	0.491	45%	0.448	S	S	.	.	H	α-helix	trans	-74.4	-45.7	-172.8	-174.5	0	0	0	0	111.4	V10 M17	V10-V13 PolarHBondContact O-N 3.43Å; V13-M17 HydrophobicContact CG1-CG 4.24Å; V13-M17 WeakPolarHBondContact O-CA 3.47Å; V13-M17 WeakPolarHBondContact O-CB 3.46Å; V13-M17 WeakPolarHBondContact O-CG 3.48Å; V13-M17 PolarHBondContact O-N 3.42Å
14	V	38.6	Very low	35.7	Very low	78 Å²	78	74.9 Å²	74.9	47%	0.473	45%	0.454	S	S	.	.	H	α-helix	trans	-86	-34.7	-172.3	-175.9	0	0	0	0	112.8	V10 M17 T18	V10-V14 HydrophobicContact CG1-CB 4.37Å; V10-V14 HydrophobicContact CG1-CG2 3.58Å; V10-V14 PolarHBondContact O-N 3.01Å; V14-M17 PolarHBondContact O-N 3.04Å; V14-T18 PolarHBondContact O-N 3.4Å; V14-T18 PolarHBondContact O-OG1 3.41Å
15	G	38	Very low	35.2	Very low	25 Å²	25	78.9 Å²	78.9	26%	0.258	47%	0.471	S	S	.	.	H	α-helix	trans	-66.4	-41.4	174.5	0	0	0	0	0	111.8	L19	G15-L19 PolarHBondContact O-N 3.28Å
16	A	37.4	Very low	34.7	Very low	42 Å²	42	86.9 Å²	86.9	35%	0.347	51%	0.506	S	S	.	.	H	α-helix	trans	-71.7	-42.2	170.9	0	0	0	0	0	111.2	C12 T18 L19 I20	C12-A16 WeakPolarHBondContact O-CB 3.24Å; C12-A16 PolarHBondContact O-N 2.91Å; A16-T18 VanDerWaalsContact C-N 3.33Å; A16-T18 PolarHBondContact O-N 3.05Å; A16-L19 CarbonylContact O-C 3.54Å; A16-L19 PolarHBondContact O-N 3.18Å; A16-L19 VanDerWaalsContact O-N 3.1Å; A16-I20 HydrophobicContact CB-CD1 3.88Å; A16-I20 VanDerWaalsContact O-CB 3.29Å; A16-I20 WeakPolarHBondContact O-CB 3.46Å; A16-I20 WeakPolarHBondContact O-CD1 3.35Å; A16-I20 WeakPolarHBondContact O-CG1 3.31Å; A16-I20 PolarHBondContact O-N 3.35Å
17	M	32.8	Very low	34.3	Very low	110 Å²	110	91.9 Å²	91.9	54%	0.542	53%	0.528	S	S	.	.	H	α-helix	trans	-60.5	-38	180	-85.4	-79.3	-162.4	0	0	113.2	V13 V14 L19 I20 T21	V13-M17 HydrophobicContact CG1-CG 4.24Å; V13-M17 WeakPolarHBondContact O-CA 3.47Å; V13-M17 WeakPolarHBondContact O-CB 3.46Å; V13-M17 WeakPolarHBondContact O-CG 3.48Å; V13-M17 PolarHBondContact O-N 3.42Å; V14-M17 PolarHBondContact O-N 3.04Å; M17-L19 VanDerWaalsContact C-N 3.35Å; M17-I20 PolarHBondContact O-N 2.9Å; M17-T21 WeakPolarHBondContact O-CB 3.19Å; M17-T21 PolarHBondContact O-N 3.23Å; M17-T21 PolarHBondContact O-OG1 3Å
18	T	34.2	Very low	33.9	Very low	93 Å²	93	93.1 Å²	93.1	57%	0.571	54%	0.544	S	S	*	.	H	α-helix	trans	-75.9	-22.3	177.7	41.6	0	0	0	0	113.5	V14 A16	V14-T18 PolarHBondContact O-N 3.4Å; V14-T18 PolarHBondContact O-OG1 3.41Å; A16-T18 VanDerWaalsContact C-N 3.33Å; A16-T18 PolarHBondContact O-N 3.05Å
19	L	31.1	Very low	33.6	Very low	132 Å²	132	97.3 Å²	97.3	69%	0.691	58%	0.576	S	S	*	*	H	α-helix	trans	-80.3	-37.3	167.5	-117.6	101.7	0	0	0	111.9	G15 A16 M17 A22	G15-L19 PolarHBondContact O-N 3.28Å; A16-L19 CarbonylContact O-C 3.54Å; A16-L19 PolarHBondContact O-N 3.18Å; A16-L19 VanDerWaalsContact O-N 3.1Å; M17-L19 VanDerWaalsContact C-N 3.35Å; L19-A22 PolarHBondContact O-N 3.45Å
20	I	29.7	Very low	33.5	Very low	108 Å²	108	102 Å²	102	55%	0.554	59%	0.586	S	S	*	*	H	α-helix	trans	-75.8	-34.6	-176.7	-67	166.3	0	0	0	111.3	A16 M17 A22 T23	A16-I20 HydrophobicContact CB-CD1 3.88Å; A16-I20 VanDerWaalsContact O-CB 3.29Å; A16-I20 WeakPolarHBondContact O-CB 3.46Å; A16-I20 WeakPolarHBondContact O-CD1 3.35Å; A16-I20 WeakPolarHBondContact O-CG1 3.31Å; A16-I20 PolarHBondContact O-N 3.35Å; M17-I20 PolarHBondContact O-N 2.9Å; I20-A22 PolarHBondContact O-N 3.3Å; I20-T23 PolarHBondContact O-N 3.11Å
21	T	29.5	Very low	33.5	Very low	112 Å²	112	106 Å²	106	69%	0.687	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-17.7	174.1	35.4	0	0	0	0	113.1	M17	M17-T21 WeakPolarHBondContact O-CB 3.19Å; M17-T21 PolarHBondContact O-N 3.23Å; M17-T21 PolarHBondContact O-OG1 3Å
22	A	28.3	Very low	33.2	Very low	80 Å²	80	108.9 Å²	108.9	66%	0.661	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-16.3	178.7	0	0	0	0	0	113.8	L19 I20	L19-A22 PolarHBondContact O-N 3.45Å; I20-A22 PolarHBondContact O-N 3.3Å
23	T	29.7	Very low	32.9	Very low	95 Å²	95	113.1 Å²	113.1	58%	0.583	65%	0.653	S	S	*	*	S	Bend	trans	-134.9	84.9	-179.3	59.9	0	0	0	0	110.7	I20	I20-T23 PolarHBondContact O-N 3.11Å
24	T	27.2	Very low	33	Very low	119 Å²	119	116.5 Å²	116.5	73%	0.73	66%	0.661	S	S	*	*			trans	46.5	110.7	134.2	15.2	0	0	0	0	118.1	E26	T24-E26 PolarHBondContact O-N 3.37Å
25	L	26.7	Very low	33.1	Very low	165 Å²	165	119.5 Å²	119.5	86%	0.864	68%	0.675	S	S	*	*			trans	41.8	79.5	133.6	-75.6	159.6	0	0	0	115.9
26	E	29.7	Very low	33.2	Very low	192 Å²	192	127.3 Å²	127.3	90%	0.897	71%	0.707	S	S	*	*			trans	-169.3	96.6	143.6	-107.5	172.2	-157.4	0	0	107.8	T24 A28	T24-E26 PolarHBondContact O-N 3.37Å; E26-A28 PolarHBondContact O-N 2.94Å
27	Q	31.7	Very low	33.2	Very low	196 Å²	196	132.4 Å²	132.4	92%	0.916	72%	0.723	S	S	*	*			trans	-56.6	103.9	173.8	-82.5	162.9	-76.2	0	0	109.1
28	A	32	Very low	33.5	Very low	65 Å²	65	135.3 Å²	135.3	54%	0.537	74%	0.74	S	S	.	*			trans	-59.8	134.5	159	0	0	0	0	0	107.7	E26 H30	E26-A28 PolarHBondContact O-N 2.94Å; A28-H30 PolarHBondContact O-CD2 2.96Å; A28-H30 VanDerWaalsContact O-CD2 3.28Å; A28-H30 PolarHBondContact O-N 3.24Å
29	P	30.2	Very low	34	Very low	132 Å²	132	135 Å²	135	86%	0.857	74%	0.738	S	S	*	*			trans	-67.3	100.7	-179.7	25.9	-30.8	0	0	0	108.5
30	H	38.9	Very low	34.6	Very low	162 Å²	162	138.1 Å²	138.1	75%	0.75	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-65.4	143.2	172	-73.5	-82.2	0	0	0	109.6	A28 S32	A28-H30 PolarHBondContact O-CD2 2.96Å; A28-H30 VanDerWaalsContact O-CD2 3.28Å; A28-H30 PolarHBondContact O-N 3.24Å; H30-S32 PolarHBondContact O-N 3.33Å
31	P	37.4	Very low	35.6	Very low	130 Å²	130	136.3 Å²	136.3	84%	0.844	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-54.3	133	175.6	21.1	-30.8	0	0	0	110.3
32	S	33.5	Very low	36.6	Very low	110 Å²	110	136.4 Å²	136.4	77%	0.769	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-76.9	161.2	-172.8	59.5	0	0	0	0	113.4	H30	H30-S32 PolarHBondContact O-N 3.33Å
33	E	36	Very low	37.9	Very low	148 Å²	148	136 Å²	136	69%	0.692	73%	0.725	S	S	*	*	S	Bend	trans	83	111.4	164	-103.2	-169.5	136.6	0	0	116.9
34	K	40.8	Very low	39	Very low	153 Å²	153	135.8 Å²	135.8	67%	0.665	72%	0.718	S	S	*	*	S	Bend	trans	68	67.9	154.7	-60.2	168.7	-172.5	146.5	0	111.7	M36	K34-M36 PolarHBondContact O-N 3.26Å
35	D	41	Very low	40.4	Very low	141 Å²	141	133.5 Å²	133.5	75%	0.754	70%	0.696	S	S	*	*				52.5	77.1	123.3	-47.2	-37.2	0	0	0	111.3	E37	D35-E37 HydrophobicContact CB-CB 4.4Å; D35-E37 PolarHBondContact O-N 2.88Å
36	M	38.7	Very low	41.8	Very low	189 Å²	189	131 Å²	131	93%	0.931	68%	0.68	S	S	*	*			trans	-59	72.4	131.3	-85.3	-171.7	-76.3	0	0	106.4	K34 L38	K34-M36 PolarHBondContact O-N 3.26Å; M36-L38 VanDerWaalsContact C-N 3.34Å; M36-L38 PolarHBondContact O-N 3.15Å
