A0A077YZI8_TRITR Loading...

Protein MIX23

AlphaFold DB , UniProt , Accession A0A077YZI8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 143 aa.

						>A0A077YZI8_TRITR|A0A077YZI8
MTEKQDESTPVVSCDDLLEFAEKIKSMRRIDDKIVYEINTTIPTSSFAKGVNVADRCRKLYEQLKRAHDSRQEIIRRCIEQSQRRVEHLLERRKANVDDNDLLKELRIEQSKLKNFQTELNIEEVIQDQSYKVRERRFRRNQC
					

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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	39.5	Very low	51.1	Low	239 Å²	239	134.6 Å²	134.6	100%	1.177	70%	0.699	S	S	*	*				0	107.6	0	-74.5	168.9	162.9	0	0	106.4	E3	M1-E3 PolarHBondContact O-N 3.38Å; M1-E3 VanDerWaalsContact O-N 3.16Å
2	T	43	Very low	53.8	Low	136 Å²	136	123.8 Å²	123.8	83%	0.834	64%	0.644	S	S	*	*			trans	-77.7	98.7	-178.3	-36	0	0	0	0	107	K4	T2-K4 VanDerWaalsContact C-N 3.26Å; T2-K4 PolarHBondContact O-N 3.26Å
3	E	40.4	Very low	56.6	Low	182 Å²	182	117.2 Å²	117.2	85%	0.85	61%	0.614	S	S	*	*			trans	-61.5	97.9	162.7	-74.3	175.5	149.2	0	0	106.3	M1 Q5	M1-E3 PolarHBondContact O-N 3.38Å; M1-E3 VanDerWaalsContact O-N 3.16Å; E3-Q5 VanDerWaalsContact C-N 3.28Å; E3-Q5 PolarHBondContact O-N 3.25Å
4	K	44.2	Very low	59.2	Low	189 Å²	189	109 Å²	109	82%	0.822	57%	0.572	S	S	*	*			trans	-62.6	101.8	164.2	-71.6	-170.1	177.2	-173.1	0	105	T2 D6	T2-K4 VanDerWaalsContact C-N 3.26Å; T2-K4 PolarHBondContact O-N 3.26Å; K4-D6 PolarHBondContact O-N 3.47Å
5	Q	41.7	Very low	61.3	Low	181 Å²	181	107 Å²	107	85%	0.846	56%	0.562	S	S	*	*			trans	-58.6	99.3	160.2	-71.7	179.9	-28.3	0	0	104.8	E3 E7	E3-Q5 VanDerWaalsContact C-N 3.28Å; E3-Q5 PolarHBondContact O-N 3.25Å; Q5-E7 PolarHBondContact O-N 3.19Å
6	D	44.5	Very low	63.2	Low	133 Å²	133	105.1 Å²	105.1	71%	0.711	55%	0.552	S	S	*	*			trans	-62.7	88.8	168.8	-173	29.4	0	0	0	105.3	K4 S8	K4-D6 PolarHBondContact O-N 3.47Å; D6-S8 PolarHBondContact O-N 3.12Å
7	E	49.3	Very low	64.8	Low	136 Å²	136	102 Å²	102	64%	0.636	54%	0.536	S	S	*	.			trans	-72.9	53.7	171.6	-161.2	166.4	-154.7	0	0	106.9	Q5 T9 R66	Q5-E7 PolarHBondContact O-N 3.19Å; E7-T9 PolarHBondContact O-N 3.31Å; E7-R66 WeakPolarHBondContact OE1-CD 3.49Å; E7-R66 IonicContact OE1-CZ 2.98Å; E7-R66 IonicContact OE1-NE 2.68Å; E7-R66 IonicContact OE1-NH1 2.62Å; E7-R66 PolarHBondContact OE1-NH1 3.32Å
8	S	57.4	Low	66.3	Low	72 Å²	72	102.6 Å²	102.6	50%	0.503	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-72.9	119.6	-176.9	68.2	0	0	0	0	107.8	D6	D6-S8 PolarHBondContact O-N 3.12Å
9	T	61	Low	67.7	Low	31 Å²	31	102.3 Å²	102.3	19%	0.19	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-49.7	126.8	165.7	-1.6	0	0	0	0	108.5	E7 V11 S70 E73 I74	E7-T9 PolarHBondContact O-N 3.31Å; T9-V11 PolarHBondContact O-N 3.24Å; T9-S70 WeakPolarHBondContact CG2-OG 3.46Å; T9-E73 HydrophobicContact CG2-CB 4.28Å; T9-E73 HydrophobicContact CG2-CG 4.38Å; T9-E73 WeakPolarHBondContact CG2-OE2 3.44Å; T9-E73 PolarHBondContact OG1-OE1 3.44Å; T9-I74 HydrophobicContact CG2-CG1 4.31Å
10	P	68.4	Low	69	Low	45 Å²	45	97.5 Å²	97.5	29%	0.292	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-50.3	131.1	-178.3	-27.6	33.3	0	0	0	111.2	V12 M27 I74	P10-V12 HydrophobicContact CB-CG2 4.37Å; P10-V12 WeakPolarHBondContact O-CG2 3.3Å; P10-V12 PolarHBondContact O-N 3.03Å; P10-V12 VanDerWaalsContact O-N 3.11Å; P10-M27 HydrophobicContact CG-CE 4.26Å; P10-I74 HydrophobicContact CB-CD1 4.48Å
11	V	73.1	Confident	70.2	Confident	137 Å²	137	95 Å²	95	83%	0.83	50%	0.503	S	S	*	.			trans	-69.9	112.5	173.8	-176.4	0	0	0	0	107.3	T9	T9-V11 PolarHBondContact O-N 3.24Å
12	V	83.5	Confident	72.8	Confident	5 Å²	5	89.4 Å²	89.4	3%	0.03	47%	0.473	C	S	.	.			trans	-119.5	127.3	177.2	-171.6	0	0	0	0	107.1	P10 F20 K23 I74 R77	P10-V12 HydrophobicContact CB-CG2 4.37Å; P10-V12 WeakPolarHBondContact O-CG2 3.3Å; P10-V12 PolarHBondContact O-N 3.03Å; P10-V12 VanDerWaalsContact O-N 3.11Å; V12-F20 HydrophobicContact CG1-CB 4.36Å; V12-F20 HydrophobicContact CG1-CD2 4Å; V12-K23 HydrophobicContact CB-CG 4.43Å; V12-K23 HydrophobicContact CG1-CB 3.98Å; V12-K23 HydrophobicContact CG1-CG 4.03Å; V12-K23 HydrophobicContact CG2-CB 4.41Å; V12-K23 HydrophobicContact CG2-CG 3.55Å; V12-I74 HydrophobicContact CB-CG2 3.82Å; V12-I74 HydrophobicContact CG1-CG2 4.33Å; V12-I74 HydrophobicContact CG2-CD1 3.83Å; V12-I74 HydrophobicContact CG2-CG1 4.29Å; V12-I74 HydrophobicContact CG2-CG2 3.88Å; V12-R77 PolarHBondContact O-NH2 3.16Å; V12-R77 VanDerWaalsContact O-NH2 3.08Å
13	S	89.2	Confident	75.1	Confident	37 Å²	37	86.9 Å²	86.9	26%	0.259	45%	0.451	S	S	.	.			trans	-64.9	134.8	174.4	-178	0	0	0	0	110.4	D15	S13-D15 PolarHBondContact OG-N 3.31Å
14	C	93.3	Very high	77.7	Confident	3 Å²	3	78.2 Å²	78.2	2%	0.02	41%	0.41	C	S	.	.	S	Bend	trans	-95.9	2.7	171.4	-53.6	0	0	0	0	111.9	C78 Q81 F116	C14-C78 HydrophobicContact CB-CB 3.62Å; C14-C78 WeakPolarHBondContact CB-SG 3.48Å; C14-C78 WeakPolarHBondContact SG-CA 3.4Å; C14-C78 WeakPolarHBondContact SG-CB 3.45Å; C14-C78 CovalentContact SG-SG 2.04Å; C14-C78 PolarHBondContact SG-SG 2.8Å; C14-Q81 PolarHBondContact SG-OE1 2.72Å; C14-Q81 VanDerWaalsContact SG-OE1 3.36Å; C14-F116 HydrophobicContact CB-CZ 4.32Å; C14-F116 WeakPolarHBondContact O-CZ 3.46Å
15	D	90.8	Very high	80	Confident	79 Å²	79	76.6 Å²	76.6	42%	0.422	40%	0.404	S	S	.	.	S	Bend	trans	-87.8	-40.1	-177.2	-66.7	-28.4	0	0	0	112	S13 R85 K112	S13-D15 PolarHBondContact OG-N 3.31Å; D15-R85 IonicContact OD1-CZ 2.91Å; D15-R85 IonicContact OD1-NH1 3.51Å; D15-R85 PolarHBondContact OD1-NH1 3.32Å; D15-R85 IonicContact OD1-NH2 2.65Å; D15-R85 PolarHBondContact OD1-NH2 2.85Å; D15-R85 IonicContact OD2-NH2 3.74Å; D15-K112 WeakPolarHBondContact O-CE 2.99Å; D15-K112 PolarHBondContact O-NZ 3.21Å; D15-K112 VanDerWaalsContact O-NZ 3.09Å
16	D	91.8	Very high	82.4	Confident	76 Å²	76	70.3 Å²	70.3	41%	0.406	38%	0.379	S	S	.	.			trans	-98.9	107.4	177.6	-168.8	-33.9	0	0	0	109.7	L18 E19 F20	D16-L18 VanDerWaalsContact C-N 3.26Å; D16-L18 PolarHBondContact O-N 3.3Å; D16-L18 WeakPolarHBondContact OD1-CA 3.5Å; D16-L18 VanDerWaalsContact OD1-CB 3.31Å; D16-L18 WeakPolarHBondContact OD1-CB 3.38Å; D16-L18 PolarHBondContact OD1-N 3.05Å; D16-E19 HydrophobicContact CB-CB 3.89Å; D16-E19 PolarHBondContact OD1-N 2.93Å; D16-E19 VanDerWaalsContact OD1-N 3.07Å; D16-F20 VanDerWaalsContact O-CB 3.32Å; D16-F20 WeakPolarHBondContact O-CB 3.44Å; D16-F20 PolarHBondContact O-N 2.65Å
17	L	91.3	Very high	84.6	Confident	53 Å²	53	65.5 Å²	65.5	28%	0.277	35%	0.353	S	S	.	.	H	α-helix	trans	-63.8	-32.2	178	-79	177.9	0	0	0	112.7	A21 K112 N115 F116	L17-A21 VanDerWaalsContact O-CB 3.26Å; L17-A21 WeakPolarHBondContact O-CB 3.24Å; L17-A21 PolarHBondContact O-N 2.88Å; L17-K112 HydrophobicContact CD1-CB 4.41Å; L17-K112 HydrophobicContact CD1-CG 3.77Å; L17-K112 HydrophobicContact CD2-CB 4.25Å; L17-K112 HydrophobicContact CD2-CG 4.2Å; L17-K112 HydrophobicContact CG-CB 4.48Å; L17-K112 HydrophobicContact CG-CG 3.89Å; L17-N115 HydrophobicContact CD2-CB 4.1Å; L17-F116 HydrophobicContact CD2-CD1 4.17Å; L17-F116 HydrophobicContact CD2-CE1 3.46Å; L17-F116 VanDerWaalsContact CD2-CE1 3.46Å; L17-F116 HydrophobicContact CD2-CE2 4.37Å; L17-F116 HydrophobicContact CD2-CZ 3.57Å
18	L	91.8	Very high	86.6	Confident	113 Å²	113	60.7 Å²	60.7	59%	0.592	33%	0.329	S	S	*	.	H	α-helix	trans	-71.1	-49.8	-179	179.5	63.1	0	0	0	109.6	D16 F20 A21 E22	D16-L18 VanDerWaalsContact C-N 3.26Å; D16-L18 PolarHBondContact O-N 3.3Å; D16-L18 WeakPolarHBondContact OD1-CA 3.5Å; D16-L18 VanDerWaalsContact OD1-CB 3.31Å; D16-L18 WeakPolarHBondContact OD1-CB 3.38Å; D16-L18 PolarHBondContact OD1-N 3.05Å; L18-F20 VanDerWaalsContact C-N 3.31Å; L18-F20 PolarHBondContact O-N 3.04Å; L18-A21 PolarHBondContact O-N 2.97Å; L18-E22 HydrophobicContact CD1-CG 4.34Å; L18-E22 WeakPolarHBondContact O-CB 3.49Å; L18-E22 WeakPolarHBondContact O-CG 3.3Å; L18-E22 PolarHBondContact O-N 3.29Å
19	E	92.1	Very high	88	Confident	97 Å²	97	65.3 Å²	65.3	45%	0.453	34%	0.335	S	S	.	.	H	α-helix	trans	-58.3	-45.5	176.6	-169.7	-169.2	165.8	0	0	111.1	D16 A21 E22 K23	D16-E19 HydrophobicContact CB-CB 3.89Å; D16-E19 PolarHBondContact OD1-N 2.93Å; D16-E19 VanDerWaalsContact OD1-N 3.07Å; E19-A21 PolarHBondContact O-N 3.05Å; E19-E22 PolarHBondContact O-N 3.48Å; E19-K23 VanDerWaalsContact O-CB 3.29Å; E19-K23 WeakPolarHBondContact O-CB 3.34Å; E19-K23 PolarHBondContact O-N 3.41Å
20	F	94.3	Very high	89.1	Confident	5 Å²	5	67.8 Å²	67.8	2%	0.022	35%	0.347	C	S	.	.	H	α-helix	trans	-56.2	-51.8	175.2	170.5	-92.3	0	0	0	111.9	V12 D16 L18 E22 K23 I24 I74 I75 C78 F116 E119	V12-F20 HydrophobicContact CG1-CB 4.36Å; V12-F20 HydrophobicContact CG1-CD2 4Å; D16-F20 VanDerWaalsContact O-CB 3.32Å; D16-F20 WeakPolarHBondContact O-CB 3.44Å; D16-F20 PolarHBondContact O-N 2.65Å; L18-F20 VanDerWaalsContact C-N 3.31Å; L18-F20 PolarHBondContact O-N 3.04Å; F20-E22 PolarHBondContact O-N 2.97Å; F20-K23 PolarHBondContact O-N 3.4Å; F20-I24 HydrophobicContact CD1-CG1 4.45Å; F20-I24 HydrophobicContact CD2-CG1 4.38Å; F20-I24 HydrophobicContact CE1-CG1 4.1Å; F20-I24 HydrophobicContact CE2-CD1 4.37Å; F20-I24 HydrophobicContact CE2-CG1 4.03Å; F20-I24 HydrophobicContact CZ-CD1 4.45Å; F20-I24 HydrophobicContact CZ-CG1 3.89Å; F20-I24 WeakPolarHBondContact O-CG1 3.41Å; F20-I24 PolarHBondContact O-N 3.22Å; F20-I74 HydrophobicContact CD2-CG2 4.45Å; F20-I74 HydrophobicContact CE2-CG2 4.02Å; F20-I75 HydrophobicContact CE2-CG1 4.45Å; F20-I75 HydrophobicContact CZ-CG1 3.93Å; F20-C78 HydrophobicContact CE2-CB 4.2Å; F20-F116 HydrophobicContact CB-CE1 4.45Å; F20-F116 AromaticContact CD1-CD1 3.97Å; F20-F116 HydrophobicContact CD1-CD1 3.97Å; F20-F116 AromaticContact CD1-CE1 3.69Å; F20-F116 HydrophobicContact CD1-CE1 3.69Å; F20-F116 HydrophobicContact CD2-CD1 4.44Å; F20-F116 AromaticContact CD2-CE1 3.99Å; F20-F116 HydrophobicContact CD2-CE1 3.99Å; F20-F116 AromaticContact CE1-CD1 3.58Å; F20-F116 HydrophobicContact CE1-CD1 3.58Å; F20-F116 AromaticContact CE1-CE1 3.81Å; F20-F116 HydrophobicContact CE1-CE1 3.81Å; F20-F116 HydrophobicContact CE2-CD1 4.08Å; F20-F116 HydrophobicContact CE2-CE1 4.08Å; F20-F116 HydrophobicContact CG-CD1 4.38Å; F20-F116 AromaticContact CG-CE1 3.78Å; F20-F116 HydrophobicContact CG-CE1 3.78Å; F20-F116 AromaticContact CZ-CD1 3.63Å; F20-F116 HydrophobicContact CZ-CD1 3.63Å; F20-F116 AromaticContact CZ-CE1 3.99Å; F20-F116 HydrophobicContact CZ-CE1 3.99Å; F20-E119 HydrophobicContact CE1-CB 4.19Å; F20-E119 HydrophobicContact CE1-CG 3.84Å; F20-E119 HydrophobicContact CZ-CB 4.44Å; F20-E119 HydrophobicContact CZ-CG 4.08Å
21	A	93.7	Very high	89.8	Confident	46 Å²	46	66.2 Å²	66.2	38%	0.38	34%	0.336	S	S	.	.	H	α-helix	trans	-64.3	-42	-177.3	0	0	0	0	0	111.9	L17 L18 E19 K23 I24 K25	L17-A21 VanDerWaalsContact O-CB 3.26Å; L17-A21 WeakPolarHBondContact O-CB 3.24Å; L17-A21 PolarHBondContact O-N 2.88Å; L18-A21 PolarHBondContact O-N 2.97Å; E19-A21 PolarHBondContact O-N 3.05Å; A21-K23 VanDerWaalsContact C-N 3.33Å; A21-K23 PolarHBondContact O-N 3.34Å; A21-I24 PolarHBondContact O-N 3.47Å; A21-K25 VanDerWaalsContact O-CB 3.23Å; A21-K25 WeakPolarHBondContact O-CB 3.44Å; A21-K25 PolarHBondContact O-N 3.21Å
22	E	93.4	Very high	90	Very high	121 Å²	121	65.9 Å²	65.9	57%	0.565	33%	0.33	S	S	*	.	H	α-helix	trans	-62.7	-41.3	175.7	-73.6	-174.7	164.3	0	0	111.7	L18 E19 F20 K25 S26	L18-E22 HydrophobicContact CD1-CG 4.34Å; L18-E22 WeakPolarHBondContact O-CB 3.49Å; L18-E22 WeakPolarHBondContact O-CG 3.3Å; L18-E22 PolarHBondContact O-N 3.29Å; E19-E22 PolarHBondContact O-N 3.48Å; F20-E22 PolarHBondContact O-N 2.97Å; E22-K25 PolarHBondContact O-N 3.16Å; E22-S26 WeakPolarHBondContact O-CB 3.49Å; E22-S26 PolarHBondContact O-N 3.16Å