37	E	38.6	Very low	43.4	Very low	149 Å²	149	127.9 Å²	127.9	70%	0.696	66%	0.664	S	S	*	*			trans	-47.8	113.2	157.4	-168.2	-179.3	-159.1	0	0	101.8	D35 V39	D35-E37 HydrophobicContact CB-CB 4.4Å; D35-E37 PolarHBondContact O-N 2.88Å; E37-V39 HydrophobicContact CB-CG2 3.51Å; E37-V39 VanDerWaalsContact CD-CG2 3.49Å; E37-V39 HydrophobicContact CG-CB 4.46Å; E37-V39 HydrophobicContact CG-CG2 3.41Å; E37-V39 VanDerWaalsContact CG-CG2 3.41Å; E37-V39 PolarHBondContact O-N 3.23Å; E37-V39 WeakPolarHBondContact OE2-CG2 3.28Å
38	L	39.5	Very low	44.9	Very low	170 Å²	170	128.2 Å²	128.2	89%	0.89	67%	0.665	S	S	*	*			trans	-66.2	68.1	165.1	-93.7	143.6	0	0	0	104.6	M36 Y40	M36-L38 VanDerWaalsContact C-N 3.34Å; M36-L38 PolarHBondContact O-N 3.15Å; L38-Y40 PolarHBondContact O-N 3.46Å
39	V	44.4	Very low	46.3	Very low	87 Å²	87	127.3 Å²	127.3	53%	0.527	66%	0.663	S	S	.	*			trans	-63.8	114	-176	-179.7	0	0	0	0	105	E37 I41	E37-V39 HydrophobicContact CB-CG2 3.51Å; E37-V39 VanDerWaalsContact CD-CG2 3.49Å; E37-V39 HydrophobicContact CG-CB 4.46Å; E37-V39 HydrophobicContact CG-CG2 3.41Å; E37-V39 VanDerWaalsContact CG-CG2 3.41Å; E37-V39 PolarHBondContact O-N 3.23Å; E37-V39 WeakPolarHBondContact OE2-CG2 3.28Å; V39-I41 PolarHBondContact O-N 2.82Å
40	Y	43	Very low	47.9	Very low	198 Å²	198	121.7 Å²	121.7	78%	0.776	63%	0.628	S	S	*	*			trans	-15.1	118.5	159.9	-84.3	-99	0	0	0	113.9	L38	L38-Y40 PolarHBondContact O-N 3.46Å
41	I	51.2	Low	49.1	Very low	69 Å²	69	116.4 Å²	116.4	35%	0.354	61%	0.605	S	S	.	*			trans	-135.5	64.3	148	-20	175.6	0	0	0	109	V39 A43 E44 Y45 L51	V39-I41 PolarHBondContact O-N 2.82Å; I41-A43 PolarHBondContact O-N 2.86Å; I41-E44 HydrophobicContact CB-CB 3.76Å; I41-E44 HydrophobicContact CB-CG 4.25Å; I41-E44 HydrophobicContact CD1-CB 4.44Å; I41-E44 WeakPolarHBondContact CD1-OE2 3.5Å; I41-E44 HydrophobicContact CG2-CB 3.31Å; I41-E44 HydrophobicContact CG2-CG 3.3Å; I41-E44 CarbonylContact O-C 3.56Å; I41-E44 PolarHBondContact O-N 3.24Å; I41-E44 VanDerWaalsContact O-N 3.16Å; I41-Y45 WeakPolarHBondContact O-CA 3.32Å; I41-Y45 WeakPolarHBondContact O-CB 3.49Å; I41-Y45 PolarHBondContact O-N 3.49Å; I41-L51 HydrophobicContact CB-CD1 4.28Å; I41-L51 HydrophobicContact CD1-CD1 4.24Å; I41-L51 HydrophobicContact CG1-CD1 4.34Å
42	D	51	Low	50.6	Low	115 Å²	115	113.7 Å²	113.7	62%	0.615	58%	0.58	S	S	*	*	H	α-helix	trans	-57.1	-37.4	173.6	-127.4	-5.4	0	0	0	110.4	Y45 E46	D42-Y45 WeakPolarHBondContact O-CB 3.32Å; D42-Y45 PolarHBondContact O-N 3.3Å; D42-E46 PolarHBondContact O-N 3.09Å
43	A	55.1	Low	52.3	Low	71 Å²	71	110.7 Å²	110.7	59%	0.587	56%	0.559	S	S	*	*	H	α-helix	trans	-68.8	-35.7	176	0	0	0	0	0	113.8	I41 K47	I41-A43 PolarHBondContact O-N 2.86Å; A43-K47 VanDerWaalsContact O-CG 3.31Å; A43-K47 WeakPolarHBondContact O-CG 3.37Å
44	E	53	Low	53.8	Low	91 Å²	91	104.2 Å²	104.2	43%	0.425	53%	0.529	S	S	.	.	H	α-helix	trans	-84.2	-19.6	172.3	-70.7	179.1	-175.3	0	0	112.2	I41 K47 G50 L51	I41-E44 HydrophobicContact CB-CB 3.76Å; I41-E44 HydrophobicContact CB-CG 4.25Å; I41-E44 HydrophobicContact CD1-CB 4.44Å; I41-E44 WeakPolarHBondContact CD1-OE2 3.5Å; I41-E44 HydrophobicContact CG2-CB 3.31Å; I41-E44 HydrophobicContact CG2-CG 3.3Å; I41-E44 CarbonylContact O-C 3.56Å; I41-E44 PolarHBondContact O-N 3.24Å; I41-E44 VanDerWaalsContact O-N 3.16Å; E44-K47 HydrophobicContact CG-CD 4.49Å; E44-K47 PolarHBondContact O-N 3.34Å; E44-G50 CarbonylContact O-C 3.52Å; E44-G50 WeakPolarHBondContact O-CA 3.44Å; E44-L51 PolarHBondContact O-N 3.18Å; E44-L51 VanDerWaalsContact O-N 3.1Å
45	Y	55.6	Low	55	Low	71 Å²	71	98 Å²	98	28%	0.278	51%	0.505	S	S	.	.	H	α-helix	trans	-62.5	-51.2	174.5	-176.6	-94.6	0	0	0	109.3	I41 D42 K47 L51 K52	I41-Y45 WeakPolarHBondContact O-CA 3.32Å; I41-Y45 WeakPolarHBondContact O-CB 3.49Å; I41-Y45 PolarHBondContact O-N 3.49Å; D42-Y45 WeakPolarHBondContact O-CB 3.32Å; D42-Y45 PolarHBondContact O-N 3.3Å; Y45-K47 VanDerWaalsContact C-N 3.33Å; Y45-K47 PolarHBondContact O-N 3.46Å; Y45-L51 HydrophobicContact CD2-CB 3.68Å; Y45-L51 HydrophobicContact CG-CB 4.39Å; Y45-K52 HydrophobicContact CD1-CB 3.91Å; Y45-K52 HydrophobicContact CD1-CD 4.34Å; Y45-K52 HydrophobicContact CD1-CG 4.48Å; Y45-K52 HydrophobicContact CD2-CB 4.33Å; Y45-K52 HydrophobicContact CE1-CB 3.76Å; Y45-K52 HydrophobicContact CE1-CD 3.97Å; Y45-K52 HydrophobicContact CE1-CG 3.94Å; Y45-K52 HydrophobicContact CE2-CB 4.18Å; Y45-K52 HydrophobicContact CG-CB 4.19Å; Y45-K52 WeakPolarHBondContact O-CA 3.46Å; Y45-K52 WeakPolarHBondContact O-CB 3.38Å; Y45-K52 PolarHBondContact O-N 3.17Å
46	E	57.2	Low	56.5	Low	113 Å²	113	95 Å²	95	53%	0.528	49%	0.489	S	S	.	.	S	Bend	trans	-75.3	-13.6	-178.6	-72.3	-65.2	149.2	0	0	115	D42 K52	D42-E46 PolarHBondContact O-N 3.09Å; E46-K52 WeakPolarHBondContact OE1-CD 3.48Å; E46-K52 IonicContact OE1-NZ 2.78Å; E46-K52 PolarHBondContact OE1-NZ 3.43Å; E46-K52 WeakPolarHBondContact OE2-CD 3.48Å; E46-K52 IonicContact OE2-NZ 2.62Å; E46-K52 PolarHBondContact OE2-NZ 3.37Å
47	K	62.4	Low	58.2	Low	126 Å²	126	90.3 Å²	90.3	55%	0.548	47%	0.465	S	S	.	.	S	Bend	trans	-65.9	142.8	178	-80.5	173.1	-168.3	176.6	0	112	A43 E44 Y45 G49 G50	A43-K47 VanDerWaalsContact O-CG 3.31Å; A43-K47 WeakPolarHBondContact O-CG 3.37Å; E44-K47 HydrophobicContact CG-CD 4.49Å; E44-K47 PolarHBondContact O-N 3.34Å; Y45-K47 VanDerWaalsContact C-N 3.33Å; Y45-K47 PolarHBondContact O-N 3.46Å; K47-G49 PolarHBondContact O-N 3.17Å; K47-G50 VanDerWaalsContact O-CA 3.25Å; K47-G50 WeakPolarHBondContact O-CA 3.33Å; K47-G50 PolarHBondContact O-N 3.35Å
48	E	63.5	Low	59.7	Low	202 Å²	202	84.2 Å²	84.2	94%	0.944	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	131	168.1	-167.5	173.1	-164.4	0	0	109.7	G50	E48-G50 PolarHBondContact O-N 2.94Å
49	G	61.8	Low	61.5	Low	47 Å²	47	81.9 Å²	81.9	49%	0.485	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	-5.1	-167	0	0	0	0	0	114.7	K47 S53	K47-G49 PolarHBondContact O-N 3.17Å; G49-S53 VanDerWaalsContact C-OG 3.28Å; G49-S53 WeakPolarHBondContact CA-OG 3.17Å; G49-S53 PolarHBondContact N-OG 2.87Å
50	G	62.7	Low	63.2	Low	13 Å²	13	84.4 Å²	84.4	13%	0.134	42%	0.419	C	S	.	.	S	Bend	trans	-84.7	-172.6	178	0	0	0	0	0	114.4	E44 K47 E48 K52 S53 I54	E44-G50 CarbonylContact O-C 3.52Å; E44-G50 WeakPolarHBondContact O-CA 3.44Å; K47-G50 VanDerWaalsContact O-CA 3.25Å; K47-G50 WeakPolarHBondContact O-CA 3.33Å; K47-G50 PolarHBondContact O-N 3.35Å; E48-G50 PolarHBondContact O-N 2.94Å; G50-K52 PolarHBondContact O-N 3.1Å; G50-K52 VanDerWaalsContact O-N 3.09Å; G50-S53 PolarHBondContact N-OG 3.24Å; G50-S53 PolarHBondContact O-N 3.35Å; G50-S53 VanDerWaalsContact O-N 3.1Å; G50-S53 PolarHBondContact O-OG 3.26Å; G50-I54 VanDerWaalsContact O-CG1 3.31Å; G50-I54 WeakPolarHBondContact O-CG1 3.35Å; G50-I54 PolarHBondContact O-N 3.06Å