23	K	92.8	Very high	89.9	Confident	83 Å²	83	71.4 Å²	71.4	36%	0.361	35%	0.353	S	S	.	.	H	α-helix	trans	-65.6	-48.9	178.4	-171.1	62.2	172.8	-168.8	0	111.4	V12 E19 F20 A21 K25 S26 M27	V12-K23 HydrophobicContact CB-CG 4.43Å; V12-K23 HydrophobicContact CG1-CB 3.98Å; V12-K23 HydrophobicContact CG1-CG 4.03Å; V12-K23 HydrophobicContact CG2-CB 4.41Å; V12-K23 HydrophobicContact CG2-CG 3.55Å; E19-K23 VanDerWaalsContact O-CB 3.29Å; E19-K23 WeakPolarHBondContact O-CB 3.34Å; E19-K23 PolarHBondContact O-N 3.41Å; F20-K23 PolarHBondContact O-N 3.4Å; A21-K23 VanDerWaalsContact C-N 3.33Å; A21-K23 PolarHBondContact O-N 3.34Å; K23-K25 VanDerWaalsContact C-N 3.32Å; K23-K25 PolarHBondContact O-N 3.32Å; K23-S26 WeakPolarHBondContact O-CB 3.39Å; K23-S26 PolarHBondContact O-N 3.25Å; K23-S26 VanDerWaalsContact O-N 3.13Å; K23-S26 PolarHBondContact O-OG 3.46Å; K23-M27 HydrophobicContact CG-SD 4.38Å; K23-M27 WeakPolarHBondContact O-CG 3.33Å; K23-M27 PolarHBondContact O-N 3.49Å
24	I	94.1	Very high	89.4	Confident	0 Å²	0	70 Å²	70	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-59.7	-44.1	176.3	-65.8	-63.5	0	0	0	110.8	F20 A21 S26 M27 R28 R71 I74 I75 E119	F20-I24 HydrophobicContact CD1-CG1 4.45Å; F20-I24 HydrophobicContact CD2-CG1 4.38Å; F20-I24 HydrophobicContact CE1-CG1 4.1Å; F20-I24 HydrophobicContact CE2-CD1 4.37Å; F20-I24 HydrophobicContact CE2-CG1 4.03Å; F20-I24 HydrophobicContact CZ-CD1 4.45Å; F20-I24 HydrophobicContact CZ-CG1 3.89Å; F20-I24 WeakPolarHBondContact O-CG1 3.41Å; F20-I24 PolarHBondContact O-N 3.22Å; A21-I24 PolarHBondContact O-N 3.47Å; I24-S26 VanDerWaalsContact C-N 3.33Å; I24-S26 PolarHBondContact O-N 3.36Å; I24-M27 PolarHBondContact O-N 3.17Å; I24-M27 VanDerWaalsContact O-N 3.15Å; I24-R28 WeakPolarHBondContact O-CG 3.26Å; I24-R28 PolarHBondContact O-N 3.45Å; I24-R28 VanDerWaalsContact O-N 3.13Å; I24-R71 HydrophobicContact CD1-CB 4.47Å; I24-R71 HydrophobicContact CD1-CG 4.42Å; I24-I74 HydrophobicContact CD1-CG2 4.09Å; I24-I75 HydrophobicContact CD1-CD1 4.47Å; I24-I75 HydrophobicContact CD1-CG1 4.08Å; I24-E119 HydrophobicContact CG2-CG 4.32Å; I24-E119 WeakPolarHBondContact CG2-OE1 3.25Å
25	K	92.3	Very high	88.3	Confident	156 Å²	156	73.5 Å²	73.5	68%	0.678	36%	0.364	S	S	*	.	H	α-helix	trans	-59.5	-41.7	175	-172.7	-178.9	-178.8	179.8	0	112.2	A21 E22 K23 M27 R28	A21-K25 VanDerWaalsContact O-CB 3.23Å; A21-K25 WeakPolarHBondContact O-CB 3.44Å; A21-K25 PolarHBondContact O-N 3.21Å; E22-K25 PolarHBondContact O-N 3.16Å; K23-K25 VanDerWaalsContact C-N 3.32Å; K23-K25 PolarHBondContact O-N 3.32Å; K25-M27 VanDerWaalsContact C-N 3.29Å; K25-M27 PolarHBondContact O-N 3.01Å; K25-R28 PolarHBondContact O-N 2.89Å
26	S	91.8	Very high	87.6	Confident	48 Å²	48	76.9 Å²	76.9	34%	0.336	37%	0.371	S	S	.	.	H	α-helix	trans	-63.9	-36.1	177.3	79.8	0	0	0	0	112.4	E22 K23 I24 R28 R29	E22-S26 WeakPolarHBondContact O-CB 3.49Å; E22-S26 PolarHBondContact O-N 3.16Å; K23-S26 WeakPolarHBondContact O-CB 3.39Å; K23-S26 PolarHBondContact O-N 3.25Å; K23-S26 VanDerWaalsContact O-N 3.13Å; K23-S26 PolarHBondContact O-OG 3.46Å; I24-S26 VanDerWaalsContact C-N 3.33Å; I24-S26 PolarHBondContact O-N 3.36Å; S26-R28 VanDerWaalsContact C-N 3.31Å; S26-R28 PolarHBondContact O-N 3.47Å; S26-R29 WeakPolarHBondContact O-CB 3.37Å; S26-R29 WeakPolarHBondContact O-CD 3.43Å; S26-R29 VanDerWaalsContact O-CG 3.25Å; S26-R29 WeakPolarHBondContact O-CG 3.39Å; S26-R29 PolarHBondContact O-N 2.91Å
27	M	91	Very high	86.7	Confident	32 Å²	32	76.6 Å²	76.6	16%	0.158	37%	0.368	C	S	.	.	H	α-helix	trans	-72.2	-24	178.5	-67.4	173.6	73.4	0	0	112.7	P10 K23 I24 K25 R29 R71 I74	P10-M27 HydrophobicContact CG-CE 4.26Å; K23-M27 HydrophobicContact CG-SD 4.38Å; K23-M27 WeakPolarHBondContact O-CG 3.33Å; K23-M27 PolarHBondContact O-N 3.49Å; I24-M27 PolarHBondContact O-N 3.17Å; I24-M27 VanDerWaalsContact O-N 3.15Å; K25-M27 VanDerWaalsContact C-N 3.29Å; K25-M27 PolarHBondContact O-N 3.01Å; M27-R29 PolarHBondContact O-N 3.39Å; M27-R71 HydrophobicContact CB-CG 3.99Å; M27-R71 HydrophobicContact CE-CG 3.57Å; M27-R71 PolarHBondContact O-NH1 3.39Å; M27-R71 VanDerWaalsContact O-NH1 3.14Å; M27-R71 HydrophobicContact SD-CG 4.1Å; M27-I74 HydrophobicContact CE-CD1 3.81Å; M27-I74 HydrophobicContact SD-CD1 3.93Å
28	R	91.5	Very high	85.8	Confident	35 Å²	35	74.3 Å²	74.3	13%	0.132	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-4.9	176.3	-73.9	173.9	176	153.5	4.2	114.7	I24 K25 S26 I30 D31 D32 E119 E123 I126	I24-R28 WeakPolarHBondContact O-CG 3.26Å; I24-R28 PolarHBondContact O-N 3.45Å; I24-R28 VanDerWaalsContact O-N 3.13Å; K25-R28 PolarHBondContact O-N 2.89Å; S26-R28 VanDerWaalsContact C-N 3.31Å; S26-R28 PolarHBondContact O-N 3.47Å; R28-I30 PolarHBondContact O-N 3.26Å; R28-I30 VanDerWaalsContact O-N 3.09Å; R28-D31 WeakPolarHBondContact O-CB 3.32Å; R28-D31 PolarHBondContact O-N 2.65Å; R28-D32 PolarHBondContact O-N 2.91Å; R28-D32 VanDerWaalsContact O-N 3.1Å; R28-E119 IonicContact CZ-OE1 3.76Å; R28-E119 IonicContact NH1-OE1 2.75Å; R28-E119 PolarHBondContact NH1-OE1 3.47Å; R28-E119 IonicContact NH2-OE1 3.3Å; R28-E119 PolarHBondContact NH2-OE1 2.88Å; R28-E123 IonicContact NE-OE2 3.95Å; R28-E123 IonicContact NH2-OE2 3.46Å; R28-I126 HydrophobicContact CG-CD1 4.42Å
29	R	87.4	Confident	84.7	Confident	169 Å²	169	73 Å²	73	64%	0.638	35%	0.35	S	S	*	.	H	α-helix	trans	-57.1	-26.3	175.2	-72.2	177	178.1	-178.4	1.7	113.4	S26 M27 K33	S26-R29 WeakPolarHBondContact O-CB 3.37Å; S26-R29 WeakPolarHBondContact O-CD 3.43Å; S26-R29 VanDerWaalsContact O-CG 3.25Å; S26-R29 WeakPolarHBondContact O-CG 3.39Å; S26-R29 PolarHBondContact O-N 2.91Å; M27-R29 PolarHBondContact O-N 3.39Å; R29-K33 VanDerWaalsContact O-CG 3.32Å; R29-K33 WeakPolarHBondContact O-CG 3.36Å; R29-K33 PolarHBondContact O-N 3.03Å
30	I	82.8	Confident	83.7	Confident	84 Å²	84	71.7 Å²	71.7	43%	0.431	35%	0.348	S	S	.	.	H	α-helix	trans	-66.3	-43.7	173.8	-74.2	173.8	0	0	0	110.5	R28 K33 I34 L64 A67	R28-I30 PolarHBondContact O-N 3.26Å; R28-I30 VanDerWaalsContact O-N 3.09Å; I30-K33 CarbonylContact O-C 3.55Å; I30-K33 PolarHBondContact O-N 2.89Å; I30-I34 PolarHBondContact O-N 3.1Å; I30-L64 HydrophobicContact CG2-CD1 4.43Å; I30-A67 HydrophobicContact CD1-CB 4.12Å; I30-A67 HydrophobicContact CG2-CB 4.46Å
31	D	83.2	Confident	82.4	Confident	12 Å²	12	73 Å²	73	6%	0.064	36%	0.357	C	S	.	.	H	α-helix	trans	-67.1	-42.2	178.8	-61.7	-90.5	0	0	0	111.5	R28 K33 I34 H68 R71 I126 S130	R28-D31 WeakPolarHBondContact O-CB 3.32Å; R28-D31 PolarHBondContact O-N 2.65Å; D31-K33 PolarHBondContact O-N 2.93Å; D31-I34 WeakPolarHBondContact O-CB 3.39Å; D31-I34 WeakPolarHBondContact O-CG2 3.27Å; D31-I34 PolarHBondContact O-N 3.41Å; D31-H68 IonicContact OD1-CE1 2.75Å; D31-H68 PolarHBondContact OD1-CE1 3.08Å; D31-H68 IonicContact OD1-NE2 3.72Å; D31-H68 PolarHBondContact OD1-NE2 3.07Å; D31-R71 IonicContact OD1-NH2 3.89Å; D31-R71 IonicContact OD2-CZ 3.04Å; D31-R71 IonicContact OD2-NH1 3.14Å; D31-R71 PolarHBondContact OD2-NH1 2.64Å; D31-R71 IonicContact OD2-NH2 2.64Å; D31-R71 PolarHBondContact OD2-NH2 2.86Å; D31-I126 HydrophobicContact CB-CG2 4Å; D31-S130 PolarHBondContact OD1-OG 3.15Å
32	D	78.7	Confident	81.1	Confident	130 Å²	130	71 Å²	71	70%	0.695	34%	0.34	S	S	*	.	H	α-helix	trans	-59.1	-34	176	-65.5	-27.6	0	0	0	112	R28	R28-D32 PolarHBondContact O-N 2.91Å; R28-D32 VanDerWaalsContact O-N 3.1Å
33	K	81	Confident	79.8	Confident	120 Å²	120	66.4 Å²	66.4	52%	0.522	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-4.7	179.9	-67.3	-179.6	-179	-173.1	0	113.1	R29 I30 D31 V35 Y36 E37	R29-K33 VanDerWaalsContact O-CG 3.32Å; R29-K33 WeakPolarHBondContact O-CG 3.36Å; R29-K33 PolarHBondContact O-N 3.03Å; I30-K33 CarbonylContact O-C 3.55Å; I30-K33 PolarHBondContact O-N 2.89Å; D31-K33 PolarHBondContact O-N 2.93Å; K33-V35 VanDerWaalsContact C-N 3.25Å; K33-V35 PolarHBondContact O-N 3.46Å; K33-V35 VanDerWaalsContact O-N 3.16Å; K33-Y36 CarbonylContact O-C 3.6Å; K33-Y36 WeakPolarHBondContact O-CA 3.27Å; K33-Y36 WeakPolarHBondContact O-CB 3.48Å; K33-Y36 PolarHBondContact O-N 2.96Å; K33-E37 HydrophobicContact CB-CG 4.26Å; K33-E37 WeakPolarHBondContact O-CG 3.47Å; K33-E37 PolarHBondContact O-N 3.29Å
34	I	78.4	Confident	78.6	Confident	8 Å²	8	65.5 Å²	65.5	4%	0.041	32%	0.321	C	S	.	.	H	α-helix	trans	-58.3	-38.9	-171.5	-162.9	56	0	0	0	112.1	I30 D31 E37 I38 L60 L64	I30-I34 PolarHBondContact O-N 3.1Å; D31-I34 WeakPolarHBondContact O-CB 3.39Å; D31-I34 WeakPolarHBondContact O-CG2 3.27Å; D31-I34 PolarHBondContact O-N 3.41Å; I34-E37 PolarHBondContact O-N 3.4Å; I34-I38 HydrophobicContact CD1-CD1 4.43Å; I34-I38 HydrophobicContact CD1-CG1 4.46Å; I34-I38 HydrophobicContact CG1-CD1 3.93Å; I34-I38 HydrophobicContact CG1-CG1 4.39Å; I34-I38 WeakPolarHBondContact O-CB 3.37Å; I34-I38 WeakPolarHBondContact O-CG1 3.45Å; I34-I38 PolarHBondContact O-N 3.38Å; I34-L60 HydrophobicContact CD1-CD1 3.97Å; I34-L60 HydrophobicContact CD1-CD2 4.41Å; I34-L60 HydrophobicContact CD1-CG 4.22Å; I34-L64 HydrophobicContact CD1-CD1 4.12Å; I34-L64 HydrophobicContact CD1-CD2 4.26Å; I34-L64 HydrophobicContact CG1-CD1 4.43Å; I34-L64 HydrophobicContact CG1-CD2 4.47Å
35	V	70.5	Confident	77	Confident	76 Å²	76	70.5 Å²	70.5	46%	0.461	36%	0.356	S	S	.	.	H	α-helix	trans	-65.3	-42.8	177.9	176.9	0	0	0	0	110.8	K33 N39 V133	K33-V35 VanDerWaalsContact C-N 3.25Å; K33-V35 PolarHBondContact O-N 3.46Å; K33-V35 VanDerWaalsContact O-N 3.16Å; V35-N39 WeakPolarHBondContact O-CB 3.47Å; V35-N39 PolarHBondContact O-N 3.25Å; V35-N39 PolarHBondContact O-ND2 2.81Å; V35-V133 HydrophobicContact CG2-CG1 4.21Å
36	Y	75.5	Confident	75.7	Confident	150 Å²	150	67 Å²	67	59%	0.588	35%	0.351	S	S	*	.	H	α-helix	trans	-64.4	-52	176.8	177.4	-96.4	0	0	0	110.5	K33 I38 N39 T40	K33-Y36 CarbonylContact O-C 3.6Å; K33-Y36 WeakPolarHBondContact O-CA 3.27Å; K33-Y36 WeakPolarHBondContact O-CB 3.48Å; K33-Y36 PolarHBondContact O-N 2.96Å; Y36-I38 VanDerWaalsContact C-N 3.29Å; Y36-I38 PolarHBondContact O-N 3.28Å; Y36-N39 PolarHBondContact O-N 3.16Å; Y36-T40 HydrophobicContact CD1-CG2 4.18Å; Y36-T40 HydrophobicContact CD2-CG2 4.09Å; Y36-T40 HydrophobicContact CE1-CG2 3.76Å; Y36-T40 HydrophobicContact CE2-CG2 3.67Å; Y36-T40 HydrophobicContact CG-CG2 4.34Å; Y36-T40 VanDerWaalsContact CZ-CG2 3.49Å; Y36-T40 WeakPolarHBondContact O-CG2 3.37Å; Y36-T40 PolarHBondContact O-N 3.38Å; Y36-T40 PolarHBondContact O-OG1 3.1Å
37	E	73.1	Confident	74.5	Confident	71 Å²	71	72 Å²	72	33%	0.332	37%	0.368	S	S	.	.	H	α-helix	trans	-57.4	-41.9	178.5	-68.3	-59.5	154.8	0	0	111.6	K33 I34 N39 T40 T41 L60	K33-E37 HydrophobicContact CB-CG 4.26Å; K33-E37 WeakPolarHBondContact O-CG 3.47Å; K33-E37 PolarHBondContact O-N 3.29Å; I34-E37 PolarHBondContact O-N 3.4Å; E37-N39 PolarHBondContact O-N 3.37Å; E37-T40 PolarHBondContact O-OG1 2.89Å; E37-T41 WeakPolarHBondContact O-CA 3.38Å; E37-T41 WeakPolarHBondContact O-CB 3.31Å; E37-T41 PolarHBondContact O-N 2.8Å; E37-T41 PolarHBondContact O-OG1 3.48Å; E37-L60 HydrophobicContact CB-CD1 4.1Å
38	I	72.2	Confident	73.2	Confident	4 Å²	4	71.7 Å²	71.7	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-60.5	-44.8	174.2	-79	173.9	0	0	0	111.4	I34 Y36 I42 L60 V133 R134 R137	I34-I38 HydrophobicContact CD1-CD1 4.43Å; I34-I38 HydrophobicContact CD1-CG1 4.46Å; I34-I38 HydrophobicContact CG1-CD1 3.93Å; I34-I38 HydrophobicContact CG1-CG1 4.39Å; I34-I38 WeakPolarHBondContact O-CB 3.37Å; I34-I38 WeakPolarHBondContact O-CG1 3.45Å; I34-I38 PolarHBondContact O-N 3.38Å; Y36-I38 VanDerWaalsContact C-N 3.29Å; Y36-I38 PolarHBondContact O-N 3.28Å; I38-I42 HydrophobicContact CG2-CD1 4.32Å; I38-I42 WeakPolarHBondContact O-CB 3.33Å; I38-I42 PolarHBondContact O-N 2.87Å; I38-L60 HydrophobicContact CG1-CD2 3.53Å; I38-V133 HydrophobicContact CD1-CG1 3.74Å; I38-R134 HydrophobicContact CD1-CB 4.49Å; I38-R137 HydrophobicContact CG2-CB 3.89Å; I38-R137 VanDerWaalsContact CG2-CD 3.48Å; I38-R137 HydrophobicContact CG2-CG 3.47Å; I38-R137 VanDerWaalsContact CG2-CG 3.47Å
39	N	68.7	Low	72	Confident	87 Å²	87	79.3 Å²	79.3	47%	0.465	40%	0.404	S	S	.	.	H	α-helix	trans	-73.6	-32.4	-176.1	-73.2	-30.1	0	0	0	112.8	V35 Y36 E37	V35-N39 WeakPolarHBondContact O-CB 3.47Å; V35-N39 PolarHBondContact O-N 3.25Å; V35-N39 PolarHBondContact O-ND2 2.81Å; Y36-N39 PolarHBondContact O-N 3.16Å; E37-N39 PolarHBondContact O-N 3.37Å
40	T	71.1	Confident	71.1	Confident	69 Å²	69	75.6 Å²	75.6	42%	0.423	42%	0.418	S	S	.	.	H	α-helix	trans	-87	-35.6	179.3	55.9	0	0	0	0	112.8	Y36 E37	Y36-T40 HydrophobicContact CD1-CG2 4.18Å; Y36-T40 HydrophobicContact CD2-CG2 4.09Å; Y36-T40 HydrophobicContact CE1-CG2 3.76Å; Y36-T40 HydrophobicContact CE2-CG2 3.67Å; Y36-T40 HydrophobicContact CG-CG2 4.34Å; Y36-T40 VanDerWaalsContact CZ-CG2 3.49Å; Y36-T40 WeakPolarHBondContact O-CG2 3.37Å; Y36-T40 PolarHBondContact O-N 3.38Å; Y36-T40 PolarHBondContact O-OG1 3.1Å; E37-T40 PolarHBondContact O-OG1 2.89Å
41	T	67.4	Low	70.6	Confident	33 Å²	33	73.4 Å²	73.4	20%	0.202	41%	0.409	C	S	.	.	H	α-helix	trans	-81.8	-34.1	-175	-58	0	0	0	0	112.1	E37 P43 R56	E37-T41 WeakPolarHBondContact O-CA 3.38Å; E37-T41 WeakPolarHBondContact O-CB 3.31Å; E37-T41 PolarHBondContact O-N 2.8Å; E37-T41 PolarHBondContact O-OG1 3.48Å; T41-P43 WeakPolarHBondContact O-CD 3.21Å; T41-R56 HydrophobicContact CG2-CB 3.94Å; T41-R56 HydrophobicContact CG2-CG 4.28Å; T41-R56 WeakPolarHBondContact O-CD 3.05Å; T41-R56 PolarHBondContact O-NH1 2.95Å
42	I	66.8	Low	70.3	Confident	4 Å²	4	77.9 Å²	77.9	2%	0.021	43%	0.433	C	S	.	.	S	Bend	trans	-104.2	90.1	-179.9	-55.7	163.4	0	0	0	108.5	I38 V53 C57 R137 N141	I38-I42 HydrophobicContact CG2-CD1 4.32Å; I38-I42 WeakPolarHBondContact O-CB 3.33Å; I38-I42 PolarHBondContact O-N 2.87Å; I42-V53 HydrophobicContact CG2-CG1 4.01Å; I42-C57 WeakPolarHBondContact CD1-SG 3.44Å; I42-R137 HydrophobicContact CD1-CG 3.97Å; I42-R137 PolarHBondContact O-NH2 3.16Å; I42-N141 HydrophobicContact CG2-CB 3.84Å
43	P	66.3	Low	70.2	Confident	24 Å²	24	72.6 Å²	72.6	16%	0.156	41%	0.405	C	S	.	.			trans	-55.8	145.2	173.9	22.5	-31.5	0	0	0	109.5	T41 F47 A48 V51 V53	T41-P43 WeakPolarHBondContact O-CD 3.21Å; P43-F47 HydrophobicContact CB-CB 3.85Å; P43-A48 HydrophobicContact CG-CB 4.34Å; P43-V51 HydrophobicContact CG-CB 4.34Å; P43-V51 HydrophobicContact CG-CG1 4.2Å; P43-V53 HydrophobicContact CG-CG2 4.35Å
44	T	65.9	Low	70.1	Confident	63 Å²	63	69.5 Å²	69.5	39%	0.387	40%	0.402	S	S	.	.			trans	-58.2	150.3	168	43.6	0	0	0	0	109.1	S46 F47 A48	T44-S46 PolarHBondContact O-N 2.9Å; T44-F47 PolarHBondContact O-N 3.21Å; T44-F47 WeakPolarHBondContact OG1-CD2 3.34Å; T44-A48 PolarHBondContact O-N 3.42Å
45	S	62.4	Low	70.3	Confident	105 Å²	105	70.9 Å²	70.9	73%	0.734	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-45.9	-31.6	-172.4	49.4	0	0	0	0	114.9
46	S	64.9	Low	70.8	Confident	82 Å²	82	71.8 Å²	71.8	57%	0.573	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-67.1	-29.6	176	45.8	0	0	0	0	115.1	T44	T44-S46 PolarHBondContact O-N 2.9Å
47	F	65.8	Low	71	Confident	155 Å²	155	65.3 Å²	65.3	68%	0.68	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-101.3	0.3	-179.3	-65.4	-80.3	0	0	0	113.6	P43 T44 K49	P43-F47 HydrophobicContact CB-CB 3.85Å; T44-F47 PolarHBondContact O-N 3.21Å; T44-F47 WeakPolarHBondContact OG1-CD2 3.34Å; F47-K49 PolarHBondContact O-N 3.17Å; F47-K49 VanDerWaalsContact O-N 3.09Å
48	A	63.8	Low	71.6	Confident	24 Å²	24	68.5 Å²	68.5	20%	0.198	39%	0.39	C	S	.	.			trans	-71.3	0.6	-177.2	0	0	0	0	0	114.5	P43 T44 G50 V51 V53	P43-A48 HydrophobicContact CG-CB 4.34Å; T44-A48 PolarHBondContact O-N 3.42Å; A48-G50 PolarHBondContact O-N 2.98Å; A48-V51 PolarHBondContact O-N 3.42Å; A48-V53 HydrophobicContact CB-CG2 3.78Å
49	K	65.7	Low	72.2	Confident	196 Å²	196	73.3 Å²	73.3	85%	0.852	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	114.6	179	-76.6	-174.4	177.8	-179.6	0	110.4	F47	F47-K49 PolarHBondContact O-N 3.17Å; F47-K49 VanDerWaalsContact O-N 3.09Å
50	G	68.4	Low	72.9	Confident	91 Å²	91	69.9 Å²	69.9	94%	0.938	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	0.9	-179.9	0	0	0	0	0	115.3	A48	A48-G50 PolarHBondContact O-N 2.98Å
51	V	71.8	Confident	73.6	Confident	38 Å²	38	70.4 Å²	70.4	23%	0.23	39%	0.387	C	S	.	.			trans	-108.7	122.3	178.1	176.5	0	0	0	0	110	P43 A48 V53 R56	P43-V51 HydrophobicContact CG-CB 4.34Å; P43-V51 HydrophobicContact CG-CG1 4.2Å; A48-V51 PolarHBondContact O-N 3.42Å; V51-V53 VanDerWaalsContact C-N 3.32Å; V51-V53 HydrophobicContact CG1-CG2 4.28Å; V51-V53 PolarHBondContact O-N 3.47Å; V51-R56 HydrophobicContact CG1-CG 4.42Å; V51-R56 VanDerWaalsContact CG1-NE 3.31Å
52	N	77.2	Confident	74.7	Confident	106 Å²	106	72.5 Å²	72.5	57%	0.567	40%	0.395	S	S	*	.			trans	-75.1	89.3	169.1	-170.5	-26.1	0	0	0	109.5	A54 D55 R56	N52-A54 VanDerWaalsContact C-N 3.3Å; N52-A54 PolarHBondContact O-N 3.02Å; N52-A54 PolarHBondContact OD1-N 2.62Å; N52-D55 HydrophobicContact CB-CB 3.99Å; N52-D55 PolarHBondContact O-N 2.04Å; N52-D55 PolarHBondContact OD1-N 3.43Å; N52-R56 PolarHBondContact O-N 2.96Å; N52-R56 VanDerWaalsContact O-N 3.13Å
53	V	77	Confident	75.7	Confident	19 Å²	19	78.1 Å²	78.1	12%	0.115	42%	0.42	C	S	.	.	H	α-helix	trans	-59.2	-40.6	-178.2	168.9	0	0	0	0	111.4	I42 P43 A48 V51 R56 C57 C143	I42-V53 HydrophobicContact CG2-CG1 4.01Å; P43-V53 HydrophobicContact CG-CG2 4.35Å; A48-V53 HydrophobicContact CB-CG2 3.78Å; V51-V53 VanDerWaalsContact C-N 3.32Å; V51-V53 HydrophobicContact CG1-CG2 4.28Å; V51-V53 PolarHBondContact O-N 3.47Å; V53-R56 PolarHBondContact O-N 3.49Å; V53-C57 WeakPolarHBondContact O-CB 3.24Å; V53-C57 PolarHBondContact O-N 2.91Å; V53-C143 WeakPolarHBondContact CG1-SG 3.31Å
54	A	79.2	Confident	76.8	Confident	55 Å²	55	77 Å²	77	46%	0.455	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-45.2	177.9	0	0	0	0	0	112.5	N52 R56 C57 R58	N52-A54 VanDerWaalsContact C-N 3.3Å; N52-A54 PolarHBondContact O-N 3.02Å; N52-A54 PolarHBondContact OD1-N 2.62Å; A54-R56 VanDerWaalsContact C-N 3.34Å; A54-R56 PolarHBondContact O-N 3.36Å; A54-C57 PolarHBondContact O-N 3.43Å; A54-R58 WeakPolarHBondContact O-CB 3.3Å; A54-R58 PolarHBondContact O-N 3.19Å
55	D	82.2	Confident	78.1	Confident	36 Å²	36	78 Å²	78	19%	0.193	41%	0.413	C	S	.	.	H	α-helix	trans	-61.6	-42.4	176.7	-179.7	61.7	0	0	0	111.8	N52 R58 K59	N52-D55 HydrophobicContact CB-CB 3.99Å; N52-D55 PolarHBondContact O-N 2.04Å; N52-D55 PolarHBondContact OD1-N 3.43Å; D55-R58 PolarHBondContact O-N 3.09Å; D55-R58 IonicContact OD1-CZ 2.84Å; D55-R58 IonicContact OD1-NE 3.79Å; D55-R58 IonicContact OD1-NH2 2.76Å; D55-R58 PolarHBondContact OD1-NH2 3.18Å; D55-K59 WeakPolarHBondContact O-CG 3.39Å; D55-K59 PolarHBondContact O-N 3.07Å; D55-K59 IonicContact OD1-NZ 2.72Å; D55-K59 VanDerWaalsContact OD2-CE 3.27Å; D55-K59 WeakPolarHBondContact OD2-CE 3.24Å; D55-K59 IonicContact OD2-NZ 3.55Å; D55-K59 PolarHBondContact OD2-NZ 2.86Å
56	R	80.6	Confident	79.5	Confident	96 Å²	96	79.3 Å²	79.3	36%	0.362	40%	0.401	S	S	.	.	H	α-helix	trans	-64.6	-43.8	176.4	-73.4	-168.5	178.6	-174.3	3	112.5	T41 V51 N52 V53 A54 R58 K59 L60	T41-R56 HydrophobicContact CG2-CB 3.94Å; T41-R56 HydrophobicContact CG2-CG 4.28Å; T41-R56 WeakPolarHBondContact O-CD 3.05Å; T41-R56 PolarHBondContact O-NH1 2.95Å; V51-R56 HydrophobicContact CG1-CG 4.42Å; V51-R56 VanDerWaalsContact CG1-NE 3.31Å; N52-R56 PolarHBondContact O-N 2.96Å; N52-R56 VanDerWaalsContact O-N 3.13Å; V53-R56 PolarHBondContact O-N 3.49Å; A54-R56 VanDerWaalsContact C-N 3.34Å; A54-R56 PolarHBondContact O-N 3.36Å; R56-R58 VanDerWaalsContact C-N 3.33Å; R56-R58 PolarHBondContact O-N 2.92Å; R56-K59 PolarHBondContact O-N 3.45Å; R56-L60 WeakPolarHBondContact O-CB 3.07Å; R56-L60 PolarHBondContact O-N 3.48Å
57	C	81.5	Confident	80.8	Confident	14 Å²	14	76 Å²	76	10%	0.095	38%	0.379	C	S	.	.	H	α-helix	trans	-58.7	-44.8	174.7	-93.7	0	0	0	0	112	I42 V53 A54 L60 Y61 C143	I42-C57 WeakPolarHBondContact CD1-SG 3.44Å; V53-C57 WeakPolarHBondContact O-CB 3.24Å; V53-C57 PolarHBondContact O-N 2.91Å; A54-C57 PolarHBondContact O-N 3.43Å; C57-L60 PolarHBondContact O-N 3.04Å; C57-Y61 WeakPolarHBondContact O-CB 3.45Å; C57-Y61 PolarHBondContact O-N 2.96Å; C57-C143 HydrophobicContact CB-CB 3.63Å; C57-C143 WeakPolarHBondContact CB-SG 3.36Å; C57-C143 WeakPolarHBondContact SG-CB 3.32Å; C57-C143 CovalentContact SG-SG 2.02Å; C57-C143 PolarHBondContact SG-SG 3.09Å
58	R	84.5	Confident	82.2	Confident	137 Å²	137	68.6 Å²	68.6	52%	0.517	35%	0.347	S	S	.	.	H	α-helix	trans	-60.5	-49.1	175.9	175.9	176.9	57.1	-154.2	-1.2	111.5	A54 D55 R56 L60 Y61 E62	A54-R58 WeakPolarHBondContact O-CB 3.3Å; A54-R58 PolarHBondContact O-N 3.19Å; D55-R58 PolarHBondContact O-N 3.09Å; D55-R58 IonicContact OD1-CZ 2.84Å; D55-R58 IonicContact OD1-NE 3.79Å; D55-R58 IonicContact OD1-NH2 2.76Å; D55-R58 PolarHBondContact OD1-NH2 3.18Å; R56-R58 VanDerWaalsContact C-N 3.33Å; R56-R58 PolarHBondContact O-N 2.92Å; R58-L60 PolarHBondContact O-N 3.32Å; R58-Y61 WeakPolarHBondContact O-CB 3.46Å; R58-Y61 PolarHBondContact O-N 3.4Å; R58-Y61 VanDerWaalsContact O-N 3.16Å; R58-E62 HydrophobicContact CG-CG 4.45Å; R58-E62 VanDerWaalsContact CG-OE1 3.28Å; R58-E62 WeakPolarHBondContact CG-OE1 3.45Å; R58-E62 WeakPolarHBondContact O-CG 3.24Å; R58-E62 PolarHBondContact O-N 3.45Å
59	K	85.1	Confident	83.7	Confident	106 Å²	106	70.4 Å²	70.4	46%	0.461	35%	0.353	S	S	.	.	H	α-helix	trans	-59.6	-44.6	178.8	-76.3	171.4	174.3	162.9	0	112.5	D55 R56 Y61 E62 Q63	D55-K59 WeakPolarHBondContact O-CG 3.39Å; D55-K59 PolarHBondContact O-N 3.07Å; D55-K59 IonicContact OD1-NZ 2.72Å; D55-K59 VanDerWaalsContact OD2-CE 3.27Å; D55-K59 WeakPolarHBondContact OD2-CE 3.24Å; D55-K59 IonicContact OD2-NZ 3.55Å; D55-K59 PolarHBondContact OD2-NZ 2.86Å; R56-K59 PolarHBondContact O-N 3.45Å; K59-Y61 VanDerWaalsContact C-N 3.3Å; K59-Y61 PolarHBondContact O-N 3.4Å; K59-E62 PolarHBondContact O-N 3.35Å; K59-Q63 VanDerWaalsContact O-CG 3.31Å; K59-Q63 WeakPolarHBondContact O-CG 3.35Å; K59-Q63 PolarHBondContact O-N 2.99Å
60	L	83.2	Confident	85	Confident	14 Å²	14	62.2 Å²	62.2	7%	0.073	32%	0.32	C	S	.	.	H	α-helix	trans	-61.7	-41.5	176.4	-176.4	64.4	0	0	0	111.4	I34 E37 I38 R56 C57 R58 Q63 L64	I34-L60 HydrophobicContact CD1-CD1 3.97Å; I34-L60 HydrophobicContact CD1-CD2 4.41Å; I34-L60 HydrophobicContact CD1-CG 4.22Å; E37-L60 HydrophobicContact CB-CD1 4.1Å; I38-L60 HydrophobicContact CG1-CD2 3.53Å; R56-L60 WeakPolarHBondContact O-CB 3.07Å; R56-L60 PolarHBondContact O-N 3.48Å; C57-L60 PolarHBondContact O-N 3.04Å; R58-L60 PolarHBondContact O-N 3.32Å; L60-Q63 PolarHBondContact O-N 3.27Å; L60-L64 WeakPolarHBondContact O-CB 3.42Å; L60-L64 PolarHBondContact O-N 2.94Å