51	L	64.8	Low	64.9	Low	51 Å²	51	78.1 Å²	78.1	27%	0.267	41%	0.405	S	S	.	.	H	α-helix	trans	-59.3	-27	-169.1	-60.9	166	0	0	0	113.8	I41 E44 Y45 I54 C55	I41-L51 HydrophobicContact CB-CD1 4.28Å; I41-L51 HydrophobicContact CD1-CD1 4.24Å; I41-L51 HydrophobicContact CG1-CD1 4.34Å; E44-L51 PolarHBondContact O-N 3.18Å; E44-L51 VanDerWaalsContact O-N 3.1Å; Y45-L51 HydrophobicContact CD2-CB 3.68Å; Y45-L51 HydrophobicContact CG-CB 4.39Å; L51-I54 HydrophobicContact CD2-CD1 4.42Å; L51-I54 WeakPolarHBondContact O-CB 3.42Å; L51-C55 WeakPolarHBondContact O-CB 3.47Å; L51-C55 PolarHBondContact O-N 2.79Å; L51-C55 PolarHBondContact O-SG 3.44Å
52	K	68.4	Low	66	Low	73 Å²	73	77.9 Å²	77.9	32%	0.317	40%	0.401	S	S	.	.	H	α-helix	trans	-70.5	-46	175.5	-178.1	174.3	-178.3	169	0	112.9	Y45 E46 G50 I54 C55 N56	Y45-K52 HydrophobicContact CD1-CB 3.91Å; Y45-K52 HydrophobicContact CD1-CD 4.34Å; Y45-K52 HydrophobicContact CD1-CG 4.48Å; Y45-K52 HydrophobicContact CD2-CB 4.33Å; Y45-K52 HydrophobicContact CE1-CB 3.76Å; Y45-K52 HydrophobicContact CE1-CD 3.97Å; Y45-K52 HydrophobicContact CE1-CG 3.94Å; Y45-K52 HydrophobicContact CE2-CB 4.18Å; Y45-K52 HydrophobicContact CG-CB 4.19Å; Y45-K52 WeakPolarHBondContact O-CA 3.46Å; Y45-K52 WeakPolarHBondContact O-CB 3.38Å; Y45-K52 PolarHBondContact O-N 3.17Å; E46-K52 WeakPolarHBondContact OE1-CD 3.48Å; E46-K52 IonicContact OE1-NZ 2.78Å; E46-K52 PolarHBondContact OE1-NZ 3.43Å; E46-K52 WeakPolarHBondContact OE2-CD 3.48Å; E46-K52 IonicContact OE2-NZ 2.62Å; E46-K52 PolarHBondContact OE2-NZ 3.37Å; G50-K52 PolarHBondContact O-N 3.1Å; G50-K52 VanDerWaalsContact O-N 3.09Å; K52-I54 PolarHBondContact O-N 3.13Å; K52-C55 PolarHBondContact O-N 3.26Å; K52-N56 WeakPolarHBondContact O-CB 3.36Å; K52-N56 PolarHBondContact O-N 2.84Å; K52-N56 PolarHBondContact O-ND2 2.95Å
53	S	69.7	Low	67.2	Low	47 Å²	47	81.2 Å²	81.2	33%	0.329	41%	0.405	S	S	.	.	H	α-helix	trans	-60.1	-41.2	177.8	70.5	0	0	0	0	110.5	G49 G50 N56 E57	G49-S53 VanDerWaalsContact C-OG 3.28Å; G49-S53 WeakPolarHBondContact CA-OG 3.17Å; G49-S53 PolarHBondContact N-OG 2.87Å; G50-S53 PolarHBondContact N-OG 3.24Å; G50-S53 PolarHBondContact O-N 3.35Å; G50-S53 VanDerWaalsContact O-N 3.1Å; G50-S53 PolarHBondContact O-OG 3.26Å; S53-N56 PolarHBondContact O-N 3.29Å; S53-E57 PolarHBondContact O-N 3.42Å
54	I	66.7	Low	68.6	Low	12 Å²	12	84.4 Å²	84.4	6%	0.062	41%	0.405	C	S	.	.	H	α-helix	trans	-55.8	-56.9	171.7	-70.1	179.6	0	0	0	110.9	I7 G50 L51 K52 N56 E57 I58	I7-I54 HydrophobicContact CB-CG2 3.72Å; I7-I54 HydrophobicContact CD1-CB 3.84Å; I7-I54 HydrophobicContact CD1-CD1 4.3Å; I7-I54 HydrophobicContact CD1-CG1 3.49Å; I7-I54 VanDerWaalsContact CD1-CG1 3.49Å; I7-I54 HydrophobicContact CD1-CG2 3.94Å; I7-I54 HydrophobicContact CG1-CB 3.79Å; I7-I54 HydrophobicContact CG1-CD1 3.91Å; I7-I54 HydrophobicContact CG1-CG1 3.56Å; I7-I54 HydrophobicContact CG1-CG2 3.38Å; I7-I54 HydrophobicContact CG2-CG2 3.88Å; G50-I54 VanDerWaalsContact O-CG1 3.31Å; G50-I54 WeakPolarHBondContact O-CG1 3.35Å; G50-I54 PolarHBondContact O-N 3.06Å; L51-I54 HydrophobicContact CD2-CD1 4.42Å; L51-I54 WeakPolarHBondContact O-CB 3.42Å; K52-I54 PolarHBondContact O-N 3.13Å; I54-N56 VanDerWaalsContact C-N 3.26Å; I54-N56 PolarHBondContact O-N 3.31Å; I54-E57 PolarHBondContact O-N 2.84Å; I54-I58 HydrophobicContact CG2-CD1 4.15Å; I54-I58 VanDerWaalsContact O-CG1 3.26Å; I54-I58 WeakPolarHBondContact O-CG1 3.37Å; I54-I58 PolarHBondContact O-N 3.25Å; I54-I58 VanDerWaalsContact O-N 3.17Å
55	C	65.9	Low	69.8	Low	22 Å²	22	81.6 Å²	81.6	15%	0.149	40%	0.401	C	S	.	.	H	α-helix	trans	-59.9	-36.4	178.8	-74.3	0	0	0	0	112.5	L51 K52 I58 K59	L51-C55 WeakPolarHBondContact O-CB 3.47Å; L51-C55 PolarHBondContact O-N 2.79Å; L51-C55 PolarHBondContact O-SG 3.44Å; K52-C55 PolarHBondContact O-N 3.26Å; C55-I58 PolarHBondContact O-N 2.91Å; C55-K59 VanDerWaalsContact O-CB 3.28Å; C55-K59 WeakPolarHBondContact O-CB 3.48Å; C55-K59 WeakPolarHBondContact O-CG 3.26Å; C55-K59 PolarHBondContact O-N 3.49Å
56	N	74	Confident	70.9	Confident	80 Å²	80	84.3 Å²	84.3	43%	0.428	41%	0.411	S	S	.	.	H	α-helix	trans	-68.3	-42.8	-179.4	-75.4	-20.3	0	0	0	112.3	K52 S53 I54 I58 K59 R60	K52-N56 WeakPolarHBondContact O-CB 3.36Å; K52-N56 PolarHBondContact O-N 2.84Å; K52-N56 PolarHBondContact O-ND2 2.95Å; S53-N56 PolarHBondContact O-N 3.29Å; I54-N56 VanDerWaalsContact C-N 3.26Å; I54-N56 PolarHBondContact O-N 3.31Å; N56-I58 VanDerWaalsContact C-N 3.32Å; N56-I58 PolarHBondContact O-N 3.49Å; N56-K59 PolarHBondContact O-N 3.42Å; N56-R60 VanDerWaalsContact O-CB 3.31Å; N56-R60 WeakPolarHBondContact O-CB 3.42Å; N56-R60 PolarHBondContact O-N 3.19Å
57	E	74.2	Confident	72	Confident	89 Å²	89	83.7 Å²	83.7	42%	0.416	41%	0.408	S	S	.	.	H	α-helix	trans	-67.1	-37.2	177.8	-168.1	53.6	-143.4	0	0	111.4	S53 I54 R60 S61	S53-E57 PolarHBondContact O-N 3.42Å; I54-E57 PolarHBondContact O-N 2.84Å; E57-R60 PolarHBondContact O-N 3.37Å; E57-R60 IonicContact OE2-CZ 3.72Å; E57-R60 IonicContact OE2-NH1 2.83Å; E57-R60 PolarHBondContact OE2-NH1 3.01Å; E57-S61 PolarHBondContact O-N 3.08Å; E57-S61 PolarHBondContact O-OG 2.83Å; E57-S61 VanDerWaalsContact O-OG 3.09Å
58	I	69.8	Low	73	Confident	22 Å²	22	83.5 Å²	83.5	11%	0.113	41%	0.409	C	S	.	.	H	α-helix	trans	-59.9	-56	171.2	-64.4	166.2	0	0	0	110.5	I7 V10 I54 C55 N56 R60 S61 F62	I7-I58 HydrophobicContact CB-CD1 4.25Å; I7-I58 HydrophobicContact CB-CG1 4.46Å; I7-I58 HydrophobicContact CG2-CD1 3.3Å; I7-I58 HydrophobicContact CG2-CG1 3.11Å; I7-I58 WeakPolarHBondContact O-CD1 3.04Å; V10-I58 HydrophobicContact CB-CD1 4.37Å; I54-I58 HydrophobicContact CG2-CD1 4.15Å; I54-I58 VanDerWaalsContact O-CG1 3.26Å; I54-I58 WeakPolarHBondContact O-CG1 3.37Å; I54-I58 PolarHBondContact O-N 3.25Å; I54-I58 VanDerWaalsContact O-N 3.17Å; C55-I58 PolarHBondContact O-N 2.91Å; N56-I58 VanDerWaalsContact C-N 3.32Å; N56-I58 PolarHBondContact O-N 3.49Å; I58-R60 PolarHBondContact O-N 3.19Å; I58-S61 PolarHBondContact O-N 2.93Å; I58-S61 VanDerWaalsContact O-N 3.1Å; I58-F62 HydrophobicContact CG2-CD2 3.38Å; I58-F62 HydrophobicContact CG2-CE2 3.33Å; I58-F62 VanDerWaalsContact O-CD2 3.31Å; I58-F62 WeakPolarHBondContact O-CD2 3.36Å; I58-F62 PolarHBondContact O-N 3.15Å
59	K	76.7	Confident	73.8	Confident	120 Å²	120	78.3 Å²	78.3	52%	0.522	39%	0.386	S	S	.	.	H	α-helix	trans	-56.1	-40.2	-178.6	-78.3	172.7	-178.3	177	0	111	C55 N56 R63	C55-K59 VanDerWaalsContact O-CB 3.28Å; C55-K59 WeakPolarHBondContact O-CB 3.48Å; C55-K59 WeakPolarHBondContact O-CG 3.26Å; C55-K59 PolarHBondContact O-N 3.49Å; N56-K59 PolarHBondContact O-N 3.42Å; K59-R63 WeakPolarHBondContact O-CB 3.43Å; K59-R63 PolarHBondContact O-N 3.48Å