61	Y	85.7	Confident	86.3	Confident	80 Å²	80	57.9 Å²	57.9	31%	0.314	28%	0.275	S	S	.	.	H	α-helix	trans	-64.2	-45	175.7	172.8	-117.5	0	0	0	112.4	C57 R58 K59 Q63 L64 K65 Y131	C57-Y61 WeakPolarHBondContact O-CB 3.45Å; C57-Y61 PolarHBondContact O-N 2.96Å; R58-Y61 WeakPolarHBondContact O-CB 3.46Å; R58-Y61 PolarHBondContact O-N 3.4Å; R58-Y61 VanDerWaalsContact O-N 3.16Å; K59-Y61 VanDerWaalsContact C-N 3.3Å; K59-Y61 PolarHBondContact O-N 3.4Å; Y61-Q63 VanDerWaalsContact C-N 3.31Å; Y61-Q63 PolarHBondContact O-N 3.43Å; Y61-L64 PolarHBondContact O-N 2.78Å; Y61-K65 HydrophobicContact CE1-CD 4.34Å; Y61-K65 HydrophobicContact CE2-CB 4.31Å; Y61-K65 VanDerWaalsContact O-CB 3.27Å; Y61-K65 WeakPolarHBondContact O-CB 3.36Å; Y61-K65 PolarHBondContact O-N 3.19Å; Y61-Y131 HydrophobicContact CD2-CE1 4.19Å; Y61-Y131 HydrophobicContact CE2-CD1 4.35Å; Y61-Y131 AromaticContact CE2-CE1 3.75Å; Y61-Y131 HydrophobicContact CE2-CE1 3.75Å
62	E	90	Very high	87.4	Confident	78 Å²	78	56.7 Å²	56.7	36%	0.364	27%	0.268	S	S	.	.	H	α-helix	trans	-60.3	-42.5	177.4	-73.8	172.5	-168.3	0	0	111.4	R58 K59 K65 R66	R58-E62 HydrophobicContact CG-CG 4.45Å; R58-E62 VanDerWaalsContact CG-OE1 3.28Å; R58-E62 WeakPolarHBondContact CG-OE1 3.45Å; R58-E62 WeakPolarHBondContact O-CG 3.24Å; R58-E62 PolarHBondContact O-N 3.45Å; K59-E62 PolarHBondContact O-N 3.35Å; E62-K65 PolarHBondContact O-N 3.25Å; E62-R66 WeakPolarHBondContact O-CB 3.38Å; E62-R66 VanDerWaalsContact O-CG 3.22Å; E62-R66 WeakPolarHBondContact O-CG 3.32Å; E62-R66 PolarHBondContact O-N 2.92Å
63	Q	88.6	Confident	88.3	Confident	121 Å²	121	56.3 Å²	56.3	57%	0.565	26%	0.262	S	S	*	.	H	α-helix	trans	-61.6	-47.5	175.3	-73.3	173.5	-7.4	0	0	112	K59 L60 Y61 R66 A67	K59-Q63 VanDerWaalsContact O-CG 3.31Å; K59-Q63 WeakPolarHBondContact O-CG 3.35Å; K59-Q63 PolarHBondContact O-N 2.99Å; L60-Q63 PolarHBondContact O-N 3.27Å; Y61-Q63 VanDerWaalsContact C-N 3.31Å; Y61-Q63 PolarHBondContact O-N 3.43Å; Q63-R66 PolarHBondContact O-N 3.32Å; Q63-A67 WeakPolarHBondContact O-CB 3.31Å; Q63-A67 PolarHBondContact O-N 3.36Å
64	L	89.9	Confident	89.2	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-45.9	178.7	-175.4	66.2	0	0	0	111	I30 I34 L60 Y61 A67 H68 Y131	I30-L64 HydrophobicContact CG2-CD1 4.43Å; I34-L64 HydrophobicContact CD1-CD1 4.12Å; I34-L64 HydrophobicContact CD1-CD2 4.26Å; I34-L64 HydrophobicContact CG1-CD1 4.43Å; I34-L64 HydrophobicContact CG1-CD2 4.47Å; L60-L64 WeakPolarHBondContact O-CB 3.42Å; L60-L64 PolarHBondContact O-N 2.94Å; Y61-L64 PolarHBondContact O-N 2.78Å; L64-A67 PolarHBondContact O-N 3.15Å; L64-H68 VanDerWaalsContact CD1-NE2 3.35Å; L64-H68 WeakPolarHBondContact CD1-NE2 3.45Å; L64-H68 WeakPolarHBondContact CG-NE2 3.32Å; L64-H68 PolarHBondContact O-CD2 3.01Å; L64-H68 PolarHBondContact O-N 2.83Å; L64-Y131 HydrophobicContact CD2-CD1 3.72Å; L64-Y131 HydrophobicContact CD2-CE1 3.75Å; L64-Y131 HydrophobicContact CG-CE1 4.13Å
65	K	92.3	Very high	90	Very high	84 Å²	84	52.8 Å²	52.8	37%	0.365	24%	0.235	S	C	.	.	H	α-helix	trans	-59.5	-49.2	177.4	-175.1	-176.7	-178.5	-63.4	0	111.1	Y61 E62 A67 H68 D69	Y61-K65 HydrophobicContact CE1-CD 4.34Å; Y61-K65 HydrophobicContact CE2-CB 4.31Å; Y61-K65 VanDerWaalsContact O-CB 3.27Å; Y61-K65 WeakPolarHBondContact O-CB 3.36Å; Y61-K65 PolarHBondContact O-N 3.19Å; E62-K65 PolarHBondContact O-N 3.25Å; K65-A67 VanDerWaalsContact C-N 3.29Å; K65-A67 PolarHBondContact O-N 3.2Å; K65-H68 PolarHBondContact O-N 3.11Å; K65-D69 IonicContact NZ-OD1 2.81Å; K65-D69 IonicContact NZ-OD2 3.62Å; K65-D69 PolarHBondContact NZ-OD2 3.36Å; K65-D69 WeakPolarHBondContact O-CB 3.42Å; K65-D69 PolarHBondContact O-N 2.82Å
66	R	92.7	Very high	90.7	Very high	131 Å²	131	56.6 Å²	56.6	49%	0.494	25%	0.247	S	C	.	.	H	α-helix	trans	-59.5	-40.2	177.3	-72.6	176.2	-161.6	-152.6	10.8	112	E7 E62 Q63 S70	E7-R66 WeakPolarHBondContact OE1-CD 3.49Å; E7-R66 IonicContact OE1-CZ 2.98Å; E7-R66 IonicContact OE1-NE 2.68Å; E7-R66 IonicContact OE1-NH1 2.62Å; E7-R66 PolarHBondContact OE1-NH1 3.32Å; E62-R66 WeakPolarHBondContact O-CB 3.38Å; E62-R66 VanDerWaalsContact O-CG 3.22Å; E62-R66 WeakPolarHBondContact O-CG 3.32Å; E62-R66 PolarHBondContact O-N 2.92Å; Q63-R66 PolarHBondContact O-N 3.32Å; R66-S70 WeakPolarHBondContact O-CB 3.43Å; R66-S70 PolarHBondContact O-N 2.88Å
67	A	92.4	Very high	91.5	Very high	13 Å²	13	56 Å²	56	11%	0.107	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-46	177.3	0	0	0	0	0	112	I30 Q63 L64 K65 R71	I30-A67 HydrophobicContact CD1-CB 4.12Å; I30-A67 HydrophobicContact CG2-CB 4.46Å; Q63-A67 WeakPolarHBondContact O-CB 3.31Å; Q63-A67 PolarHBondContact O-N 3.36Å; L64-A67 PolarHBondContact O-N 3.15Å; K65-A67 VanDerWaalsContact C-N 3.29Å; K65-A67 PolarHBondContact O-N 3.2Å; A67-R71 WeakPolarHBondContact O-CG 3.37Å; A67-R71 PolarHBondContact O-N 3.13Å; A67-R71 VanDerWaalsContact O-N 3.12Å
68	H	94.9	Very high	92.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.9	-48.5	174.8	-70.2	-58	0	0	0	112.3	D31 L64 K65 S70 R71 Q72 E123 Q127 Y131	D31-H68 IonicContact OD1-CE1 2.75Å; D31-H68 PolarHBondContact OD1-CE1 3.08Å; D31-H68 IonicContact OD1-NE2 3.72Å; D31-H68 PolarHBondContact OD1-NE2 3.07Å; L64-H68 VanDerWaalsContact CD1-NE2 3.35Å; L64-H68 WeakPolarHBondContact CD1-NE2 3.45Å; L64-H68 WeakPolarHBondContact CG-NE2 3.32Å; L64-H68 PolarHBondContact O-CD2 3.01Å; L64-H68 PolarHBondContact O-N 2.83Å; K65-H68 PolarHBondContact O-N 3.11Å; H68-S70 VanDerWaalsContact C-N 3.3Å; H68-S70 PolarHBondContact O-N 3.26Å; H68-R71 PolarHBondContact CE1-NH2 3.29Å; H68-R71 PolarHBondContact ND1-NH2 3.42Å; H68-R71 PolarHBondContact O-N 3.42Å; H68-Q72 WeakPolarHBondContact O-CB 3.43Å; H68-Q72 WeakPolarHBondContact O-CG 3.48Å; H68-Q72 PolarHBondContact O-N 2.92Å; H68-E123 IonicContact CE1-OE1 3.64Å; H68-E123 IonicContact CG-OE1 2.79Å; H68-E123 IonicContact ND1-OE1 3.8Å; H68-E123 PolarHBondContact ND1-OE1 2.92Å; H68-Q127 HydrophobicContact CB-CG 4.44Å; H68-Q127 VanDerWaalsContact CE1-CA 3.45Å; H68-Q127 WeakPolarHBondContact CE1-CA 3.44Å; H68-Y131 AromaticContact CD2-CE1 4Å; H68-Y131 AromaticContact CD2-CZ 4Å
69	D	94.7	Very high	92.8	Very high	61 Å²	61	49.4 Å²	49.4	33%	0.326	22%	0.219	S	C	.	.	H	α-helix	trans	-58.6	-45.8	-179.3	-68.9	-14.3	0	0	0	110.3	K65 R71 Q72 E73	K65-D69 IonicContact NZ-OD1 2.81Å; K65-D69 IonicContact NZ-OD2 3.62Å; K65-D69 PolarHBondContact NZ-OD2 3.36Å; K65-D69 WeakPolarHBondContact O-CB 3.42Å; K65-D69 PolarHBondContact O-N 2.82Å; D69-R71 PolarHBondContact O-N 3.41Å; D69-Q72 PolarHBondContact O-N 3.03Å; D69-E73 WeakPolarHBondContact O-CB 3.35Å; D69-E73 PolarHBondContact O-N 3.47Å
70	S	93.7	Very high	93.4	Very high	24 Å²	24	49.1 Å²	49.1	17%	0.168	22%	0.219	C	C	.	.	H	α-helix	trans	-60.1	-45.5	177.7	-179	0	0	0	0	112.5	T9 R66 H68 I74	T9-S70 WeakPolarHBondContact CG2-OG 3.46Å; R66-S70 WeakPolarHBondContact O-CB 3.43Å; R66-S70 PolarHBondContact O-N 2.88Å; H68-S70 VanDerWaalsContact C-N 3.3Å; H68-S70 PolarHBondContact O-N 3.26Å; S70-I74 WeakPolarHBondContact O-CD1 3.21Å; S70-I74 VanDerWaalsContact O-CG1 3.32Å; S70-I74 WeakPolarHBondContact O-CG1 3.49Å; S70-I74 PolarHBondContact O-N 3.02Å; S70-I74 VanDerWaalsContact O-N 3.13Å
71	R	94.8	Very high	94	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-67.3	-44.3	177.5	-70.5	-171	-56.7	-105.5	3.5	111.9	I24 M27 D31 A67 H68 D69 E73 I74 I75 E123	I24-R71 HydrophobicContact CD1-CB 4.47Å; I24-R71 HydrophobicContact CD1-CG 4.42Å; M27-R71 HydrophobicContact CB-CG 3.99Å; M27-R71 HydrophobicContact CE-CG 3.57Å; M27-R71 PolarHBondContact O-NH1 3.39Å; M27-R71 VanDerWaalsContact O-NH1 3.14Å; M27-R71 HydrophobicContact SD-CG 4.1Å; D31-R71 IonicContact OD1-NH2 3.89Å; D31-R71 IonicContact OD2-CZ 3.04Å; D31-R71 IonicContact OD2-NH1 3.14Å; D31-R71 PolarHBondContact OD2-NH1 2.64Å; D31-R71 IonicContact OD2-NH2 2.64Å; D31-R71 PolarHBondContact OD2-NH2 2.86Å; A67-R71 WeakPolarHBondContact O-CG 3.37Å; A67-R71 PolarHBondContact O-N 3.13Å; A67-R71 VanDerWaalsContact O-N 3.12Å; H68-R71 PolarHBondContact CE1-NH2 3.29Å; H68-R71 PolarHBondContact ND1-NH2 3.42Å; H68-R71 PolarHBondContact O-N 3.42Å; D69-R71 PolarHBondContact O-N 3.41Å; R71-E73 VanDerWaalsContact C-N 3.3Å; R71-E73 PolarHBondContact O-N 3.3Å; R71-I74 PolarHBondContact O-N 3.45Å; R71-I75 WeakPolarHBondContact O-CD1 3.4Å; R71-I75 WeakPolarHBondContact O-CG1 3.42Å; R71-I75 PolarHBondContact O-N 2.92Å; R71-E123 HydrophobicContact CB-CG 4.46Å; R71-E123 IonicContact CZ-OE1 3.01Å; R71-E123 VanDerWaalsContact CZ-OE1 3.3Å; R71-E123 IonicContact CZ-OE2 2.62Å; R71-E123 VanDerWaalsContact NE-CD 3.27Å; R71-E123 IonicContact NE-OE1 3.38Å; R71-E123 PolarHBondContact NE-OE1 3.33Å; R71-E123 IonicContact NE-OE2 2.72Å; R71-E123 PolarHBondContact NE-OE2 3.42Å; R71-E123 IonicContact NH2-OE1 2.64Å; R71-E123 PolarHBondContact NH2-OE1 2.9Å; R71-E123 IonicContact NH2-OE2 3.54Å
72	Q	96.1	Very high	94.5	Very high	14 Å²	14	47.8 Å²	47.8	7%	0.065	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-40.9	177.4	-75.2	-173.8	-3.4	0	0	111.7	H68 D69 I75 R76 E123	H68-Q72 WeakPolarHBondContact O-CB 3.43Å; H68-Q72 WeakPolarHBondContact O-CG 3.48Å; H68-Q72 PolarHBondContact O-N 2.92Å; D69-Q72 PolarHBondContact O-N 3.03Å; Q72-I75 PolarHBondContact O-N 3.4Å; Q72-R76 VanDerWaalsContact O-CB 3.3Å; Q72-R76 WeakPolarHBondContact O-CB 3.49Å; Q72-R76 VanDerWaalsContact O-CG 3.24Å; Q72-R76 WeakPolarHBondContact O-CG 3.29Å; Q72-R76 PolarHBondContact O-N 2.98Å; Q72-E123 HydrophobicContact CG-CG 3.71Å
73	E	95.6	Very high	94.9	Very high	97 Å²	97	48.2 Å²	48.2	45%	0.453	22%	0.217	S	C	.	.	H	α-helix	trans	-60.9	-47.3	175.6	-171.8	-170.7	143.2	0	0	111.4	T9 D69 R71 I75 R76 R77	T9-E73 HydrophobicContact CG2-CB 4.28Å; T9-E73 HydrophobicContact CG2-CG 4.38Å; T9-E73 WeakPolarHBondContact CG2-OE2 3.44Å; T9-E73 PolarHBondContact OG1-OE1 3.44Å; D69-E73 WeakPolarHBondContact O-CB 3.35Å; D69-E73 PolarHBondContact O-N 3.47Å; R71-E73 VanDerWaalsContact C-N 3.3Å; R71-E73 PolarHBondContact O-N 3.3Å; E73-I75 PolarHBondContact O-N 2.87Å; E73-R76 PolarHBondContact O-N 3.46Å; E73-R77 WeakPolarHBondContact O-CB 3.37Å; E73-R77 PolarHBondContact O-N 3.26Å
74	I	95.4	Very high	95.3	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-59.5	-48.4	176.7	-69.1	160.8	0	0	0	111	T9 P10 V12 F20 I24 M27 S70 R71 R77 C78	T9-I74 HydrophobicContact CG2-CG1 4.31Å; P10-I74 HydrophobicContact CB-CD1 4.48Å; V12-I74 HydrophobicContact CB-CG2 3.82Å; V12-I74 HydrophobicContact CG1-CG2 4.33Å; V12-I74 HydrophobicContact CG2-CD1 3.83Å; V12-I74 HydrophobicContact CG2-CG1 4.29Å; V12-I74 HydrophobicContact CG2-CG2 3.88Å; F20-I74 HydrophobicContact CD2-CG2 4.45Å; F20-I74 HydrophobicContact CE2-CG2 4.02Å; I24-I74 HydrophobicContact CD1-CG2 4.09Å; M27-I74 HydrophobicContact CE-CD1 3.81Å; M27-I74 HydrophobicContact SD-CD1 3.93Å; S70-I74 WeakPolarHBondContact O-CD1 3.21Å; S70-I74 VanDerWaalsContact O-CG1 3.32Å; S70-I74 WeakPolarHBondContact O-CG1 3.49Å; S70-I74 PolarHBondContact O-N 3.02Å; S70-I74 VanDerWaalsContact O-N 3.13Å; R71-I74 PolarHBondContact O-N 3.45Å; I74-R77 PolarHBondContact O-N 3.18Å; I74-C78 PolarHBondContact O-N 2.91Å; I74-C78 VanDerWaalsContact O-N 3.07Å; I74-C78 PolarHBondContact O-SG 2.82Å
75	I	96.5	Very high	95.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.1	-47.3	-179.1	-63	160.5	0	0	0	110.4	F20 I24 R71 Q72 E73 R77 C78 I79 F116 E119 L120 E123	F20-I75 HydrophobicContact CE2-CG1 4.45Å; F20-I75 HydrophobicContact CZ-CG1 3.93Å; I24-I75 HydrophobicContact CD1-CD1 4.47Å; I24-I75 HydrophobicContact CD1-CG1 4.08Å; R71-I75 WeakPolarHBondContact O-CD1 3.4Å; R71-I75 WeakPolarHBondContact O-CG1 3.42Å; R71-I75 PolarHBondContact O-N 2.92Å; Q72-I75 PolarHBondContact O-N 3.4Å; E73-I75 PolarHBondContact O-N 2.87Å; I75-R77 PolarHBondContact O-N 3.24Å; I75-C78 PolarHBondContact O-N 2.85Å; I75-I79 HydrophobicContact CG2-CD1 4.03Å; I75-I79 HydrophobicContact CG2-CG1 4.49Å; I75-I79 WeakPolarHBondContact O-CG1 3.39Å; I75-I79 PolarHBondContact O-N 3.24Å; I75-F116 WeakPolarHBondContact CG2-O 3.46Å; I75-E119 HydrophobicContact CD1-CG 3.95Å; I75-E119 HydrophobicContact CG1-CG 4.11Å; I75-E119 HydrophobicContact CG2-CB 4.35Å; I75-L120 HydrophobicContact CG2-CB 3.73Å; I75-L120 HydrophobicContact CG2-CD1 4.15Å; I75-E123 HydrophobicContact CD1-CB 3.82Å; I75-E123 HydrophobicContact CD1-CG 4.16Å
76	R	97.1	Very high	95.9	Very high	115 Å²	115	50.3 Å²	50.3	43%	0.434	22%	0.219	S	C	.	.	H	α-helix	trans	-60.9	-42.9	178.3	-75.1	176.7	-176.4	138	8.7	111.8	Q72 E73 C78 I79 E80 L120	Q72-R76 VanDerWaalsContact O-CB 3.3Å; Q72-R76 WeakPolarHBondContact O-CB 3.49Å; Q72-R76 VanDerWaalsContact O-CG 3.24Å; Q72-R76 WeakPolarHBondContact O-CG 3.29Å; Q72-R76 PolarHBondContact O-N 2.98Å; E73-R76 PolarHBondContact O-N 3.46Å; R76-C78 VanDerWaalsContact C-N 3.31Å; R76-C78 PolarHBondContact O-N 2.94Å; R76-I79 WeakPolarHBondContact O-CB 3.33Å; R76-I79 PolarHBondContact O-N 3.32Å; R76-E80 WeakPolarHBondContact O-CG 3.22Å; R76-E80 PolarHBondContact O-N 3.4Å; R76-L120 HydrophobicContact CG-CD1 4.34Å
77	R	96.1	Very high	96.1	Very high	83 Å²	83	50 Å²	50	31%	0.313	22%	0.223	S	C	.	.	H	α-helix	trans	-57.5	-45	174.6	-175.7	-179	69.8	-157.3	-2.4	111.6	V12 E73 I74 I75 E80 Q81	V12-R77 PolarHBondContact O-NH2 3.16Å; V12-R77 VanDerWaalsContact O-NH2 3.08Å; E73-R77 WeakPolarHBondContact O-CB 3.37Å; E73-R77 PolarHBondContact O-N 3.26Å; I74-R77 PolarHBondContact O-N 3.18Å; I75-R77 PolarHBondContact O-N 3.24Å; R77-E80 PolarHBondContact O-N 2.92Å; R77-Q81 WeakPolarHBondContact O-CB 3.4Å; R77-Q81 PolarHBondContact O-N 3.49Å
78	C	96.7	Very high	96.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.4	-36.3	177.8	-66.3	0	0	0	0	113.1	C14 F20 I74 I75 R76 S82 F116	C14-C78 HydrophobicContact CB-CB 3.62Å; C14-C78 WeakPolarHBondContact CB-SG 3.48Å; C14-C78 WeakPolarHBondContact SG-CA 3.4Å; C14-C78 WeakPolarHBondContact SG-CB 3.45Å; C14-C78 CovalentContact SG-SG 2.04Å; C14-C78 PolarHBondContact SG-SG 2.8Å; F20-C78 HydrophobicContact CE2-CB 4.2Å; I74-C78 PolarHBondContact O-N 2.91Å; I74-C78 VanDerWaalsContact O-N 3.07Å; I74-C78 PolarHBondContact O-SG 2.82Å; I75-C78 PolarHBondContact O-N 2.85Å; R76-C78 VanDerWaalsContact C-N 3.31Å; R76-C78 PolarHBondContact O-N 2.94Å; C78-S82 VanDerWaalsContact O-CB 3.27Å; C78-S82 WeakPolarHBondContact O-CB 3.44Å; C78-S82 PolarHBondContact O-N 2.94Å; C78-F116 HydrophobicContact CB-CD1 3.97Å; C78-F116 HydrophobicContact CB-CD2 3.96Å; C78-F116 HydrophobicContact CB-CE1 3.99Å; C78-F116 HydrophobicContact CB-CE2 3.99Å; C78-F116 HydrophobicContact CB-CG 3.97Å; C78-F116 HydrophobicContact CB-CZ 4.01Å
79	I	97.7	Very high	96.2	Very high	14 Å²	14	55.1 Å²	55.1	7%	0.072	25%	0.245	C	C	.	.	H	α-helix	trans	-59.7	-52.6	171.2	-69.1	170.7	0	0	0	110	I75 R76 Q81 S82 Q83 L113 F116 Q117 L120	I75-I79 HydrophobicContact CG2-CD1 4.03Å; I75-I79 HydrophobicContact CG2-CG1 4.49Å; I75-I79 WeakPolarHBondContact O-CG1 3.39Å; I75-I79 PolarHBondContact O-N 3.24Å; R76-I79 WeakPolarHBondContact O-CB 3.33Å; R76-I79 PolarHBondContact O-N 3.32Å; I79-Q81 VanDerWaalsContact C-N 3.35Å; I79-Q81 PolarHBondContact O-N 2.91Å; I79-S82 PolarHBondContact O-N 3.39Å; I79-Q83 HydrophobicContact CG2-CG 4.21Å; I79-Q83 WeakPolarHBondContact O-CB 3.44Å; I79-Q83 VanDerWaalsContact O-CG 3.27Å; I79-Q83 WeakPolarHBondContact O-CG 3.38Å; I79-Q83 PolarHBondContact O-N 3.49Å; I79-L113 HydrophobicContact CB-CD1 4.49Å; I79-L113 HydrophobicContact CG2-CD1 3.93Å; I79-F116 HydrophobicContact CD1-CB 4.49Å; I79-F116 HydrophobicContact CG1-CB 3.55Å; I79-Q117 HydrophobicContact CD1-CG 4.24Å; I79-Q117 HydrophobicContact CG1-CG 4.38Å; I79-L120 HydrophobicContact CD1-CB 4.04Å; I79-L120 HydrophobicContact CD1-CD2 3.82Å
80	E	97.1	Very high	96.2	Very high	99 Å²	99	55.4 Å²	55.4	46%	0.463	25%	0.246	S	C	.	.	H	α-helix	trans	-59.9	-44.4	-179	-73.1	179.1	-162.7	0	0	112	R76 R77 Q83 R84	R76-E80 WeakPolarHBondContact O-CG 3.22Å; R76-E80 PolarHBondContact O-N 3.4Å; R77-E80 PolarHBondContact O-N 2.92Å; E80-Q83 PolarHBondContact O-N 3.45Å; E80-R84 WeakPolarHBondContact O-CG 3.23Å; E80-R84 PolarHBondContact O-N 3.47Å; E80-R84 IonicContact OE2-NH2 3.98Å
81	Q	96.4	Very high	96.2	Very high	65 Å²	65	59 Å²	59	30%	0.304	26%	0.26	S	S	.	.	H	α-helix	trans	-62.2	-45.1	177.8	-177.4	173.3	0.5	0	0	111.5	C14 R77 I79 R84 R85	C14-Q81 PolarHBondContact SG-OE1 2.72Å; C14-Q81 VanDerWaalsContact SG-OE1 3.36Å; R77-Q81 WeakPolarHBondContact O-CB 3.4Å; R77-Q81 PolarHBondContact O-N 3.49Å; I79-Q81 VanDerWaalsContact C-N 3.35Å; I79-Q81 PolarHBondContact O-N 2.91Å; Q81-R84 PolarHBondContact O-N 3.22Å; Q81-R85 WeakPolarHBondContact O-CG 3.26Å; Q81-R85 PolarHBondContact O-N 2.91Å; Q81-R85 VanDerWaalsContact O-N 3.16Å
82	S	96.4	Very high	96.1	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.007	28%	0.278	C	S	.	.	H	α-helix	trans	-69.3	-36.9	178.8	-168.3	0	0	0	0	111.9	C78 I79 R85 V86 E109 L113	C78-S82 VanDerWaalsContact O-CB 3.27Å; C78-S82 WeakPolarHBondContact O-CB 3.44Å; C78-S82 PolarHBondContact O-N 2.94Å; I79-S82 PolarHBondContact O-N 3.39Å; S82-R85 PolarHBondContact O-N 3.49Å; S82-V86 WeakPolarHBondContact O-CG2 3.21Å; S82-V86 PolarHBondContact O-N 3.26Å; S82-E109 PolarHBondContact OG-O 3.24Å; S82-L113 WeakPolarHBondContact OG-CB 3.21Å; S82-L113 PolarHBondContact OG-N 3.12Å
83	Q	97.9	Very high	95.8	Very high	88 Å²	88	67.2 Å²	67.2	41%	0.411	29%	0.29	S	S	.	.	H	α-helix	trans	-58.8	-48.2	173	-77.6	173.9	-30	0	0	111.9	I79 E80 R85 V86 E87 L113	I79-Q83 HydrophobicContact CG2-CG 4.21Å; I79-Q83 WeakPolarHBondContact O-CB 3.44Å; I79-Q83 VanDerWaalsContact O-CG 3.27Å; I79-Q83 WeakPolarHBondContact O-CG 3.38Å; I79-Q83 PolarHBondContact O-N 3.49Å; E80-Q83 PolarHBondContact O-N 3.45Å; Q83-R85 VanDerWaalsContact C-N 3.28Å; Q83-R85 PolarHBondContact O-N 2.97Å; Q83-V86 PolarHBondContact O-N 2.93Å; Q83-E87 WeakPolarHBondContact O-CB 3.32Å; Q83-E87 PolarHBondContact O-N 2.99Å; Q83-L113 HydrophobicContact CG-CD1 3.65Å; Q83-L113 HydrophobicContact CG-CD2 3.89Å; Q83-L113 HydrophobicContact CG-CG 4.45Å
84	R	97.8	Very high	95.5	Very high	169 Å²	169	69.2 Å²	69.2	64%	0.638	30%	0.298	S	S	*	.	H	α-helix	trans	-60.4	-38.4	177.2	-69.3	178.4	-159.7	-162.5	7.8	112.1	E80 Q81 H88	E80-R84 WeakPolarHBondContact O-CG 3.23Å; E80-R84 PolarHBondContact O-N 3.47Å; E80-R84 IonicContact OE2-NH2 3.98Å; Q81-R84 PolarHBondContact O-N 3.22Å; R84-H88 WeakPolarHBondContact O-CB 3.35Å; R84-H88 PolarHBondContact O-N 3.26Å
85	R	96.5	Very high	95.2	Very high	69 Å²	69	72.9 Å²	72.9	26%	0.26	33%	0.328	S	S	.	.	H	α-helix	trans	-67	-46.1	176.3	-72.9	173.4	177.3	172.8	-3.9	112.1	D15 Q81 S82 Q83 E87 H88 L89 E109	D15-R85 IonicContact OD1-CZ 2.91Å; D15-R85 IonicContact OD1-NH1 3.51Å; D15-R85 PolarHBondContact OD1-NH1 3.32Å; D15-R85 IonicContact OD1-NH2 2.65Å; D15-R85 PolarHBondContact OD1-NH2 2.85Å; D15-R85 IonicContact OD2-NH2 3.74Å; Q81-R85 WeakPolarHBondContact O-CG 3.26Å; Q81-R85 PolarHBondContact O-N 2.91Å; Q81-R85 VanDerWaalsContact O-N 3.16Å; S82-R85 PolarHBondContact O-N 3.49Å; Q83-R85 VanDerWaalsContact C-N 3.28Å; Q83-R85 PolarHBondContact O-N 2.97Å; R85-E87 VanDerWaalsContact C-N 3.32Å; R85-E87 PolarHBondContact O-N 3.25Å; R85-H88 PolarHBondContact O-N 2.99Å; R85-L89 WeakPolarHBondContact O-CB 3.43Å; R85-L89 VanDerWaalsContact O-CG 3.26Å; R85-L89 WeakPolarHBondContact O-CG 3.28Å; R85-L89 PolarHBondContact O-N 3.42Å; R85-E109 HydrophobicContact CB-CG 4.43Å; R85-E109 WeakPolarHBondContact CD-OE2 3.27Å; R85-E109 IonicContact NH1-OE2 3.86Å
86	V	96.8	Very high	94.8	Very high	13 Å²	13	77.1 Å²	77.1	8%	0.079	35%	0.351	C	S	.	.	H	α-helix	trans	-59.6	-45.1	176	169.9	0	0	0	0	110.4	S82 Q83 L89 L90 L106 E109 Q110 L113	S82-V86 WeakPolarHBondContact O-CG2 3.21Å; S82-V86 PolarHBondContact O-N 3.26Å; Q83-V86 PolarHBondContact O-N 2.93Å; V86-L89 PolarHBondContact O-N 2.91Å; V86-L90 HydrophobicContact CG1-CD1 3.92Å; V86-L90 HydrophobicContact CG1-CG 4.38Å; V86-L90 WeakPolarHBondContact O-CB 3.38Å; V86-L90 VanDerWaalsContact O-CG 3.24Å; V86-L90 WeakPolarHBondContact O-CG 3.31Å; V86-L90 PolarHBondContact O-N 3.02Å; V86-L106 HydrophobicContact CG1-CD1 4.02Å; V86-E109 HydrophobicContact CG2-CB 3.9Å; V86-Q110 HydrophobicContact CG1-CG 4.01Å; V86-Q110 HydrophobicContact CG2-CG 4.04Å; V86-L113 HydrophobicContact CG2-CD2 4.38Å
87	E	96.8	Very high	94.1	Very high	125 Å²	125	76.1 Å²	76.1	58%	0.584	36%	0.357	S	S	*	.	H	α-helix	trans	-58.7	-49.1	175.8	-175.2	176.4	-164.3	0	0	111.5	Q83 R85 L89 L90 E91	Q83-E87 WeakPolarHBondContact O-CB 3.32Å; Q83-E87 PolarHBondContact O-N 2.99Å; R85-E87 VanDerWaalsContact C-N 3.32Å; R85-E87 PolarHBondContact O-N 3.25Å; E87-L89 PolarHBondContact O-N 2.75Å; E87-L90 WeakPolarHBondContact O-CB 3.45Å; E87-L90 PolarHBondContact O-N 3.37Å; E87-E91 PolarHBondContact O-N 2.84Å
88	H	95.8	Very high	93.6	Very high	115 Å²	115	79.3 Å²	79.3	53%	0.532	38%	0.38	S	S	.	.	H	α-helix	trans	-61	-41.2	177.8	-176.4	64.7	0	0	0	113.1	R84 R85 E91 R92	R84-H88 WeakPolarHBondContact O-CB 3.35Å; R84-H88 PolarHBondContact O-N 3.26Å; R85-H88 PolarHBondContact O-N 2.99Å; H88-E91 PolarHBondContact O-N 2.76Å; H88-R92 VanDerWaalsContact NE2-CD 3.3Å; H88-R92 WeakPolarHBondContact NE2-CD 3.34Å; H88-R92 WeakPolarHBondContact O-CG 3.19Å; H88-R92 PolarHBondContact O-N 2.62Å
89	L	95	Very high	93.3	Very high	5 Å²	5	82 Å²	82	3%	0.026	40%	0.395	C	S	.	.	H	α-helix	trans	-67.8	-36.3	177	-71.4	169.6	0	0	0	112.1	R85 V86 E87 R92 R93 L102 E105 L106 E109	R85-L89 WeakPolarHBondContact O-CB 3.43Å; R85-L89 VanDerWaalsContact O-CG 3.26Å; R85-L89 WeakPolarHBondContact O-CG 3.28Å; R85-L89 PolarHBondContact O-N 3.42Å; V86-L89 PolarHBondContact O-N 2.91Å; E87-L89 PolarHBondContact O-N 2.75Å; L89-R92 PolarHBondContact O-N 2.68Å; L89-R93 VanDerWaalsContact O-CB 3.3Å; L89-R93 WeakPolarHBondContact O-CB 3.5Å; L89-R93 PolarHBondContact O-N 3.14Å; L89-L102 HydrophobicContact CD2-CD2 4.3Å; L89-E105 HydrophobicContact CD1-CB 4.48Å; L89-E105 HydrophobicContact CD1-CG 3.91Å; L89-E105 HydrophobicContact CD2-CB 4.37Å; L89-E105 VanDerWaalsContact CD2-CD 3.46Å; L89-E105 HydrophobicContact CD2-CG 3.98Å; L89-L106 HydrophobicContact CB-CB 4.39Å; L89-L106 HydrophobicContact CB-CD1 3.87Å; L89-E109 HydrophobicContact CD1-CB 4.03Å; L89-E109 HydrophobicContact CD1-CG 3.81Å
90	L	93.9	Very high	92.9	Very high	67 Å²	67	87.3 Å²	87.3	35%	0.351	42%	0.423	S	S	.	.	H	α-helix	trans	-63.1	-44.5	173.8	-74.5	169	0	0	0	111.4	V86 E87 R93 K94 L106	V86-L90 HydrophobicContact CG1-CD1 3.92Å; V86-L90 HydrophobicContact CG1-CG 4.38Å; V86-L90 WeakPolarHBondContact O-CB 3.38Å; V86-L90 VanDerWaalsContact O-CG 3.24Å; V86-L90 WeakPolarHBondContact O-CG 3.31Å; V86-L90 PolarHBondContact O-N 3.02Å; E87-L90 WeakPolarHBondContact O-CB 3.45Å; E87-L90 PolarHBondContact O-N 3.37Å; L90-R93 PolarHBondContact O-N 2.9Å; L90-K94 WeakPolarHBondContact O-CG 3.47Å; L90-K94 PolarHBondContact O-N 3.37Å; L90-L106 HydrophobicContact CD2-CD1 4.08Å; L90-L106 HydrophobicContact CD2-CD2 3.66Å; L90-L106 HydrophobicContact CG-CD1 3.95Å; L90-L106 HydrophobicContact CG-CD2 4.4Å