60	R	80.7	Confident	74.6	Confident	140 Å²	140	82.3 Å²	82.3	53%	0.528	39%	0.388	S	S	.	.	H	α-helix	trans	-62.6	-49.2	176.1	-179.1	-174.1	-75	164.8	-10	111.6	N56 E57 I58 F62 R63 K64	N56-R60 VanDerWaalsContact O-CB 3.31Å; N56-R60 WeakPolarHBondContact O-CB 3.42Å; N56-R60 PolarHBondContact O-N 3.19Å; E57-R60 PolarHBondContact O-N 3.37Å; E57-R60 IonicContact OE2-CZ 3.72Å; E57-R60 IonicContact OE2-NH1 2.83Å; E57-R60 PolarHBondContact OE2-NH1 3.01Å; I58-R60 PolarHBondContact O-N 3.19Å; R60-F62 PolarHBondContact O-N 3.06Å; R60-R63 PolarHBondContact O-N 2.82Å; R60-K64 PolarHBondContact O-N 3.36Å; R60-K64 VanDerWaalsContact O-N 3.08Å
61	S	78.3	Confident	75.7	Confident	67 Å²	67	87.8 Å²	87.8	47%	0.469	41%	0.408	S	S	.	.	H	α-helix	trans	-61.5	-43.6	179.1	-65.9	0	0	0	0	111.9	E57 I58 K64 G65	E57-S61 PolarHBondContact O-N 3.08Å; E57-S61 PolarHBondContact O-OG 2.83Å; E57-S61 VanDerWaalsContact O-OG 3.09Å; I58-S61 PolarHBondContact O-N 2.93Å; I58-S61 VanDerWaalsContact O-N 3.1Å; S61-K64 PolarHBondContact O-N 3.41Å; S61-G65 PolarHBondContact O-N 3.02Å
62	F	74.4	Confident	76.5	Confident	64 Å²	64	89.5 Å²	89.5	28%	0.281	42%	0.42	S	S	.	.	H	α-helix	trans	-63.2	-42.2	173.9	-85.6	-68	0	0	0	113.2	F11 I58 R60 K64 G65 R66	F11-F62 HydrophobicContact CD1-CZ 4.13Å; F11-F62 HydrophobicContact CD2-CD2 4.31Å; F11-F62 AromaticContact CD2-CE1 3.96Å; F11-F62 HydrophobicContact CD2-CE1 3.96Å; F11-F62 AromaticContact CD2-CE2 3.24Å; F11-F62 HydrophobicContact CD2-CE2 3.24Å; F11-F62 AromaticContact CD2-CZ 3.05Å; F11-F62 HydrophobicContact CD2-CZ 3.05Å; F11-F62 HydrophobicContact CE1-CE1 4.36Å; F11-F62 HydrophobicContact CE1-CZ 4.01Å; F11-F62 HydrophobicContact CE2-CD1 4.18Å; F11-F62 HydrophobicContact CE2-CD2 4.29Å; F11-F62 AromaticContact CE2-CE1 3.31Å; F11-F62 HydrophobicContact CE2-CE1 3.31Å; F11-F62 AromaticContact CE2-CE2 3.45Å; F11-F62 HydrophobicContact CE2-CE2 3.45Å; F11-F62 VanDerWaalsContact CE2-CE2 3.45Å; F11-F62 AromaticContact CE2-CZ 2.91Å; F11-F62 HydrophobicContact CE2-CZ 2.91Å; F11-F62 HydrophobicContact CG-CE2 4.05Å; F11-F62 AromaticContact CG-CZ 3.67Å; F11-F62 HydrophobicContact CG-CZ 3.67Å; F11-F62 AromaticContact CZ-CE1 3.53Å; F11-F62 HydrophobicContact CZ-CE1 3.53Å; F11-F62 HydrophobicContact CZ-CE2 4.38Å; F11-F62 AromaticContact CZ-CZ 3.43Å; F11-F62 HydrophobicContact CZ-CZ 3.43Å; F11-F62 VanDerWaalsContact CZ-CZ 3.43Å; I58-F62 HydrophobicContact CG2-CD2 3.38Å; I58-F62 HydrophobicContact CG2-CE2 3.33Å; I58-F62 VanDerWaalsContact O-CD2 3.31Å; I58-F62 WeakPolarHBondContact O-CD2 3.36Å; I58-F62 PolarHBondContact O-N 3.15Å; R60-F62 PolarHBondContact O-N 3.06Å; F62-K64 VanDerWaalsContact C-N 3.29Å; F62-K64 PolarHBondContact O-N 3.09Å; F62-G65 PolarHBondContact O-N 2.91Å; F62-R66 WeakPolarHBondContact O-CB 3.26Å; F62-R66 WeakPolarHBondContact O-CG 3.46Å; F62-R66 PolarHBondContact O-N 2.89Å
63	R	77.3	Confident	77	Confident	184 Å²	184	88.6 Å²	88.6	69%	0.694	42%	0.418	S	S	*	.	H	α-helix	trans	-59.7	-43.7	178.2	-171.5	-177.6	-68.2	-179.6	-2.7	110.7	K59 R60 H67	K59-R63 WeakPolarHBondContact O-CB 3.43Å; K59-R63 PolarHBondContact O-N 3.48Å; R60-R63 PolarHBondContact O-N 2.82Å; R63-H67 PolarHBondContact O-N 2.93Å
64	K	82.9	Confident	77.6	Confident	138 Å²	138	92.1 Å²	92.1	60%	0.6	43%	0.433	S	S	*	.	H	α-helix	trans	-63	-48.8	175	-69.5	-179.8	178.7	-179.4	0	111.6	R60 S61 F62 H67 H68	R60-K64 PolarHBondContact O-N 3.36Å; R60-K64 VanDerWaalsContact O-N 3.08Å; S61-K64 PolarHBondContact O-N 3.41Å; F62-K64 VanDerWaalsContact C-N 3.29Å; F62-K64 PolarHBondContact O-N 3.09Å; K64-H67 WeakPolarHBondContact O-CB 3.35Å; K64-H67 PolarHBondContact O-N 3.46Å; K64-H68 PolarHBondContact O-CD2 3.05Å; K64-H68 PolarHBondContact O-N 3.45Å
65	G	78.4	Confident	78.7	Confident	33 Å²	33	98.7 Å²	98.7	34%	0.34	46%	0.461	S	S	.	.	H	α-helix	trans	-59.9	-47.4	179	0	0	0	0	0	113.3	S61 F62 H67 H68 I69	S61-G65 PolarHBondContact O-N 3.02Å; F62-G65 PolarHBondContact O-N 2.91Å; G65-H67 VanDerWaalsContact C-N 3.31Å; G65-H67 PolarHBondContact O-N 3.1Å; G65-H68 PolarHBondContact O-N 3.25Å; G65-I69 WeakPolarHBondContact O-CG1 3.31Å; G65-I69 PolarHBondContact O-N 2.83Å
66	R	78.9	Confident	79.8	Confident	127 Å²	127	101.5 Å²	101.5	48%	0.479	47%	0.469	S	S	.	.	H	α-helix	trans	-58.2	-41.4	178.2	-76.7	-168.5	-63.5	167.5	-1.8	112.5	F62 H68 I69 Y70	F62-R66 WeakPolarHBondContact O-CB 3.26Å; F62-R66 WeakPolarHBondContact O-CG 3.46Å; F62-R66 PolarHBondContact O-N 2.89Å; R66-H68 VanDerWaalsContact C-N 3.31Å; R66-H68 PolarHBondContact O-N 3.16Å; R66-I69 PolarHBondContact O-N 3.4Å; R66-I69 VanDerWaalsContact O-N 3.17Å; R66-Y70 HydrophobicContact CB-CD2 4.25Å; R66-Y70 HydrophobicContact CB-CE2 3.94Å; R66-Y70 WeakPolarHBondContact O-CD2 3.46Å; R66-Y70 PolarHBondContact O-N 2.99Å
67	H	81.2	Confident	80.2	Confident	100 Å²	100	103.2 Å²	103.2	46%	0.463	48%	0.477	S	S	.	.	H	α-helix	trans	-57.4	-43.2	177.3	-175.6	65.4	0	0	0	112.6	R63 K64 G65 K71	R63-H67 PolarHBondContact O-N 2.93Å; K64-H67 WeakPolarHBondContact O-CB 3.35Å; K64-H67 PolarHBondContact O-N 3.46Å; G65-H67 VanDerWaalsContact C-N 3.31Å; G65-H67 PolarHBondContact O-N 3.1Å; H67-K71 VanDerWaalsContact NE2-CE 3.32Å; H67-K71 WeakPolarHBondContact NE2-CE 3.43Å; H67-K71 WeakPolarHBondContact O-CG 3.46Å; H67-K71 PolarHBondContact O-N 2.96Å; H67-K71 VanDerWaalsContact O-N 3.15Å
68	H	83.4	Confident	80.9	Confident	122 Å²	122	110.4 Å²	110.4	57%	0.565	50%	0.501	S	S	*	.	H	α-helix	trans	-65.7	-40.1	176.9	-68.3	-66.6	0	0	0	112.2	K64 G65 R66 V72	K64-H68 PolarHBondContact O-CD2 3.05Å; K64-H68 PolarHBondContact O-N 3.45Å; G65-H68 PolarHBondContact O-N 3.25Å; R66-H68 VanDerWaalsContact C-N 3.31Å; R66-H68 PolarHBondContact O-N 3.16Å; H68-V72 PolarHBondContact O-N 3.46Å
69	I	79.8	Confident	81.8	Confident	93 Å²	93	114.1 Å²	114.1	48%	0.477	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-50.3	177.8	-61.1	170.5	0	0	0	109.7	G65 R66 K71 V72 M73	G65-I69 WeakPolarHBondContact O-CG1 3.31Å; G65-I69 PolarHBondContact O-N 2.83Å; R66-I69 PolarHBondContact O-N 3.4Å; R66-I69 VanDerWaalsContact O-N 3.17Å; I69-K71 VanDerWaalsContact C-N 3.29Å; I69-K71 PolarHBondContact O-N 2.96Å; I69-V72 PolarHBondContact O-N 3.42Å; I69-M73 HydrophobicContact CG2-CE 3.82Å; I69-M73 HydrophobicContact CG2-CG 4.04Å; I69-M73 HydrophobicContact CG2-SD 3.8Å; I69-M73 VanDerWaalsContact O-CG 3.32Å; I69-M73 WeakPolarHBondContact O-CG 3.31Å; I69-M73 PolarHBondContact O-N 3.23Å
70	Y	79.1	Confident	82.4	Confident	131 Å²	131	118.1 Å²	118.1	51%	0.514	54%	0.536	S	S	.	.	H	α-helix	trans	-56	-41.1	179.4	-72	-49.9	0	0	0	112.9	R66 V72 M73 D74	R66-Y70 HydrophobicContact CB-CD2 4.25Å; R66-Y70 HydrophobicContact CB-CE2 3.94Å; R66-Y70 WeakPolarHBondContact O-CD2 3.46Å; R66-Y70 PolarHBondContact O-N 2.99Å; Y70-V72 VanDerWaalsContact C-N 3.28Å; Y70-V72 PolarHBondContact O-N 3.11Å; Y70-M73 HydrophobicContact CD1-CE 3.12Å; Y70-M73 HydrophobicContact CE1-CE 3.42Å; Y70-M73 VanDerWaalsContact CE1-CE 3.42Å; Y70-M73 HydrophobicContact CG-CE 4.13Å; Y70-M73 PolarHBondContact O-N 3.31Å; Y70-D74 VanDerWaalsContact O-CB 3.31Å; Y70-D74 WeakPolarHBondContact O-CB 3.19Å; Y70-D74 PolarHBondContact O-N 3.3Å
71	K	85.2	Confident	82.9	Confident	128 Å²	128	114.7 Å²	114.7	56%	0.557	53%	0.529	S	S	*	.	H	α-helix	trans	-58.2	-38.7	174.5	-79	-175.7	170.1	-174	0	113.4	H67 I69 K75	H67-K71 VanDerWaalsContact NE2-CE 3.32Å; H67-K71 WeakPolarHBondContact NE2-CE 3.43Å; H67-K71 WeakPolarHBondContact O-CG 3.46Å; H67-K71 PolarHBondContact O-N 2.96Å; H67-K71 VanDerWaalsContact O-N 3.15Å; I69-K71 VanDerWaalsContact C-N 3.29Å; I69-K71 PolarHBondContact O-N 2.96Å; K71-K75 PolarHBondContact O-N 3.45Å
72	V	82.6	Confident	83.1	Confident	87 Å²	87	113.1 Å²	113.1	53%	0.527	52%	0.515	S	S	.	.	H	α-helix	trans	-74.4	-40.2	178.6	176.6	0	0	0	0	110.7	H68 I69 Y70 K75 Y76	H68-V72 PolarHBondContact O-N 3.46Å; I69-V72 PolarHBondContact O-N 3.42Å; Y70-V72 VanDerWaalsContact C-N 3.28Å; Y70-V72 PolarHBondContact O-N 3.11Å; V72-K75 PolarHBondContact O-N 3.31Å; V72-Y76 HydrophobicContact CG1-CD2 4.07Å; V72-Y76 HydrophobicContact CG1-CE2 4.14Å; V72-Y76 VanDerWaalsContact O-CD2 3.24Å; V72-Y76 WeakPolarHBondContact O-CD2 3.33Å; V72-Y76 PolarHBondContact O-N 3.26Å
73	M	77.1	Confident	83.5	Confident	55 Å²	55	112.4 Å²	112.4	27%	0.271	53%	0.526	S	S	.	.	H	α-helix	trans	-64.4	-46	179	-60.5	-165.8	-62.8	0	0	111.4	I69 Y70 K75 Y76 I77 M86	I69-M73 HydrophobicContact CG2-CE 3.82Å; I69-M73 HydrophobicContact CG2-CG 4.04Å; I69-M73 HydrophobicContact CG2-SD 3.8Å; I69-M73 VanDerWaalsContact O-CG 3.32Å; I69-M73 WeakPolarHBondContact O-CG 3.31Å; I69-M73 PolarHBondContact O-N 3.23Å; Y70-M73 HydrophobicContact CD1-CE 3.12Å; Y70-M73 HydrophobicContact CE1-CE 3.42Å; Y70-M73 VanDerWaalsContact CE1-CE 3.42Å; Y70-M73 HydrophobicContact CG-CE 4.13Å; Y70-M73 PolarHBondContact O-N 3.31Å; M73-K75 VanDerWaalsContact C-N 3.31Å; M73-K75 PolarHBondContact O-N 3.3Å; M73-Y76 CarbonylContact O-C 3.59Å; M73-Y76 PolarHBondContact O-N 3.1Å; M73-I77 WeakPolarHBondContact O-CA 3.35Å; M73-I77 PolarHBondContact O-N 3.29Å; M73-M86 HydrophobicContact CB-CE 3.91Å; M73-M86 HydrophobicContact CG-CE 3.26Å; M73-M86 HydrophobicContact SD-CE 3.19Å; M73-M86 WeakPolarHBondContact SD-CE 3.42Å; M73-M86 HydrophobicContact SD-SD 4.21Å
74	D	83.3	Confident	84	Confident	120 Å²	120	109.6 Å²	109.6	64%	0.642	52%	0.522	S	S	*	.	H	α-helix	trans	-56.8	-43.7	178	-174.3	61	0	0	0	111.9	Y70 Y76 I77	Y70-D74 VanDerWaalsContact O-CB 3.31Å; Y70-D74 WeakPolarHBondContact O-CB 3.19Å; Y70-D74 PolarHBondContact O-N 3.3Å; D74-Y76 PolarHBondContact O-N 2.75Å; D74-I77 WeakPolarHBondContact O-CG2 3.14Å; D74-I77 PolarHBondContact O-N 2.96Å
75	K	89.6	Confident	84.1	Confident	150 Å²	150	108.1 Å²	108.1	65%	0.652	52%	0.515	S	S	*	.	H	α-helix	trans	-58.7	-31.2	176.7	-175.8	177	179.1	-176	0	113.6	K71 V72 M73	K71-K75 PolarHBondContact O-N 3.45Å; V72-K75 PolarHBondContact O-N 3.31Å; M73-K75 VanDerWaalsContact C-N 3.31Å; M73-K75 PolarHBondContact O-N 3.3Å
76	Y	88.2	Confident	84.3	Confident	82 Å²	82	110 Å²	110	32%	0.322	52%	0.516	S	S	.	.	H	α-helix	trans	-117.8	14.3	-173	-60	-59.6	0	0	0	113.6	V72 M73 D74 R78 K79 L82	V72-Y76 HydrophobicContact CG1-CD2 4.07Å; V72-Y76 HydrophobicContact CG1-CE2 4.14Å; V72-Y76 VanDerWaalsContact O-CD2 3.24Å; V72-Y76 WeakPolarHBondContact O-CD2 3.33Å; V72-Y76 PolarHBondContact O-N 3.26Å; M73-Y76 CarbonylContact O-C 3.59Å; M73-Y76 PolarHBondContact O-N 3.1Å; D74-Y76 PolarHBondContact O-N 2.75Å; Y76-R78 PolarHBondContact O-N 3.2Å; Y76-K79 HydrophobicContact CD1-CD 4.01Å; Y76-K79 HydrophobicContact CG-CD 4.39Å; Y76-K79 WeakPolarHBondContact O-CB 3.07Å; Y76-K79 PolarHBondContact O-N 2.96Å; Y76-L82 WeakPolarHBondContact O-CD2 3.48Å
77	I	82.4	Confident	84.5	Confident	116 Å²	116	107.8 Å²	107.8	60%	0.595	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-25.8	-172.6	-163	162.1	0	0	0	113.8	M73 D74 K79	M73-I77 WeakPolarHBondContact O-CA 3.35Å; M73-I77 PolarHBondContact O-N 3.29Å; D74-I77 WeakPolarHBondContact O-CG2 3.14Å; D74-I77 PolarHBondContact O-N 2.96Å; I77-K79 VanDerWaalsContact C-N 3.35Å
78	R	89.7	Confident	84.8	Confident	240 Å²	240	106.9 Å²	106.9	91%	0.906	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-1.4	178.4	-58.4	-173.5	-176.4	-166.9	0.5	114.3	Y76	Y76-R78 PolarHBondContact O-N 3.2Å
79	K	88.5	Confident	84.8	Confident	100 Å²	100	105 Å²	105	44%	0.435	51%	0.509	S	S	.	.			trans	-80.9	123.3	178.3	-70.9	-164.7	171.4	-174.6	0	110.2	Y76 I77 D81 L82	Y76-K79 HydrophobicContact CD1-CD 4.01Å; Y76-K79 HydrophobicContact CG-CD 4.39Å; Y76-K79 WeakPolarHBondContact O-CB 3.07Å; Y76-K79 PolarHBondContact O-N 2.96Å; I77-K79 VanDerWaalsContact C-N 3.35Å; K79-D81 VanDerWaalsContact C-N 3.25Å; K79-D81 PolarHBondContact O-N 2.82Å; K79-L82 HydrophobicContact CB-CB 4.24Å; K79-L82 WeakPolarHBondContact O-CB 3.04Å; K79-L82 PolarHBondContact O-N 3.37Å; K79-L82 VanDerWaalsContact O-N 3.17Å
80	E	90.1	Very high	84.9	Confident	203 Å²	203	103.1 Å²	103.1	95%	0.949	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-33.1	179.9	-63.1	176.3	-178.8	0	0	112.4	L82	E80-L82 VanDerWaalsContact C-N 3.3Å; E80-L82 PolarHBondContact O-N 3.42Å
81	D	91.3	Very high	85.3	Confident	69 Å²	69	101.9 Å²	101.9	37%	0.369	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	4.9	-179.8	73.3	-20	0	0	0	114.3	K79 G83 M84 K85	K79-D81 VanDerWaalsContact C-N 3.25Å; K79-D81 PolarHBondContact O-N 2.82Å; D81-G83 PolarHBondContact O-N 2.6Å; D81-M84 PolarHBondContact O-N 2.83Å; D81-K85 PolarHBondContact O-N 2.87Å; D81-K85 IonicContact OD1-NZ 3.68Å; D81-K85 WeakPolarHBondContact OD2-CE 3.02Å; D81-K85 IonicContact OD2-NZ 2.61Å; D81-K85 PolarHBondContact OD2-NZ 2.83Å
82	L	82.8	Confident	85.3	Confident	34 Å²	34	99.1 Å²	99.1	18%	0.178	50%	0.495	C	S	.	.	H	α-helix	trans	-60.3	-44.4	-175.5	-175.4	65.9	0	0	0	112	Y76 K79 E80 M84 K85 M86	Y76-L82 WeakPolarHBondContact O-CD2 3.48Å; K79-L82 HydrophobicContact CB-CB 4.24Å; K79-L82 WeakPolarHBondContact O-CB 3.04Å; K79-L82 PolarHBondContact O-N 3.37Å; K79-L82 VanDerWaalsContact O-N 3.17Å; E80-L82 VanDerWaalsContact C-N 3.3Å; E80-L82 PolarHBondContact O-N 3.42Å; L82-M84 PolarHBondContact O-N 3.17Å; L82-K85 PolarHBondContact O-N 3.32Å; L82-M86 HydrophobicContact CD1-CE 3.86Å; L82-M86 HydrophobicContact CD2-CE 3.71Å; L82-M86 HydrophobicContact CG-CE 3.6Å; L82-M86 HydrophobicContact CG-CG 4.45Å; L82-M86 HydrophobicContact CG-SD 4.11Å; L82-M86 VanDerWaalsContact O-CG 3.28Å; L82-M86 WeakPolarHBondContact O-CG 2.99Å; L82-M86 PolarHBondContact O-N 3.3Å