91	E	94	Very high	92.7	Very high	98 Å²	98	88.3 Å²	88.3	46%	0.458	43%	0.432	S	S	.	.	H	α-helix	trans	-63.8	-43.6	176.7	-66.4	-48.8	126.6	0	0	112.2	E87 H88 R93 K94 A95	E87-E91 PolarHBondContact O-N 2.84Å; H88-E91 PolarHBondContact O-N 2.76Å; E91-R93 VanDerWaalsContact C-N 3.3Å; E91-R93 PolarHBondContact O-N 3.25Å; E91-K94 WeakPolarHBondContact O-CB 3.23Å; E91-K94 PolarHBondContact O-N 2.93Å; E91-K94 IonicContact OE1-NZ 2.65Å; E91-K94 PolarHBondContact OE1-NZ 3.49Å; E91-K94 IonicContact OE2-NZ 3.3Å; E91-K94 PolarHBondContact OE2-NZ 3.01Å; E91-A95 PolarHBondContact O-N 2.91Å
92	R	93	Very high	92.5	Very high	104 Å²	104	85.5 Å²	85.5	39%	0.392	42%	0.419	S	S	.	.	H	α-helix	trans	-61.8	-37.7	175.7	-74.4	177	63.7	-158	0.7	112.6	H88 L89 A95 N96 L102	H88-R92 VanDerWaalsContact NE2-CD 3.3Å; H88-R92 WeakPolarHBondContact NE2-CD 3.34Å; H88-R92 WeakPolarHBondContact O-CG 3.19Å; H88-R92 PolarHBondContact O-N 2.62Å; L89-R92 PolarHBondContact O-N 2.68Å; R92-A95 PolarHBondContact O-N 2.98Å; R92-N96 PolarHBondContact O-N 3.44Å; R92-N96 PolarHBondContact O-ND2 2.93Å; R92-L102 HydrophobicContact CB-CD1 4.23Å; R92-L102 HydrophobicContact CB-CD2 4.4Å
93	R	89.2	Confident	92.2	Very high	84 Å²	84	86.9 Å²	86.9	32%	0.317	43%	0.426	S	S	.	.	H	α-helix	trans	-69.8	-33.6	177.8	-173	179.6	179.4	-145	-4.2	112.6	L89 L90 E91 A95 N96 V97	L89-R93 VanDerWaalsContact O-CB 3.3Å; L89-R93 WeakPolarHBondContact O-CB 3.5Å; L89-R93 PolarHBondContact O-N 3.14Å; L90-R93 PolarHBondContact O-N 2.9Å; E91-R93 VanDerWaalsContact C-N 3.3Å; E91-R93 PolarHBondContact O-N 3.25Å; R93-A95 PolarHBondContact O-N 3.25Å; R93-N96 CarbonylContact O-C 3.15Å; R93-N96 PolarHBondContact O-N 3.26Å; R93-N96 VanDerWaalsContact O-N 3.12Å; R93-V97 WeakPolarHBondContact O-CA 3.4Å; R93-V97 PolarHBondContact O-N 3.42Å
94	K	89.4	Confident	92	Very high	139 Å²	139	89 Å²	89	60%	0.604	43%	0.434	S	S	*	.	H	α-helix	trans	-58.9	-35	173.1	-72.4	173.3	-174.9	170.3	0	111.7	L90 E91	L90-K94 WeakPolarHBondContact O-CG 3.47Å; L90-K94 PolarHBondContact O-N 3.37Å; E91-K94 WeakPolarHBondContact O-CB 3.23Å; E91-K94 PolarHBondContact O-N 2.93Å; E91-K94 IonicContact OE1-NZ 2.65Å; E91-K94 PolarHBondContact OE1-NZ 3.49Å; E91-K94 IonicContact OE2-NZ 3.3Å; E91-K94 PolarHBondContact OE2-NZ 3.01Å
95	A	90	Very high	91.9	Very high	78 Å²	78	85.2 Å²	85.2	65%	0.645	42%	0.423	S	S	*	.	H	α-helix	trans	-79	-24.7	176.1	0	0	0	0	0	113.6	E91 R92 R93	E91-A95 PolarHBondContact O-N 2.91Å; R92-A95 PolarHBondContact O-N 2.98Å; R93-A95 PolarHBondContact O-N 3.25Å
96	N	87.4	Confident	91.8	Very high	88 Å²	88	82 Å²	82	47%	0.471	41%	0.412	S	S	.	.			trans	-136.7	73.9	-175.2	-56.9	-76.7	0	0	0	110.6	R92 R93 D98 D99 L102	R92-N96 PolarHBondContact O-N 3.44Å; R92-N96 PolarHBondContact O-ND2 2.93Å; R93-N96 CarbonylContact O-C 3.15Å; R93-N96 PolarHBondContact O-N 3.26Å; R93-N96 VanDerWaalsContact O-N 3.12Å; N96-D98 VanDerWaalsContact C-N 3.29Å; N96-D98 PolarHBondContact O-N 3.48Å; N96-D99 HydrophobicContact CB-CB 4.07Å; N96-D99 PolarHBondContact O-N 3.03Å; N96-L102 HydrophobicContact CB-CD1 4.06Å
97	V	82.5	Confident	91.7	Very high	94 Å²	94	88.8 Å²	88.8	57%	0.57	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-32.9	-170	178.1	0	0	0	0	112.9	R93	R93-V97 WeakPolarHBondContact O-CA 3.4Å; R93-V97 PolarHBondContact O-N 3.42Å
98	D	86.3	Confident	91.6	Very high	150 Å²	150	86.9 Å²	86.9	80%	0.802	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	4.7	-175.3	-60.5	-39.1	0	0	0	113.9	N96 N100	N96-D98 VanDerWaalsContact C-N 3.29Å; N96-D98 PolarHBondContact O-N 3.48Å; D98-N100 PolarHBondContact O-N 2.64Å; D98-N100 VanDerWaalsContact O-N 3.16Å
99	D	89.2	Confident	91.6	Very high	58 Å²	58	82.1 Å²	82.1	31%	0.31	41%	0.406	S	S	.	.			trans	-77.6	102.2	176.8	-171.2	-26.6	0	0	0	110.6	N96 D101 L102 L103	N96-D99 HydrophobicContact CB-CB 4.07Å; N96-D99 PolarHBondContact O-N 3.03Å; D99-D101 VanDerWaalsContact C-N 3.29Å; D99-D101 PolarHBondContact O-N 3Å; D99-D101 WeakPolarHBondContact OD1-CA 3.28Å; D99-D101 WeakPolarHBondContact OD1-CB 3.42Å; D99-D101 PolarHBondContact OD1-N 3.38Å; D99-L102 HydrophobicContact CB-CB 4.09Å; D99-L102 HydrophobicContact CB-CD1 3.85Å; D99-L102 HydrophobicContact CB-CG 4.01Å; D99-L102 PolarHBondContact O-N 3.48Å; D99-L102 PolarHBondContact OD1-N 2.95Å; D99-L102 WeakPolarHBondContact OD2-CG 3.38Å; D99-L103 PolarHBondContact O-N 3.43Å
100	N	89.7	Confident	91.7	Very high	124 Å²	124	86 Å²	86	66%	0.663	43%	0.425	S	S	*	.	H	α-helix	trans	-67.5	-28	179.2	-74.4	-57	0	0	0	113.2	D98 L103 K104	D98-N100 PolarHBondContact O-N 2.64Å; D98-N100 VanDerWaalsContact O-N 3.16Å; N100-L103 PolarHBondContact O-N 3.34Å; N100-K104 PolarHBondContact O-N 3.03Å
101	D	92.2	Very high	91.8	Very high	121 Å²	121	85.8 Å²	85.8	65%	0.647	43%	0.429	S	S	*	.	H	α-helix	trans	-72.1	-41.5	179	-71.2	-32.4	0	0	0	110	D99 L103 K104 E105	D99-D101 VanDerWaalsContact C-N 3.29Å; D99-D101 PolarHBondContact O-N 3Å; D99-D101 WeakPolarHBondContact OD1-CA 3.28Å; D99-D101 WeakPolarHBondContact OD1-CB 3.42Å; D99-D101 PolarHBondContact OD1-N 3.38Å; D101-L103 VanDerWaalsContact C-N 3.3Å; D101-L103 PolarHBondContact O-N 3.43Å; D101-K104 WeakPolarHBondContact O-CB 3.45Å; D101-K104 PolarHBondContact O-N 2.66Å; D101-E105 PolarHBondContact O-N 3.38Å
102	L	91.8	Very high	91.9	Very high	5 Å²	5	82.6 Å²	82.6	3%	0.026	41%	0.413	C	S	.	.	H	α-helix	trans	-59.6	-40.4	171	-73.8	-179.4	0	0	0	112.2	L89 R92 N96 D99 K104 E105 L106	L89-L102 HydrophobicContact CD2-CD2 4.3Å; R92-L102 HydrophobicContact CB-CD1 4.23Å; R92-L102 HydrophobicContact CB-CD2 4.4Å; N96-L102 HydrophobicContact CB-CD1 4.06Å; D99-L102 HydrophobicContact CB-CB 4.09Å; D99-L102 HydrophobicContact CB-CD1 3.85Å; D99-L102 HydrophobicContact CB-CG 4.01Å; D99-L102 PolarHBondContact O-N 3.48Å; D99-L102 PolarHBondContact OD1-N 2.95Å; D99-L102 WeakPolarHBondContact OD2-CG 3.38Å; L102-K104 VanDerWaalsContact C-N 3.33Å; L102-K104 PolarHBondContact O-N 3.16Å; L102-E105 PolarHBondContact O-N 3.14Å; L102-L106 VanDerWaalsContact O-CB 3.25Å; L102-L106 WeakPolarHBondContact O-CB 3.45Å; L102-L106 PolarHBondContact O-N 3.42Å
103	L	91.5	Very high	92.1	Very high	30 Å²	30	78.8 Å²	78.8	16%	0.157	40%	0.401	C	S	.	.	H	α-helix	trans	-63.8	-40.2	176.7	178.4	58.3	0	0	0	111.8	D99 N100 D101 R107	D99-L103 PolarHBondContact O-N 3.43Å; N100-L103 PolarHBondContact O-N 3.34Å; D101-L103 VanDerWaalsContact C-N 3.3Å; D101-L103 PolarHBondContact O-N 3.43Å; L103-R107 VanDerWaalsContact O-CG 3.32Å; L103-R107 WeakPolarHBondContact O-CG 3.47Å; L103-R107 PolarHBondContact O-N 3.15Å; L103-R107 VanDerWaalsContact O-N 3.1Å
104	K	94.1	Very high	92.5	Very high	134 Å²	134	81.5 Å²	81.5	58%	0.583	42%	0.415	S	S	*	.	H	α-helix	trans	-65.8	-46.8	177	-175.9	-177.8	176.6	-174.4	0	111.2	N100 D101 L102 R107 I108	N100-K104 PolarHBondContact O-N 3.03Å; D101-K104 WeakPolarHBondContact O-CB 3.45Å; D101-K104 PolarHBondContact O-N 2.66Å; L102-K104 VanDerWaalsContact C-N 3.33Å; L102-K104 PolarHBondContact O-N 3.16Å; K104-R107 PolarHBondContact O-N 3.39Å; K104-I108 HydrophobicContact CG-CD1 4.21Å; K104-I108 WeakPolarHBondContact O-CG1 3.39Å; K104-I108 PolarHBondContact O-N 3.13Å; K104-I108 VanDerWaalsContact O-N 3.1Å
105	E	93.8	Very high	92.9	Very high	88 Å²	88	78.5 Å²	78.5	41%	0.411	41%	0.405	S	S	.	.	H	α-helix	trans	-60.3	-45.8	177.6	-166.7	-178.6	171.5	0	0	111.3	L89 D101 L102 R107 I108 E109	L89-E105 HydrophobicContact CD1-CB 4.48Å; L89-E105 HydrophobicContact CD1-CG 3.91Å; L89-E105 HydrophobicContact CD2-CB 4.37Å; L89-E105 VanDerWaalsContact CD2-CD 3.46Å; L89-E105 HydrophobicContact CD2-CG 3.98Å; D101-E105 PolarHBondContact O-N 3.38Å; L102-E105 PolarHBondContact O-N 3.14Å; E105-R107 VanDerWaalsContact C-N 3.34Å; E105-R107 PolarHBondContact O-N 2.85Å; E105-I108 PolarHBondContact O-N 3.26Å; E105-I108 VanDerWaalsContact O-N 3.16Å; E105-E109 PolarHBondContact O-N 3.13Å
106	L	95	Very high	93.2	Very high	3 Å²	3	74.9 Å²	74.9	2%	0.016	38%	0.375	C	S	.	.	H	α-helix	trans	-58.7	-43.6	176.8	179.3	63.8	0	0	0	112.2	V86 L89 L90 L102 I108 E109 Q110	V86-L106 HydrophobicContact CG1-CD1 4.02Å; L89-L106 HydrophobicContact CB-CB 4.39Å; L89-L106 HydrophobicContact CB-CD1 3.87Å; L90-L106 HydrophobicContact CD2-CD1 4.08Å; L90-L106 HydrophobicContact CD2-CD2 3.66Å; L90-L106 HydrophobicContact CG-CD1 3.95Å; L90-L106 HydrophobicContact CG-CD2 4.4Å; L102-L106 VanDerWaalsContact O-CB 3.25Å; L102-L106 WeakPolarHBondContact O-CB 3.45Å; L102-L106 PolarHBondContact O-N 3.42Å; L106-I108 VanDerWaalsContact C-N 3.33Å; L106-I108 PolarHBondContact O-N 3.43Å; L106-E109 PolarHBondContact O-N 2.96Å; L106-Q110 HydrophobicContact CD1-CG 4.13Å; L106-Q110 HydrophobicContact CG-CG 4.37Å; L106-Q110 VanDerWaalsContact O-CB 3.31Å; L106-Q110 WeakPolarHBondContact O-CB 3.46Å; L106-Q110 WeakPolarHBondContact O-CG 3.35Å; L106-Q110 PolarHBondContact O-N 2.98Å
107	R	95.6	Very high	93.7	Very high	154 Å²	154	74.5 Å²	74.5	58%	0.581	37%	0.371	S	S	*	.	H	α-helix	trans	-63	-40	177.2	-76.1	171.6	177.1	161	-0.3	112.1	L103 K104 E105 S111	L103-R107 VanDerWaalsContact O-CG 3.32Å; L103-R107 WeakPolarHBondContact O-CG 3.47Å; L103-R107 PolarHBondContact O-N 3.15Å; L103-R107 VanDerWaalsContact O-N 3.1Å; K104-R107 PolarHBondContact O-N 3.39Å; E105-R107 VanDerWaalsContact C-N 3.34Å; E105-R107 PolarHBondContact O-N 2.85Å; R107-S111 WeakPolarHBondContact O-CB 3.45Å; R107-S111 PolarHBondContact O-N 3.28Å
108	I	94.7	Very high	94.4	Very high	85 Å²	85	73.1 Å²	73.1	44%	0.436	36%	0.362	S	S	.	.	H	α-helix	trans	-63.8	-50.9	177.6	-68.9	165.7	0	0	0	109.7	K104 E105 L106 Q110 S111 K112	K104-I108 HydrophobicContact CG-CD1 4.21Å; K104-I108 WeakPolarHBondContact O-CG1 3.39Å; K104-I108 PolarHBondContact O-N 3.13Å; K104-I108 VanDerWaalsContact O-N 3.1Å; E105-I108 PolarHBondContact O-N 3.26Å; E105-I108 VanDerWaalsContact O-N 3.16Å; L106-I108 VanDerWaalsContact C-N 3.33Å; L106-I108 PolarHBondContact O-N 3.43Å; I108-Q110 PolarHBondContact O-N 2.8Å; I108-S111 WeakPolarHBondContact O-CB 3.46Å; I108-S111 PolarHBondContact O-N 2.79Å; I108-S111 VanDerWaalsContact O-N 3.17Å; I108-K112 WeakPolarHBondContact O-CG 2.83Å; I108-K112 PolarHBondContact O-N 3.45Å
109	E	95.8	Very high	94.9	Very high	15 Å²	15	67.2 Å²	67.2	7%	0.07	33%	0.33	C	S	.	.	H	α-helix	trans	-66	-37.9	-179.7	-73.4	-60.6	131.8	0	0	112.5	S82 R85 V86 L89 E105 L106 S111 K112 L113	S82-E109 PolarHBondContact OG-O 3.24Å; R85-E109 HydrophobicContact CB-CG 4.43Å; R85-E109 WeakPolarHBondContact CD-OE2 3.27Å; R85-E109 IonicContact NH1-OE2 3.86Å; V86-E109 HydrophobicContact CG2-CB 3.9Å; L89-E109 HydrophobicContact CD1-CB 4.03Å; L89-E109 HydrophobicContact CD1-CG 3.81Å; E105-E109 PolarHBondContact O-N 3.13Å; L106-E109 PolarHBondContact O-N 2.96Å; E109-S111 VanDerWaalsContact C-N 3.31Å; E109-S111 PolarHBondContact O-N 3.44Å; E109-K112 WeakPolarHBondContact O-CB 3.26Å; E109-K112 PolarHBondContact O-N 3.46Å; E109-K112 WeakPolarHBondContact OE1-CD 3.39Å; E109-K112 WeakPolarHBondContact OE1-CE 3.4Å; E109-K112 IonicContact OE1-NZ 3.65Å; E109-K112 PolarHBondContact OE1-NZ 2.86Å; E109-L113 PolarHBondContact O-N 3.31Å
110	Q	96.7	Very high	95.3	Very high	87 Å²	87	65.8 Å²	65.8	41%	0.407	32%	0.322	S	S	.	.	H	α-helix	trans	-62	-38.6	172.2	-75.8	177.3	-24.2	0	0	112.4	V86 L106 I108 L113 K114	V86-Q110 HydrophobicContact CG1-CG 4.01Å; V86-Q110 HydrophobicContact CG2-CG 4.04Å; L106-Q110 HydrophobicContact CD1-CG 4.13Å; L106-Q110 HydrophobicContact CG-CG 4.37Å; L106-Q110 VanDerWaalsContact O-CB 3.31Å; L106-Q110 WeakPolarHBondContact O-CB 3.46Å; L106-Q110 WeakPolarHBondContact O-CG 3.35Å; L106-Q110 PolarHBondContact O-N 2.98Å; I108-Q110 PolarHBondContact O-N 2.8Å; Q110-L113 PolarHBondContact O-N 3.46Å; Q110-K114 PolarHBondContact O-N 3.03Å
111	S	96.4	Very high	95.6	Very high	63 Å²	63	64.3 Å²	64.3	44%	0.441	31%	0.314	S	S	.	.	H	α-helix	trans	-63.8	-43.8	174	-173.4	0	0	0	0	111.1	R107 I108 E109 K114 N115	R107-S111 WeakPolarHBondContact O-CB 3.45Å; R107-S111 PolarHBondContact O-N 3.28Å; I108-S111 WeakPolarHBondContact O-CB 3.46Å; I108-S111 PolarHBondContact O-N 2.79Å; I108-S111 VanDerWaalsContact O-N 3.17Å; E109-S111 VanDerWaalsContact C-N 3.31Å; E109-S111 PolarHBondContact O-N 3.44Å; S111-K114 PolarHBondContact O-N 3.36Å; S111-N115 PolarHBondContact O-N 3.09Å; S111-N115 PolarHBondContact O-ND2 2.88Å
112	K	95.8	Very high	95.8	Very high	31 Å²	31	61.6 Å²	61.6	14%	0.135	30%	0.299	C	S	.	.	H	α-helix	trans	-59.1	-49.3	174.9	-67.1	-176.3	-175	171.5	0	111.6	D15 L17 I108 E109 K114 N115 F116	D15-K112 WeakPolarHBondContact O-CE 2.99Å; D15-K112 PolarHBondContact O-NZ 3.21Å; D15-K112 VanDerWaalsContact O-NZ 3.09Å; L17-K112 HydrophobicContact CD1-CB 4.41Å; L17-K112 HydrophobicContact CD1-CG 3.77Å; L17-K112 HydrophobicContact CD2-CB 4.25Å; L17-K112 HydrophobicContact CD2-CG 4.2Å; L17-K112 HydrophobicContact CG-CB 4.48Å; L17-K112 HydrophobicContact CG-CG 3.89Å; I108-K112 WeakPolarHBondContact O-CG 2.83Å; I108-K112 PolarHBondContact O-N 3.45Å; E109-K112 WeakPolarHBondContact O-CB 3.26Å; E109-K112 PolarHBondContact O-N 3.46Å; E109-K112 WeakPolarHBondContact OE1-CD 3.39Å; E109-K112 WeakPolarHBondContact OE1-CE 3.4Å; E109-K112 IonicContact OE1-NZ 3.65Å; E109-K112 PolarHBondContact OE1-NZ 2.86Å; K112-K114 VanDerWaalsContact C-N 3.29Å; K112-K114 PolarHBondContact O-N 3.16Å; K112-N115 WeakPolarHBondContact O-CB 3.02Å; K112-N115 PolarHBondContact O-N 2.97Å; K112-F116 HydrophobicContact CB-CE2 3.95Å; K112-F116 HydrophobicContact CB-CZ 4.47Å; K112-F116 VanDerWaalsContact O-CD2 3.24Å; K112-F116 WeakPolarHBondContact O-CD2 3.46Å; K112-F116 WeakPolarHBondContact O-CG 3.25Å; K112-F116 PolarHBondContact O-N 2.92Å
113	L	97.5	Very high	95.9	Very high	24 Å²	24	61.4 Å²	61.4	13%	0.126	30%	0.298	C	S	.	.	H	α-helix	trans	-54.5	-47	177.4	177	55.1	0	0	0	111.6	I79 S82 Q83 V86 E109 Q110 N115 F116 Q117	I79-L113 HydrophobicContact CB-CD1 4.49Å; I79-L113 HydrophobicContact CG2-CD1 3.93Å; S82-L113 WeakPolarHBondContact OG-CB 3.21Å; S82-L113 PolarHBondContact OG-N 3.12Å; Q83-L113 HydrophobicContact CG-CD1 3.65Å; Q83-L113 HydrophobicContact CG-CD2 3.89Å; Q83-L113 HydrophobicContact CG-CG 4.45Å; V86-L113 HydrophobicContact CG2-CD2 4.38Å; E109-L113 PolarHBondContact O-N 3.31Å; Q110-L113 PolarHBondContact O-N 3.46Å; L113-N115 VanDerWaalsContact C-N 3.33Å; L113-N115 PolarHBondContact O-N 3.24Å; L113-F116 PolarHBondContact O-N 3.02Å; L113-Q117 HydrophobicContact CD1-CG 4.22Å; L113-Q117 WeakPolarHBondContact O-CG 3.27Å; L113-Q117 PolarHBondContact O-N 3.03Å
114	K	97.5	Very high	96.1	Very high	140 Å²	140	64.4 Å²	64.4	61%	0.609	31%	0.311	S	S	*	.	H	α-helix	trans	-59.4	-43.8	176.7	-176.4	-178.8	176.9	-177	0	111.7	Q110 S111 K112 Q117 T118	Q110-K114 PolarHBondContact O-N 3.03Å; S111-K114 PolarHBondContact O-N 3.36Å; K112-K114 VanDerWaalsContact C-N 3.29Å; K112-K114 PolarHBondContact O-N 3.16Å; K114-Q117 PolarHBondContact O-N 3.42Å; K114-T118 PolarHBondContact O-N 2.84Å; K114-T118 PolarHBondContact O-OG1 3.39Å
115	N	96.4	Very high	96.1	Very high	77 Å²	77	61.8 Å²	61.8	41%	0.412	31%	0.306	S	S	.	.	H	α-helix	trans	-62.1	-44	177.4	-78.8	-77.4	0	0	0	111.7	L17 S111 K112 L113 Q117 T118 E119	L17-N115 HydrophobicContact CD2-CB 4.1Å; S111-N115 PolarHBondContact O-N 3.09Å; S111-N115 PolarHBondContact O-ND2 2.88Å; K112-N115 WeakPolarHBondContact O-CB 3.02Å; K112-N115 PolarHBondContact O-N 2.97Å; L113-N115 VanDerWaalsContact C-N 3.33Å; L113-N115 PolarHBondContact O-N 3.24Å; N115-Q117 VanDerWaalsContact C-N 3.35Å; N115-Q117 PolarHBondContact O-N 3.48Å; N115-T118 WeakPolarHBondContact O-CB 3.24Å; N115-T118 PolarHBondContact O-N 3.47Å; N115-E119 PolarHBondContact O-N 2.72Å
116	F	97.4	Very high	96	Very high	1 Å²	1	59.1 Å²	59.1	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-64.2	-38.3	177.1	-59.2	-44.6	0	0	0	112.7	C14 L17 F20 I75 C78 I79 K112 L113 E119 L120	C14-F116 HydrophobicContact CB-CZ 4.32Å; C14-F116 WeakPolarHBondContact O-CZ 3.46Å; L17-F116 HydrophobicContact CD2-CD1 4.17Å; L17-F116 HydrophobicContact CD2-CE1 3.46Å; L17-F116 VanDerWaalsContact CD2-CE1 3.46Å; L17-F116 HydrophobicContact CD2-CE2 4.37Å; L17-F116 HydrophobicContact CD2-CZ 3.57Å; F20-F116 HydrophobicContact CB-CE1 4.45Å; F20-F116 AromaticContact CD1-CD1 3.97Å; F20-F116 HydrophobicContact CD1-CD1 3.97Å; F20-F116 AromaticContact CD1-CE1 3.69Å; F20-F116 HydrophobicContact CD1-CE1 3.69Å; F20-F116 HydrophobicContact CD2-CD1 4.44Å; F20-F116 AromaticContact CD2-CE1 3.99Å; F20-F116 HydrophobicContact CD2-CE1 3.99Å; F20-F116 AromaticContact CE1-CD1 3.58Å; F20-F116 HydrophobicContact CE1-CD1 3.58Å; F20-F116 AromaticContact CE1-CE1 3.81Å; F20-F116 HydrophobicContact CE1-CE1 3.81Å; F20-F116 HydrophobicContact CE2-CD1 4.08Å; F20-F116 HydrophobicContact CE2-CE1 4.08Å; F20-F116 HydrophobicContact CG-CD1 4.38Å; F20-F116 AromaticContact CG-CE1 3.78Å; F20-F116 HydrophobicContact CG-CE1 3.78Å; F20-F116 AromaticContact CZ-CD1 3.63Å; F20-F116 HydrophobicContact CZ-CD1 3.63Å; F20-F116 AromaticContact CZ-CE1 3.99Å; F20-F116 HydrophobicContact CZ-CE1 3.99Å; I75-F116 WeakPolarHBondContact CG2-O 3.46Å; C78-F116 HydrophobicContact CB-CD1 3.97Å; C78-F116 HydrophobicContact CB-CD2 3.96Å; C78-F116 HydrophobicContact CB-CE1 3.99Å; C78-F116 HydrophobicContact CB-CE2 3.99Å; C78-F116 HydrophobicContact CB-CG 3.97Å; C78-F116 HydrophobicContact CB-CZ 4.01Å; I79-F116 HydrophobicContact CD1-CB 4.49Å; I79-F116 HydrophobicContact CG1-CB 3.55Å; K112-F116 HydrophobicContact CB-CE2 3.95Å; K112-F116 HydrophobicContact CB-CZ 4.47Å; K112-F116 VanDerWaalsContact O-CD2 3.24Å; K112-F116 WeakPolarHBondContact O-CD2 3.46Å; K112-F116 WeakPolarHBondContact O-CG 3.25Å; K112-F116 PolarHBondContact O-N 2.92Å; L113-F116 PolarHBondContact O-N 3.02Å; F116-E119 WeakPolarHBondContact O-CB 3.43Å; F116-E119 PolarHBondContact O-N 2.75Å; F116-L120 PolarHBondContact O-N 3.43Å
117	Q	97.8	Very high	95.8	Very high	81 Å²	81	60.6 Å²	60.6	38%	0.379	30%	0.301	S	S	.	.	H	α-helix	trans	-65	-42	173.8	-71.4	173.1	-24.7	0	0	112	I79 L113 K114 N115 E119 L120 N121	I79-Q117 HydrophobicContact CD1-CG 4.24Å; I79-Q117 HydrophobicContact CG1-CG 4.38Å; L113-Q117 HydrophobicContact CD1-CG 4.22Å; L113-Q117 WeakPolarHBondContact O-CG 3.27Å; L113-Q117 PolarHBondContact O-N 3.03Å; K114-Q117 PolarHBondContact O-N 3.42Å; N115-Q117 VanDerWaalsContact C-N 3.35Å; N115-Q117 PolarHBondContact O-N 3.48Å; Q117-E119 VanDerWaalsContact C-N 3.28Å; Q117-E119 PolarHBondContact O-N 2.96Å; Q117-L120 PolarHBondContact O-N 2.95Å; Q117-N121 PolarHBondContact O-N 2.69Å; Q117-N121 VanDerWaalsContact O-N 3.15Å; Q117-N121 PolarHBondContact O-ND2 3.29Å
118	T	97.5	Very high	95.7	Very high	64 Å²	64	56.8 Å²	56.8	39%	0.393	29%	0.292	S	S	.	.	H	α-helix	trans	-59.9	-41.9	172.1	-66.8	0	0	0	0	111	K114 N115 L120 N121 I122	K114-T118 PolarHBondContact O-N 2.84Å; K114-T118 PolarHBondContact O-OG1 3.39Å; N115-T118 WeakPolarHBondContact O-CB 3.24Å; N115-T118 PolarHBondContact O-N 3.47Å; T118-L120 VanDerWaalsContact C-N 3.31Å; T118-L120 PolarHBondContact O-N 3.43Å; T118-N121 WeakPolarHBondContact O-CB 3.31Å; T118-N121 PolarHBondContact O-N 2.93Å; T118-I122 HydrophobicContact CG2-CD1 3.95Å; T118-I122 HydrophobicContact CG2-CG1 4.49Å; T118-I122 WeakPolarHBondContact O-CG1 3.41Å; T118-I122 PolarHBondContact O-N 3.09Å
119	E	96.1	Very high	95.4	Very high	27 Å²	27	58.2 Å²	58.2	13%	0.126	30%	0.297	C	S	.	.	H	α-helix	trans	-63.3	-37.2	178.3	-162.4	63.5	-157.3	0	0	112.5	F20 I24 R28 I75 N115 F116 Q117 I122 E123	F20-E119 HydrophobicContact CE1-CB 4.19Å; F20-E119 HydrophobicContact CE1-CG 3.84Å; F20-E119 HydrophobicContact CZ-CB 4.44Å; F20-E119 HydrophobicContact CZ-CG 4.08Å; I24-E119 HydrophobicContact CG2-CG 4.32Å; I24-E119 WeakPolarHBondContact CG2-OE1 3.25Å; R28-E119 IonicContact CZ-OE1 3.76Å; R28-E119 IonicContact NH1-OE1 2.75Å; R28-E119 PolarHBondContact NH1-OE1 3.47Å; R28-E119 IonicContact NH2-OE1 3.3Å; R28-E119 PolarHBondContact NH2-OE1 2.88Å; I75-E119 HydrophobicContact CD1-CG 3.95Å; I75-E119 HydrophobicContact CG1-CG 4.11Å; I75-E119 HydrophobicContact CG2-CB 4.35Å; N115-E119 PolarHBondContact O-N 2.72Å; F116-E119 WeakPolarHBondContact O-CB 3.43Å; F116-E119 PolarHBondContact O-N 2.75Å; Q117-E119 VanDerWaalsContact C-N 3.28Å; Q117-E119 PolarHBondContact O-N 2.96Å; E119-I122 PolarHBondContact O-N 3.33Å; E119-E123 PolarHBondContact O-N 3.37Å
120	L	97.1	Very high	95	Very high	28 Å²	28	57.8 Å²	57.8	15%	0.147	30%	0.296	C	S	.	.	H	α-helix	trans	-62.6	-45.7	174.7	-173.8	62.9	0	0	0	111.2	I75 R76 I79 F116 Q117 T118 I122 E123 E124	I75-L120 HydrophobicContact CG2-CB 3.73Å; I75-L120 HydrophobicContact CG2-CD1 4.15Å; R76-L120 HydrophobicContact CG-CD1 4.34Å; I79-L120 HydrophobicContact CD1-CB 4.04Å; I79-L120 HydrophobicContact CD1-CD2 3.82Å; F116-L120 PolarHBondContact O-N 3.43Å; Q117-L120 PolarHBondContact O-N 2.95Å; T118-L120 VanDerWaalsContact C-N 3.31Å; T118-L120 PolarHBondContact O-N 3.43Å; L120-I122 VanDerWaalsContact C-N 3.29Å; L120-I122 PolarHBondContact O-N 3.31Å; L120-E123 PolarHBondContact O-N 3.45Å; L120-E123 VanDerWaalsContact O-N 3.16Å; L120-E124 WeakPolarHBondContact O-CG 3.4Å; L120-E124 PolarHBondContact O-N 3.46Å
121	N	96.9	Very high	94.5	Very high	92 Å²	92	55.9 Å²	55.9	49%	0.492	29%	0.285	S	S	.	.	H	α-helix	trans	-61.3	-39.6	176.4	-62.8	-26.8	0	0	0	111.5	Q117 T118 E124 V125	Q117-N121 PolarHBondContact O-N 2.69Å; Q117-N121 VanDerWaalsContact O-N 3.15Å; Q117-N121 PolarHBondContact O-ND2 3.29Å; T118-N121 WeakPolarHBondContact O-CB 3.31Å; T118-N121 PolarHBondContact O-N 2.93Å; N121-E124 PolarHBondContact O-N 3.02Å; N121-V125 WeakPolarHBondContact O-CG2 3.32Å; N121-V125 PolarHBondContact O-N 3.04Å
122	I	95.6	Very high	94.1	Very high	65 Å²	65	57.5 Å²	57.5	33%	0.333	28%	0.284	S	S	.	.	H	α-helix	trans	-63.1	-43.8	175.6	-67.7	165.9	0	0	0	110.4	T118 E119 L120 E124 V125 I126	T118-I122 HydrophobicContact CG2-CD1 3.95Å; T118-I122 HydrophobicContact CG2-CG1 4.49Å; T118-I122 WeakPolarHBondContact O-CG1 3.41Å; T118-I122 PolarHBondContact O-N 3.09Å; E119-I122 PolarHBondContact O-N 3.33Å; L120-I122 VanDerWaalsContact C-N 3.29Å; L120-I122 PolarHBondContact O-N 3.31Å; I122-E124 VanDerWaalsContact C-N 3.34Å; I122-E124 PolarHBondContact O-N 3.2Å; I122-V125 PolarHBondContact O-N 3.1Å; I122-I126 HydrophobicContact CG2-CD1 3.73Å; I122-I126 HydrophobicContact CG2-CG1 4.37Å; I122-I126 WeakPolarHBondContact O-CG1 3.05Å; I122-I126 PolarHBondContact O-N 2.97Å