83	G	82.6	Confident	85.2	Confident	49 Å²	49	98.6 Å²	98.6	51%	0.505	49%	0.489	S	S	.	.	H	α-helix	trans	-60.6	-43.6	-178.9	0	0	0	0	0	112.8	D81 M86 L87	D81-G83 PolarHBondContact O-N 2.6Å; G83-M86 WeakPolarHBondContact O-CB 3.15Å; G83-M86 PolarHBondContact O-N 2.89Å; G83-L87 PolarHBondContact O-N 3.5Å
84	M	86.1	Confident	85.4	Confident	125 Å²	125	97.6 Å²	97.6	62%	0.616	49%	0.493	S	S	*	.	H	α-helix	trans	-64.9	-43.1	177.5	-69.6	-56.5	-64.8	0	0	111.8	D81 L82 M86 L87 D88	D81-M84 PolarHBondContact O-N 2.83Å; L82-M84 PolarHBondContact O-N 3.17Å; M84-M86 VanDerWaalsContact C-N 3.31Å; M84-M86 PolarHBondContact O-N 3Å; M84-L87 WeakPolarHBondContact O-CB 3.29Å; M84-L87 PolarHBondContact O-N 3.5Å; M84-D88 PolarHBondContact O-N 3.3Å; M84-D88 VanDerWaalsContact O-N 3.11Å
85	K	85.3	Confident	85.6	Confident	107 Å²	107	98.7 Å²	98.7	47%	0.465	49%	0.488	S	S	.	.	H	α-helix	trans	-62.8	-37.9	175.3	-74.6	174.4	169.9	164.4	0	112.4	D81 L82 D88 V89	D81-K85 PolarHBondContact O-N 2.87Å; D81-K85 IonicContact OD1-NZ 3.68Å; D81-K85 WeakPolarHBondContact OD2-CE 3.02Å; D81-K85 IonicContact OD2-NZ 2.61Å; D81-K85 PolarHBondContact OD2-NZ 2.83Å; L82-K85 PolarHBondContact O-N 3.32Å; K85-D88 PolarHBondContact O-N 3.07Å; K85-V89 WeakPolarHBondContact O-CG2 3.37Å; K85-V89 PolarHBondContact O-N 3.38Å
86	M	82.2	Confident	85.4	Confident	71 Å²	71	99.6 Å²	99.6	35%	0.35	49%	0.488	S	S	.	.	H	α-helix	trans	-64.1	-41.7	175.1	-75.1	176.8	170.5	0	0	112	M73 L82 G83 M84 D88 V89 A90	M73-M86 HydrophobicContact CB-CE 3.91Å; M73-M86 HydrophobicContact CG-CE 3.26Å; M73-M86 HydrophobicContact SD-CE 3.19Å; M73-M86 WeakPolarHBondContact SD-CE 3.42Å; M73-M86 HydrophobicContact SD-SD 4.21Å; L82-M86 HydrophobicContact CD1-CE 3.86Å; L82-M86 HydrophobicContact CD2-CE 3.71Å; L82-M86 HydrophobicContact CG-CE 3.6Å; L82-M86 HydrophobicContact CG-CG 4.45Å; L82-M86 HydrophobicContact CG-SD 4.11Å; L82-M86 VanDerWaalsContact O-CG 3.28Å; L82-M86 WeakPolarHBondContact O-CG 2.99Å; L82-M86 PolarHBondContact O-N 3.3Å; G83-M86 WeakPolarHBondContact O-CB 3.15Å; G83-M86 PolarHBondContact O-N 2.89Å; M84-M86 VanDerWaalsContact C-N 3.31Å; M84-M86 PolarHBondContact O-N 3Å; M86-D88 VanDerWaalsContact C-N 3.32Å; M86-D88 PolarHBondContact O-N 3.14Å; M86-V89 PolarHBondContact O-N 2.96Å; M86-A90 WeakPolarHBondContact O-CB 3.46Å; M86-A90 PolarHBondContact O-N 2.85Å
87	L	84.5	Confident	85.1	Confident	82 Å²	82	98.2 Å²	98.2	43%	0.429	49%	0.485	S	S	.	.	H	α-helix	trans	-61	-42.2	176.5	-179.9	60.6	0	0	0	111.5	G83 M84 A90 K91	G83-L87 PolarHBondContact O-N 3.5Å; M84-L87 WeakPolarHBondContact O-CB 3.29Å; M84-L87 PolarHBondContact O-N 3.5Å; L87-A90 WeakPolarHBondContact O-CB 3.26Å; L87-A90 PolarHBondContact O-N 3.28Å; L87-K91 WeakPolarHBondContact O-CG 3.41Å; L87-K91 PolarHBondContact O-N 3.26Å
88	D	87.3	Confident	85.1	Confident	81 Å²	81	98.1 Å²	98.1	43%	0.433	48%	0.482	S	S	.	.	H	α-helix	trans	-65.4	-41.9	176.9	-71.9	-22.3	0	0	0	112.3	M84 K85 M86 A90 K91 I92	M84-D88 PolarHBondContact O-N 3.3Å; M84-D88 VanDerWaalsContact O-N 3.11Å; K85-D88 PolarHBondContact O-N 3.07Å; M86-D88 VanDerWaalsContact C-N 3.32Å; M86-D88 PolarHBondContact O-N 3.14Å; D88-A90 VanDerWaalsContact C-N 3.31Å; D88-A90 PolarHBondContact O-N 3.14Å; D88-K91 PolarHBondContact O-N 3.3Å; D88-K91 IonicContact OD1-NZ 3.93Å; D88-I92 WeakPolarHBondContact O-CG1 3.38Å; D88-I92 PolarHBondContact O-N 3.02Å; D88-I92 VanDerWaalsContact O-N 3.09Å
89	V	82.3	Confident	85	Confident	81 Å²	81	93.8 Å²	93.8	49%	0.491	47%	0.47	S	S	.	.	H	α-helix	trans	-60.5	-42.7	172.4	171.2	0	0	0	0	110.6	K85 M86 K91 I92 L93	K85-V89 WeakPolarHBondContact O-CG2 3.37Å; K85-V89 PolarHBondContact O-N 3.38Å; M86-V89 PolarHBondContact O-N 2.96Å; V89-K91 PolarHBondContact O-N 3.2Å; V89-I92 PolarHBondContact O-N 3.4Å; V89-L93 HydrophobicContact CG1-CD1 3.83Å; V89-L93 HydrophobicContact CG1-CG 4.21Å; V89-L93 WeakPolarHBondContact O-CB 3.28Å; V89-L93 WeakPolarHBondContact O-CG 3.17Å; V89-L93 PolarHBondContact O-N 2.83Å
90	A	83.1	Confident	84.8	Confident	54 Å²	54	95.5 Å²	95.5	45%	0.446	47%	0.474	S	S	.	.	H	α-helix	trans	-62.1	-42.7	178.3	0	0	0	0	0	112	M86 L87 D88 I92 L93 G94	M86-A90 WeakPolarHBondContact O-CB 3.46Å; M86-A90 PolarHBondContact O-N 2.85Å; L87-A90 WeakPolarHBondContact O-CB 3.26Å; L87-A90 PolarHBondContact O-N 3.28Å; D88-A90 VanDerWaalsContact C-N 3.31Å; D88-A90 PolarHBondContact O-N 3.14Å; A90-I92 VanDerWaalsContact C-N 3.34Å; A90-I92 PolarHBondContact O-N 3.37Å; A90-L93 PolarHBondContact O-N 2.89Å; A90-G94 PolarHBondContact O-N 3.08Å
91	K	86.3	Confident	84.3	Confident	105 Å²	105	87.8 Å²	87.8	46%	0.457	44%	0.438	S	S	.	.	H	α-helix	trans	-60.4	-41.9	174.3	-71.1	170.5	-177.2	167.9	0	112.2	L87 D88 V89 R95	L87-K91 WeakPolarHBondContact O-CG 3.41Å; L87-K91 PolarHBondContact O-N 3.26Å; D88-K91 PolarHBondContact O-N 3.3Å; D88-K91 IonicContact OD1-NZ 3.93Å; V89-K91 PolarHBondContact O-N 3.2Å; K91-R95 PolarHBondContact O-N 3.05Å
92	I	85.1	Confident	84	Confident	70 Å²	70	89.4 Å²	89.4	36%	0.359	44%	0.443	S	S	.	.	H	α-helix	trans	-65.6	-44.5	176.6	-67.1	166.1	0	0	0	110.6	D88 V89 A90 R96	D88-I92 WeakPolarHBondContact O-CG1 3.38Å; D88-I92 PolarHBondContact O-N 3.02Å; D88-I92 VanDerWaalsContact O-N 3.09Å; V89-I92 PolarHBondContact O-N 3.4Å; A90-I92 VanDerWaalsContact C-N 3.34Å; A90-I92 PolarHBondContact O-N 3.37Å; I92-R96 WeakPolarHBondContact O-CG 3.44Å; I92-R96 PolarHBondContact O-N 3.23Å; I92-R96 VanDerWaalsContact O-N 3.13Å
93	L	81.8	Confident	84.1	Confident	76 Å²	76	93.2 Å²	93.2	40%	0.398	46%	0.456	S	S	.	.	H	α-helix	trans	-63.7	-44	178	-74	175.3	0	0	0	111.6	V89 A90 R95 R96 I97	V89-L93 HydrophobicContact CG1-CD1 3.83Å; V89-L93 HydrophobicContact CG1-CG 4.21Å; V89-L93 WeakPolarHBondContact O-CB 3.28Å; V89-L93 WeakPolarHBondContact O-CG 3.17Å; V89-L93 PolarHBondContact O-N 2.83Å; A90-L93 PolarHBondContact O-N 2.89Å; L93-R95 PolarHBondContact O-N 3.07Å; L93-R96 WeakPolarHBondContact O-CB 3.39Å; L93-R96 PolarHBondContact O-N 3.38Å; L93-I97 WeakPolarHBondContact O-CB 3.3Å; L93-I97 VanDerWaalsContact O-CG1 3.26Å; L93-I97 WeakPolarHBondContact O-CG1 3.44Å; L93-I97 PolarHBondContact O-N 3.13Å
94	G	81.9	Confident	83.8	Confident	35 Å²	35	91.8 Å²	91.8	36%	0.361	44%	0.437	S	S	.	.	H	α-helix	trans	-53.9	-51.7	176.9	0	0	0	0	0	111.8	A90 R96 I97 E98	A90-G94 PolarHBondContact O-N 3.08Å; G94-R96 VanDerWaalsContact C-N 3.3Å; G94-R96 PolarHBondContact O-N 3.11Å; G94-I97 PolarHBondContact O-N 2.87Å; G94-I97 VanDerWaalsContact O-N 3.15Å; G94-E98 PolarHBondContact O-N 2.75Å
95	R	86.5	Confident	83.5	Confident	143 Å²	143	88.5 Å²	88.5	54%	0.54	43%	0.429	S	S	.	.	H	α-helix	trans	-60.7	-35.8	175.9	-70.3	-168.4	-66.1	-97.7	3.3	113.6	K91 L93 K99	K91-R95 PolarHBondContact O-N 3.05Å; L93-R95 PolarHBondContact O-N 3.07Å; R95-K99 WeakPolarHBondContact O-CG 3.46Å; R95-K99 PolarHBondContact O-N 3.43Å
96	R	86	Confident	83.5	Confident	169 Å²	169	90 Å²	90	64%	0.638	44%	0.436	S	S	*	.	H	α-helix	trans	-70	-38.7	177	-73.8	177.1	-178.9	-166	1.5	111.5	I92 L93 G94 R100	I92-R96 WeakPolarHBondContact O-CG 3.44Å; I92-R96 PolarHBondContact O-N 3.23Å; I92-R96 VanDerWaalsContact O-N 3.13Å; L93-R96 WeakPolarHBondContact O-CB 3.39Å; L93-R96 PolarHBondContact O-N 3.38Å; G94-R96 VanDerWaalsContact C-N 3.3Å; G94-R96 PolarHBondContact O-N 3.11Å; R96-R100 VanDerWaalsContact O-CB 3.26Å; R96-R100 WeakPolarHBondContact O-CB 3.31Å; R96-R100 PolarHBondContact O-N 3.1Å
97	I	81.9	Confident	83.5	Confident	53 Å²	53	90.8 Å²	90.8	27%	0.272	44%	0.437	S	S	.	.	H	α-helix	trans	-65.4	-48.3	177.7	-70.9	163.9	0	0	0	109.7	F8 F11 L93 G94 K99 R100 M101	F8-I97 HydrophobicContact CE1-CG2 4.5Å; F11-I97 HydrophobicContact CD1-CG2 4.38Å; F11-I97 HydrophobicContact CE1-CD1 4.05Å; F11-I97 HydrophobicContact CE1-CG1 4.15Å; F11-I97 HydrophobicContact CE1-CG2 4.16Å; L93-I97 WeakPolarHBondContact O-CB 3.3Å; L93-I97 VanDerWaalsContact O-CG1 3.26Å; L93-I97 WeakPolarHBondContact O-CG1 3.44Å; L93-I97 PolarHBondContact O-N 3.13Å; G94-I97 PolarHBondContact O-N 2.87Å; G94-I97 VanDerWaalsContact O-N 3.15Å; I97-K99 PolarHBondContact O-N 3.45Å; I97-R100 CarbonylContact O-C 3.44Å; I97-R100 WeakPolarHBondContact O-CA 3.01Å; I97-R100 WeakPolarHBondContact O-CB 3.33Å; I97-R100 PolarHBondContact O-N 2.91Å; I97-M101 HydrophobicContact CG2-CE 3.3Å; I97-M101 HydrophobicContact CG2-CG 4.47Å; I97-M101 HydrophobicContact CG2-SD 3.87Å; I97-M101 WeakPolarHBondContact O-CG 3.29Å; I97-M101 PolarHBondContact O-N 3.19Å
98	E	81.7	Confident	83.1	Confident	113 Å²	113	88.9 Å²	88.9	53%	0.528	43%	0.428	S	S	.	.	H	α-helix	trans	-53.7	-55.5	176.2	-178.8	-177.9	-166.3	0	0	111.9	G94 R100 M101 E102	G94-E98 PolarHBondContact O-N 2.75Å; E98-R100 PolarHBondContact O-N 3.09Å; E98-M101 WeakPolarHBondContact O-CA 3.48Å; E98-M101 WeakPolarHBondContact O-CB 3.49Å; E98-M101 PolarHBondContact O-N 2.62Å; E98-E102 PolarHBondContact O-N 3.34Å
99	K	87.2	Confident	82.9	Confident	149 Å²	149	89.7 Å²	89.7	65%	0.648	43%	0.432	S	S	*	.	H	α-helix	trans	-58.9	-34.1	176	-71.9	-175.3	177.1	-170.6	0	112.9	R95 I97 Y103	R95-K99 WeakPolarHBondContact O-CG 3.46Å; R95-K99 PolarHBondContact O-N 3.43Å; I97-K99 PolarHBondContact O-N 3.45Å; K99-Y103 WeakPolarHBondContact O-CB 3.46Å; K99-Y103 PolarHBondContact O-N 3.22Å
100	R	84	Confident	82.9	Confident	136 Å²	136	92.7 Å²	92.7	51%	0.513	44%	0.438	S	S	.	.	H	α-helix	trans	-70.8	-35.1	177.1	-167.3	60.6	171	-175.7	-1	111.3	F8 R96 I97 E98 Y103 I104	F8-R100 HydrophobicContact CE1-CB 4.39Å; F8-R100 HydrophobicContact CE1-CG 4.24Å; F8-R100 HydrophobicContact CZ-CG 4.28Å; R96-R100 VanDerWaalsContact O-CB 3.26Å; R96-R100 WeakPolarHBondContact O-CB 3.31Å; R96-R100 PolarHBondContact O-N 3.1Å; I97-R100 CarbonylContact O-C 3.44Å; I97-R100 WeakPolarHBondContact O-CA 3.01Å; I97-R100 WeakPolarHBondContact O-CB 3.33Å; I97-R100 PolarHBondContact O-N 2.91Å; E98-R100 PolarHBondContact O-N 3.09Å; R100-Y103 PolarHBondContact O-N 3.31Å; R100-I104 HydrophobicContact CG-CD1 3.94Å; R100-I104 WeakPolarHBondContact O-CB 3.33Å; R100-I104 WeakPolarHBondContact O-CD1 2.84Å; R100-I104 WeakPolarHBondContact O-CG1 3.33Å; R100-I104 PolarHBondContact O-N 2.87Å
101	M	80.5	Confident	82.9	Confident	41 Å²	41	92 Å²	92	20%	0.202	43%	0.426	C	S	.	.	H	α-helix	trans	-65.8	-46.1	173.9	-72	171.1	177.8	0	0	111.2	F8 F11 C12 I97 E98 Y103 I104 A105	F8-M101 HydrophobicContact CD1-CE 3.98Å; F8-M101 HydrophobicContact CD1-CG 3.76Å; F8-M101 HydrophobicContact CE1-CE 3.69Å; F8-M101 HydrophobicContact CE1-CG 3.71Å; F11-M101 HydrophobicContact CD1-CE 3.98Å; C12-M101 HydrophobicContact CB-CE 3.39Å; C12-M101 HydrophobicContact CB-SD 3.98Å; C12-M101 WeakPolarHBondContact SG-CE 3.48Å; C12-M101 PolarHBondContact SG-SD 2.78Å; I97-M101 HydrophobicContact CG2-CE 3.3Å; I97-M101 HydrophobicContact CG2-CG 4.47Å; I97-M101 HydrophobicContact CG2-SD 3.87Å; I97-M101 WeakPolarHBondContact O-CG 3.29Å; I97-M101 PolarHBondContact O-N 3.19Å; E98-M101 WeakPolarHBondContact O-CA 3.48Å; E98-M101 WeakPolarHBondContact O-CB 3.49Å; E98-M101 PolarHBondContact O-N 2.62Å; M101-Y103 VanDerWaalsContact C-N 3.33Å; M101-Y103 PolarHBondContact O-N 3.12Å; M101-I104 PolarHBondContact O-N 3.26Å; M101-I104 VanDerWaalsContact O-N 3.16Å; M101-A105 WeakPolarHBondContact O-CB 3.39Å; M101-A105 PolarHBondContact O-N 2.97Å
102	E	84.8	Confident	82.6	Confident	103 Å²	103	92 Å²	92	48%	0.481	43%	0.429	S	S	.	.	H	α-helix	trans	-56.9	-46.5	173.5	-69.2	177.8	-172.9	0	0	112.1	E98 I104 A105 K106	E98-E102 PolarHBondContact O-N 3.34Å; E102-I104 VanDerWaalsContact C-N 3.32Å; E102-I104 PolarHBondContact O-N 3.2Å; E102-A105 PolarHBondContact O-N 3.1Å; E102-K106 WeakPolarHBondContact O-CG 3.36Å; E102-K106 PolarHBondContact O-N 3.44Å
103	Y	84.6	Confident	82.3	Confident	115 Å²	115	94 Å²	94	45%	0.451	44%	0.437	S	S	.	.	H	α-helix	trans	-61.2	-42.1	177.1	171.7	-96.5	0	0	0	112	K99 R100 M101 K107	K99-Y103 WeakPolarHBondContact O-CB 3.46Å; K99-Y103 PolarHBondContact O-N 3.22Å; R100-Y103 PolarHBondContact O-N 3.31Å; M101-Y103 VanDerWaalsContact C-N 3.33Å; M101-Y103 PolarHBondContact O-N 3.12Å; Y103-K107 HydrophobicContact CE1-CD 4.15Å; Y103-K107 WeakPolarHBondContact O-CB 3.25Å; Y103-K107 PolarHBondContact O-N 3.5Å
104	I	77.6	Confident	81.7	Confident	18 Å²	18	98.8 Å²	98.8	9%	0.092	45%	0.451	C	S	.	.	H	α-helix	trans	-66.7	-43.1	179.3	-77.5	168.1	0	0	0	111	P5 F8 R100 M101 E102 K107 L108	P5-I104 HydrophobicContact CB-CG2 4.02Å; P5-I104 HydrophobicContact CG-CG2 3.97Å; F8-I104 HydrophobicContact CB-CD1 3.52Å; F8-I104 HydrophobicContact CB-CG2 4.19Å; F8-I104 HydrophobicContact CD1-CD1 3.41Å; F8-I104 VanDerWaalsContact CD1-CD1 3.41Å; F8-I104 HydrophobicContact CD2-CD1 4.01Å; F8-I104 HydrophobicContact CE1-CD1 4.05Å; F8-I104 HydrophobicContact CG-CD1 3.37Å; R100-I104 HydrophobicContact CG-CD1 3.94Å; R100-I104 WeakPolarHBondContact O-CB 3.33Å; R100-I104 WeakPolarHBondContact O-CD1 2.84Å; R100-I104 WeakPolarHBondContact O-CG1 3.33Å; R100-I104 PolarHBondContact O-N 2.87Å; M101-I104 PolarHBondContact O-N 3.26Å; M101-I104 VanDerWaalsContact O-N 3.16Å; E102-I104 VanDerWaalsContact C-N 3.32Å; E102-I104 PolarHBondContact O-N 3.2Å; I104-K107 PolarHBondContact O-N 3.19Å; I104-K107 VanDerWaalsContact O-N 3.14Å; I104-L108 HydrophobicContact CG2-CD1 4.1Å; I104-L108 PolarHBondContact O-N 2.95Å
105	A	79.7	Confident	80.9	Confident	56 Å²	56	103 Å²	103	46%	0.463	46%	0.461	S	S	.	.	H	α-helix	trans	-58.7	-49.2	175.3	0	0	0	0	0	111.1	M101 E102 K107 L108 D109	M101-A105 WeakPolarHBondContact O-CB 3.39Å; M101-A105 PolarHBondContact O-N 2.97Å; E102-A105 PolarHBondContact O-N 3.1Å; A105-K107 PolarHBondContact O-N 3.31Å; A105-L108 WeakPolarHBondContact O-CB 3.43Å; A105-L108 PolarHBondContact O-N 3.36Å; A105-D109 WeakPolarHBondContact O-CB 3.44Å; A105-D109 PolarHBondContact O-N 2.83Å
106	K	84	Confident	80	Confident	139 Å²	139	101.2 Å²	101.2	60%	0.604	47%	0.471	S	S	*	.	H	α-helix	trans	-59.8	-33.9	175	-71.7	176.1	-178.4	175.5	0	113.2	E102 K110	E102-K106 WeakPolarHBondContact O-CG 3.36Å; E102-K106 PolarHBondContact O-N 3.44Å; K106-K110 VanDerWaalsContact O-CG 3.3Å; K106-K110 WeakPolarHBondContact O-CG 3.48Å; K106-K110 PolarHBondContact O-N 3.4Å
107	K	83.2	Confident	78.6	Confident	87 Å²	87	100.8 Å²	100.8	38%	0.378	49%	0.494	S	S	.	.	H	α-helix	trans	-75.4	-37.6	179.1	-171.9	171.3	-176.7	175.4	0	111.8	Y103 I104 A105 M111	Y103-K107 HydrophobicContact CE1-CD 4.15Å; Y103-K107 WeakPolarHBondContact O-CB 3.25Å; Y103-K107 PolarHBondContact O-N 3.5Å; I104-K107 PolarHBondContact O-N 3.19Å; I104-K107 VanDerWaalsContact O-N 3.14Å; A105-K107 PolarHBondContact O-N 3.31Å; K107-M111 HydrophobicContact CD-CE 4.29Å; K107-M111 VanDerWaalsContact CE-CE 3.45Å; K107-M111 HydrophobicContact CG-CE 4.03Å; K107-M111 HydrophobicContact CG-SD 4.39Å; K107-M111 VanDerWaalsContact O-CG 3.29Å; K107-M111 WeakPolarHBondContact O-CG 3.15Å; K107-M111 PolarHBondContact O-N 2.69Å; K107-M111 VanDerWaalsContact O-N 3.14Å
108	L	75.7	Confident	78.4	Confident	43 Å²	43	103.2 Å²	103.2	23%	0.225	51%	0.505	C	S	.	.	H	α-helix	trans	-59.1	-54.3	172.1	-85.8	165.3	0	0	0	110.4	P5 I6 I104 A105 K110 M111 M112	P5-L108 HydrophobicContact CG-CD2 4.38Å; P5-L108 HydrophobicContact CG-CG 4.09Å; I6-L108 HydrophobicContact CG1-CD2 3.89Å; I104-L108 HydrophobicContact CG2-CD1 4.1Å; I104-L108 PolarHBondContact O-N 2.95Å; A105-L108 WeakPolarHBondContact O-CB 3.43Å; A105-L108 PolarHBondContact O-N 3.36Å; L108-K110 VanDerWaalsContact C-N 3.32Å; L108-K110 PolarHBondContact O-N 3.43Å; L108-M111 WeakPolarHBondContact O-CA 3.1Å; L108-M111 WeakPolarHBondContact O-CB 3.31Å; L108-M111 PolarHBondContact O-N 3.37Å; L108-M112 WeakPolarHBondContact O-CG 3.48Å; L108-M112 PolarHBondContact O-N 3.34Å
109	D	82.7	Confident	78.3	Confident	98 Å²	98	102.6 Å²	102.6	52%	0.524	50%	0.503	S	S	.	.	H	α-helix	trans	-50.6	-52.6	-179.5	-161.8	41.4	0	0	0	111.3	A105 M111 M112 E113	A105-D109 WeakPolarHBondContact O-CB 3.44Å; A105-D109 PolarHBondContact O-N 2.83Å; D109-M111 VanDerWaalsContact C-N 3.32Å; D109-M111 PolarHBondContact O-N 3.26Å; D109-M112 PolarHBondContact O-N 3.5Å; D109-M112 VanDerWaalsContact O-N 3.12Å; D109-E113 WeakPolarHBondContact O-CG 3.18Å; D109-E113 PolarHBondContact O-N 3.14Å
110	K	83.5	Confident	77.8	Confident	143 Å²	143	100.1 Å²	100.1	62%	0.622	50%	0.495	S	S	*	.	H	α-helix	trans	-60.1	-33.9	175.8	-71.9	178.8	-179.5	-167.7	0	115	K106 L108 Y114	K106-K110 VanDerWaalsContact O-CG 3.3Å; K106-K110 WeakPolarHBondContact O-CG 3.48Å; K106-K110 PolarHBondContact O-N 3.4Å; L108-K110 VanDerWaalsContact C-N 3.32Å; L108-K110 PolarHBondContact O-N 3.43Å; K110-Y114 WeakPolarHBondContact O-CB 3.47Å; K110-Y114 PolarHBondContact O-N 3.43Å
111	M	82.1	Confident	77.4	Confident	39 Å²	39	97.9 Å²	97.9	19%	0.192	49%	0.494	C	S	.	.	H	α-helix	trans	-71.3	-39.9	177.3	-75.9	173.7	170.6	0	0	110.8	K107 L108 D109 Y114 E115	K107-M111 HydrophobicContact CD-CE 4.29Å; K107-M111 VanDerWaalsContact CE-CE 3.45Å; K107-M111 HydrophobicContact CG-CE 4.03Å; K107-M111 HydrophobicContact CG-SD 4.39Å; K107-M111 VanDerWaalsContact O-CG 3.29Å; K107-M111 WeakPolarHBondContact O-CG 3.15Å; K107-M111 PolarHBondContact O-N 2.69Å; K107-M111 VanDerWaalsContact O-N 3.14Å; L108-M111 WeakPolarHBondContact O-CA 3.1Å; L108-M111 WeakPolarHBondContact O-CB 3.31Å; L108-M111 PolarHBondContact O-N 3.37Å; D109-M111 VanDerWaalsContact C-N 3.32Å; D109-M111 PolarHBondContact O-N 3.26Å; M111-Y114 PolarHBondContact O-N 3.06Å; M111-E115 WeakPolarHBondContact O-CG 3.19Å; M111-E115 PolarHBondContact O-N 3.21Å
112	M	80.5	Confident	77.2	Confident	105 Å²	105	101.5 Å²	101.5	52%	0.517	51%	0.513	S	S	.	.	H	α-helix	trans	-72.2	-37.1	178.2	-57.2	-53.8	-64.1	0	0	112.1	L108 D109 E115 S116	L108-M112 WeakPolarHBondContact O-CG 3.48Å; L108-M112 PolarHBondContact O-N 3.34Å; D109-M112 PolarHBondContact O-N 3.5Å; D109-M112 VanDerWaalsContact O-N 3.12Å; M112-E115 PolarHBondContact O-N 3.33Å; M112-S116 PolarHBondContact O-N 3.16Å; M112-S116 PolarHBondContact O-OG 2.88Å
113	E	78.1	Confident	76.7	Confident	112 Å²	112	101.4 Å²	101.4	52%	0.523	52%	0.515	S	S	.	.	H	α-helix	trans	-59.9	-45.3	172.3	-74.8	178	160.9	0	0	111.6	D109 E115 S116 S117	D109-E113 WeakPolarHBondContact O-CG 3.18Å; D109-E113 PolarHBondContact O-N 3.14Å; E113-E115 VanDerWaalsContact C-N 3.31Å; E113-E115 PolarHBondContact O-N 2.71Å; E113-S116 PolarHBondContact O-N 2.95Å; E113-S116 VanDerWaalsContact O-N 3.14Å; E113-S117 PolarHBondContact O-N 2.67Å; E113-S117 PolarHBondContact O-OG 3.29Å
114	Y	68.8	Low	76.2	Confident	177 Å²	177	100.4 Å²	100.4	69%	0.694	52%	0.519	S	S	*	.	H	α-helix	trans	-65.4	-32.7	178.5	-178.3	-90.9	0	0	0	112.7	K110 M111 S116	K110-Y114 WeakPolarHBondContact O-CB 3.47Å; K110-Y114 PolarHBondContact O-N 3.43Å; M111-Y114 PolarHBondContact O-N 3.06Å; Y114-S116 VanDerWaalsContact C-N 3.26Å
115	E	65.4	Low	76	Confident	123 Å²	123	106.8 Å²	106.8	58%	0.575	55%	0.552	S	S	*	*	H	α-helix	trans	-75.8	-15.2	176	-72.2	178.6	-178.5	0	0	113	M111 M112 E113	M111-E115 WeakPolarHBondContact O-CG 3.19Å; M111-E115 PolarHBondContact O-N 3.21Å; M112-E115 PolarHBondContact O-N 3.33Å; E113-E115 VanDerWaalsContact C-N 3.31Å; E113-E115 PolarHBondContact O-N 2.71Å
116	S	68.5	Low	75.7	Confident	106 Å²	106	111 Å²	111	74%	0.741	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-8.6	178.5	-55.3	0	0	0	0	114	M112 E113 Y114	M112-S116 PolarHBondContact O-N 3.16Å; M112-S116 PolarHBondContact O-OG 2.88Å; E113-S116 PolarHBondContact O-N 2.95Å; E113-S116 VanDerWaalsContact O-N 3.14Å; Y114-S116 VanDerWaalsContact C-N 3.26Å
117	S	56.5	Low	75	Confident	160 Å²	160	108.5 Å²	108.5	100%	1.119	56%	0.556	S	S	*	*			trans	-100.2	0	-180	-56.4	0	0	0	0	111.9	E113	E113-S117 PolarHBondContact O-N 2.67Å; E113-S117 PolarHBondContact O-OG 3.29Å

Retrieved 117 of 117 residues in 50.5 ms (Link to these results)

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