123	E	95.1	Very high	93.4	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.5	-39.7	178.8	-174.6	58	-148.1	0	0	112.4	R28 H68 R71 Q72 I75 E119 L120 V125 I126 Q127	R28-E123 IonicContact NE-OE2 3.95Å; R28-E123 IonicContact NH2-OE2 3.46Å; H68-E123 IonicContact CE1-OE1 3.64Å; H68-E123 IonicContact CG-OE1 2.79Å; H68-E123 IonicContact ND1-OE1 3.8Å; H68-E123 PolarHBondContact ND1-OE1 2.92Å; R71-E123 HydrophobicContact CB-CG 4.46Å; R71-E123 IonicContact CZ-OE1 3.01Å; R71-E123 VanDerWaalsContact CZ-OE1 3.3Å; R71-E123 IonicContact CZ-OE2 2.62Å; R71-E123 VanDerWaalsContact NE-CD 3.27Å; R71-E123 IonicContact NE-OE1 3.38Å; R71-E123 PolarHBondContact NE-OE1 3.33Å; R71-E123 IonicContact NE-OE2 2.72Å; R71-E123 PolarHBondContact NE-OE2 3.42Å; R71-E123 IonicContact NH2-OE1 2.64Å; R71-E123 PolarHBondContact NH2-OE1 2.9Å; R71-E123 IonicContact NH2-OE2 3.54Å; Q72-E123 HydrophobicContact CG-CG 3.71Å; I75-E123 HydrophobicContact CD1-CB 3.82Å; I75-E123 HydrophobicContact CD1-CG 4.16Å; E119-E123 PolarHBondContact O-N 3.37Å; L120-E123 PolarHBondContact O-N 3.45Å; L120-E123 VanDerWaalsContact O-N 3.16Å; E123-V125 PolarHBondContact O-N 3.32Å; E123-I126 PolarHBondContact O-N 3.48Å; E123-Q127 VanDerWaalsContact O-CB 3.32Å; E123-Q127 WeakPolarHBondContact O-CB 3.05Å; E123-Q127 PolarHBondContact O-N 2.02Å
124	E	94.9	Very high	92.5	Very high	94 Å²	94	60.9 Å²	60.9	44%	0.439	30%	0.3	S	S	.	.	H	α-helix	trans	-61.4	-42.4	174.8	-71.1	178.4	177.9	0	0	112.1	L120 N121 I122 Q127 D128	L120-E124 WeakPolarHBondContact O-CG 3.4Å; L120-E124 PolarHBondContact O-N 3.46Å; N121-E124 PolarHBondContact O-N 3.02Å; I122-E124 VanDerWaalsContact C-N 3.34Å; I122-E124 PolarHBondContact O-N 3.2Å; E124-Q127 PolarHBondContact O-N 2.86Å; E124-D128 PolarHBondContact O-N 3.26Å
125	V	94.5	Very high	91.8	Very high	79 Å²	79	58.6 Å²	58.6	48%	0.479	29%	0.292	S	S	.	.	H	α-helix	trans	-65	-44	177	173.5	0	0	0	0	111.3	N121 I122 E123 Q127 D128 Q129	N121-V125 WeakPolarHBondContact O-CG2 3.32Å; N121-V125 PolarHBondContact O-N 3.04Å; I122-V125 PolarHBondContact O-N 3.1Å; E123-V125 PolarHBondContact O-N 3.32Å; V125-Q127 VanDerWaalsContact C-N 3.34Å; V125-D128 PolarHBondContact O-N 3.13Å; V125-Q129 VanDerWaalsContact O-CG 3.31Å; V125-Q129 WeakPolarHBondContact O-CG 3.39Å; V125-Q129 PolarHBondContact O-N 3.48Å
126	I	91.7	Very high	91.1	Very high	31 Å²	31	62.5 Å²	62.5	16%	0.159	30%	0.301	C	S	.	.	H	α-helix	trans	-62.9	-44.3	177.9	-68.4	169.2	0	0	0	110.1	R28 D31 I122 E123 D128 Q129 S130	R28-I126 HydrophobicContact CG-CD1 4.42Å; D31-I126 HydrophobicContact CB-CG2 4Å; I122-I126 HydrophobicContact CG2-CD1 3.73Å; I122-I126 HydrophobicContact CG2-CG1 4.37Å; I122-I126 WeakPolarHBondContact O-CG1 3.05Å; I122-I126 PolarHBondContact O-N 2.97Å; E123-I126 PolarHBondContact O-N 3.48Å; I126-D128 PolarHBondContact O-N 3.18Å; I126-Q129 PolarHBondContact O-N 3.5Å; I126-S130 WeakPolarHBondContact O-CB 3.06Å; I126-S130 PolarHBondContact O-N 3.07Å; I126-S130 PolarHBondContact O-OG 3.47Å
127	Q	91.7	Very high	90	Very high	34 Å²	34	64.3 Å²	64.3	16%	0.159	31%	0.308	C	S	.	.	H	α-helix	trans	-59.2	-47.8	177.7	-177.4	174.2	46	0	0	112.3	H68 E123 E124 V125 Q129 S130 Y131	H68-Q127 HydrophobicContact CB-CG 4.44Å; H68-Q127 VanDerWaalsContact CE1-CA 3.45Å; H68-Q127 WeakPolarHBondContact CE1-CA 3.44Å; E123-Q127 VanDerWaalsContact O-CB 3.32Å; E123-Q127 WeakPolarHBondContact O-CB 3.05Å; E123-Q127 PolarHBondContact O-N 2.02Å; E124-Q127 PolarHBondContact O-N 2.86Å; V125-Q127 VanDerWaalsContact C-N 3.34Å; Q127-Q129 VanDerWaalsContact C-N 3.33Å; Q127-Q129 PolarHBondContact O-N 3.05Å; Q127-S130 PolarHBondContact O-N 3.04Å; Q127-Y131 HydrophobicContact CG-CD2 3.76Å; Q127-Y131 HydrophobicContact CG-CE2 3.31Å; Q127-Y131 PolarHBondContact NE2-OH 3.13Å; Q127-Y131 VanDerWaalsContact NE2-OH 3.14Å; Q127-Y131 WeakPolarHBondContact O-CB 3.33Å; Q127-Y131 PolarHBondContact O-N 3.37Å
128	D	91.8	Very high	88.9	Confident	74 Å²	74	65.1 Å²	65.1	40%	0.396	31%	0.31	S	S	.	.	H	α-helix	trans	-60.1	-42.8	176.7	175.2	63.4	0	0	0	111.8	E124 V125 I126 Y131 K132	E124-D128 PolarHBondContact O-N 3.26Å; V125-D128 PolarHBondContact O-N 3.13Å; I126-D128 PolarHBondContact O-N 3.18Å; D128-Y131 PolarHBondContact O-N 3.09Å; D128-K132 WeakPolarHBondContact O-CB 3.33Å; D128-K132 VanDerWaalsContact O-CG 3.28Å; D128-K132 WeakPolarHBondContact O-CG 3.28Å; D128-K132 PolarHBondContact O-N 3.07Å; D128-K132 WeakPolarHBondContact OD1-CE 3.45Å; D128-K132 IonicContact OD1-NZ 3.8Å; D128-K132 PolarHBondContact OD1-NZ 2.8Å; D128-K132 VanDerWaalsContact OD2-CE 3.23Å; D128-K132 WeakPolarHBondContact OD2-CE 3.38Å; D128-K132 IonicContact OD2-NZ 3.02Å; D128-K132 PolarHBondContact OD2-NZ 3.03Å
129	Q	89.2	Confident	87.9	Confident	115 Å²	115	70.4 Å²	70.4	54%	0.537	32%	0.323	S	S	.	.	H	α-helix	trans	-63.1	-49.5	176.4	-72.4	179.1	5.4	0	0	112.2	V125 I126 Q127 Y131 K132 V133	V125-Q129 VanDerWaalsContact O-CG 3.31Å; V125-Q129 WeakPolarHBondContact O-CG 3.39Å; V125-Q129 PolarHBondContact O-N 3.48Å; I126-Q129 PolarHBondContact O-N 3.5Å; Q127-Q129 VanDerWaalsContact C-N 3.33Å; Q127-Q129 PolarHBondContact O-N 3.05Å; Q129-Y131 VanDerWaalsContact C-N 3.31Å; Q129-Y131 PolarHBondContact O-N 3.33Å; Q129-K132 PolarHBondContact O-N 3.35Å; Q129-V133 WeakPolarHBondContact O-CG2 3.28Å; Q129-V133 PolarHBondContact O-N 3.3Å
130	S	87.1	Confident	86.8	Confident	6 Å²	6	78.9 Å²	78.9	4%	0.042	35%	0.354	C	S	.	.	H	α-helix	trans	-59.7	-41.7	179.4	-67.9	0	0	0	0	111.2	D31 I126 Q127 V133 R134	D31-S130 PolarHBondContact OD1-OG 3.15Å; I126-S130 WeakPolarHBondContact O-CB 3.06Å; I126-S130 PolarHBondContact O-N 3.07Å; I126-S130 PolarHBondContact O-OG 3.47Å; Q127-S130 PolarHBondContact O-N 3.04Å; S130-V133 PolarHBondContact O-N 3Å; S130-R134 PolarHBondContact O-N 3.37Å; S130-R134 VanDerWaalsContact O-N 3.09Å
131	Y	87.1	Confident	85.4	Confident	48 Å²	48	78.7 Å²	78.7	19%	0.188	35%	0.353	C	S	.	.	H	α-helix	trans	-70.1	-36.9	176.9	-69.2	-18.7	0	0	0	113.8	Y61 L64 H68 Q127 D128 Q129 R134 E135	Y61-Y131 HydrophobicContact CD2-CE1 4.19Å; Y61-Y131 HydrophobicContact CE2-CD1 4.35Å; Y61-Y131 AromaticContact CE2-CE1 3.75Å; Y61-Y131 HydrophobicContact CE2-CE1 3.75Å; L64-Y131 HydrophobicContact CD2-CD1 3.72Å; L64-Y131 HydrophobicContact CD2-CE1 3.75Å; L64-Y131 HydrophobicContact CG-CE1 4.13Å; H68-Y131 AromaticContact CD2-CE1 4Å; H68-Y131 AromaticContact CD2-CZ 4Å; Q127-Y131 HydrophobicContact CG-CD2 3.76Å; Q127-Y131 HydrophobicContact CG-CE2 3.31Å; Q127-Y131 PolarHBondContact NE2-OH 3.13Å; Q127-Y131 VanDerWaalsContact NE2-OH 3.14Å; Q127-Y131 WeakPolarHBondContact O-CB 3.33Å; Q127-Y131 PolarHBondContact O-N 3.37Å; D128-Y131 PolarHBondContact O-N 3.09Å; Q129-Y131 VanDerWaalsContact C-N 3.31Å; Q129-Y131 PolarHBondContact O-N 3.33Å; Y131-R134 PolarHBondContact O-N 3.42Å; Y131-E135 WeakPolarHBondContact O-CB 3.47Å; Y131-E135 PolarHBondContact O-N 2.96Å
132	K	86.9	Confident	83.7	Confident	96 Å²	96	82.8 Å²	82.8	42%	0.417	37%	0.369	S	S	.	.	H	α-helix	trans	-62.2	-43.3	173.4	-80.5	170.5	176.5	166.5	0	112	D128 Q129 E135 R136	D128-K132 WeakPolarHBondContact O-CB 3.33Å; D128-K132 VanDerWaalsContact O-CG 3.28Å; D128-K132 WeakPolarHBondContact O-CG 3.28Å; D128-K132 PolarHBondContact O-N 3.07Å; D128-K132 WeakPolarHBondContact OD1-CE 3.45Å; D128-K132 IonicContact OD1-NZ 3.8Å; D128-K132 PolarHBondContact OD1-NZ 2.8Å; D128-K132 VanDerWaalsContact OD2-CE 3.23Å; D128-K132 WeakPolarHBondContact OD2-CE 3.38Å; D128-K132 IonicContact OD2-NZ 3.02Å; D128-K132 PolarHBondContact OD2-NZ 3.03Å; Q129-K132 PolarHBondContact O-N 3.35Å; K132-E135 PolarHBondContact O-N 3.47Å; K132-R136 WeakPolarHBondContact O-CB 3.44Å; K132-R136 VanDerWaalsContact O-CG 3.24Å; K132-R136 WeakPolarHBondContact O-CG 3.32Å; K132-R136 PolarHBondContact O-N 3.2Å
133	V	82.1	Confident	82	Confident	52 Å²	52	81.4 Å²	81.4	32%	0.315	37%	0.365	S	S	.	.	H	α-helix	trans	-61.9	-46	176.8	174.6	0	0	0	0	110.3	V35 I38 Q129 S130 R136 R137	V35-V133 HydrophobicContact CG2-CG1 4.21Å; I38-V133 HydrophobicContact CD1-CG1 3.74Å; Q129-V133 WeakPolarHBondContact O-CG2 3.28Å; Q129-V133 PolarHBondContact O-N 3.3Å; S130-V133 PolarHBondContact O-N 3Å; V133-R136 PolarHBondContact O-N 3.49Å; V133-R137 PolarHBondContact O-N 2.82Å; V133-R137 VanDerWaalsContact O-N 3.15Å
134	R	78.6	Confident	81.3	Confident	74 Å²	74	85.5 Å²	85.5	28%	0.279	38%	0.383	S	S	.	.	H	α-helix	trans	-58.3	-51.5	175.2	-179.9	-152.9	65.1	158.7	-0.4	111.7	I38 S130 Y131 R136 R137 F138	I38-R134 HydrophobicContact CD1-CB 4.49Å; S130-R134 PolarHBondContact O-N 3.37Å; S130-R134 VanDerWaalsContact O-N 3.09Å; Y131-R134 PolarHBondContact O-N 3.42Å; R134-R136 VanDerWaalsContact C-N 3.32Å; R134-R136 PolarHBondContact O-N 3.33Å; R134-R137 WeakPolarHBondContact O-CB 3.1Å; R134-R137 PolarHBondContact O-N 2.83Å; R134-F138 WeakPolarHBondContact O-CB 3.43Å; R134-F138 PolarHBondContact O-N 3.31Å
135	E	82.1	Confident	80.6	Confident	92 Å²	92	85.1 Å²	85.1	43%	0.43	38%	0.38	S	S	.	.	H	α-helix	trans	-60.9	-41.3	-177.2	-165.4	-160.5	151.6	0	0	111.8	Y131 K132 R137 F138 R139	Y131-E135 WeakPolarHBondContact O-CB 3.47Å; Y131-E135 PolarHBondContact O-N 2.96Å; K132-E135 PolarHBondContact O-N 3.47Å; E135-R137 VanDerWaalsContact C-N 3.28Å; E135-R137 PolarHBondContact O-N 3.02Å; E135-F138 WeakPolarHBondContact O-CB 3.44Å; E135-F138 PolarHBondContact O-N 3.11Å; E135-R139 PolarHBondContact O-N 3.44Å; E135-R139 IonicContact OE1-CZ 2.69Å; E135-R139 IonicContact OE1-NH2 3.86Å; E135-R139 PolarHBondContact OE1-NH2 2.83Å
136	R	81.3	Confident	79.9	Confident	160 Å²	160	85.4 Å²	85.4	60%	0.604	38%	0.375	S	S	*	.	H	α-helix	trans	-60.6	-37.2	174.2	-72.8	172.1	-179.3	-175.8	1	112.2	K132 V133 R134 R140	K132-R136 WeakPolarHBondContact O-CB 3.44Å; K132-R136 VanDerWaalsContact O-CG 3.24Å; K132-R136 WeakPolarHBondContact O-CG 3.32Å; K132-R136 PolarHBondContact O-N 3.2Å; V133-R136 PolarHBondContact O-N 3.49Å; R134-R136 VanDerWaalsContact C-N 3.32Å; R134-R136 PolarHBondContact O-N 3.33Å; R136-R140 WeakPolarHBondContact O-CG 3.19Å; R136-R140 PolarHBondContact O-N 2.88Å
137	R	74.8	Confident	79.2	Confident	39 Å²	39	88.6 Å²	88.6	15%	0.147	39%	0.387	C	S	.	.	H	α-helix	trans	-73.4	-41.8	176.7	-168.6	81.5	175	164.9	2.8	112	I38 I42 V133 R134 E135 R139 R140 N141	I38-R137 HydrophobicContact CG2-CB 3.89Å; I38-R137 VanDerWaalsContact CG2-CD 3.48Å; I38-R137 HydrophobicContact CG2-CG 3.47Å; I38-R137 VanDerWaalsContact CG2-CG 3.47Å; I42-R137 HydrophobicContact CD1-CG 3.97Å; I42-R137 PolarHBondContact O-NH2 3.16Å; V133-R137 PolarHBondContact O-N 2.82Å; V133-R137 VanDerWaalsContact O-N 3.15Å; R134-R137 WeakPolarHBondContact O-CB 3.1Å; R134-R137 PolarHBondContact O-N 2.83Å; E135-R137 VanDerWaalsContact C-N 3.28Å; E135-R137 PolarHBondContact O-N 3.02Å; R137-R139 PolarHBondContact O-N 2.8Å; R137-R140 PolarHBondContact O-N 3.02Å; R137-R140 VanDerWaalsContact O-N 3.07Å; R137-N141 VanDerWaalsContact CD-ND2 3.31Å; R137-N141 WeakPolarHBondContact CD-ND2 3.47Å; R137-N141 WeakPolarHBondContact CG-ND2 2.94Å; R137-N141 PolarHBondContact NE-ND2 2.96Å; R137-N141 VanDerWaalsContact NE-ND2 3.11Å; R137-N141 PolarHBondContact O-N 2.88Å; R137-N141 PolarHBondContact O-ND2 3.01Å; R137-N141 VanDerWaalsContact O-ND2 3.07Å
138	F	74.1	Confident	78.4	Confident	98 Å²	98	92 Å²	92	43%	0.43	40%	0.402	S	S	.	.	H	α-helix	trans	-53.5	-55.1	178.2	-166.2	-93.1	0	0	0	109.9	R134 E135 R140 N141 Q142 C143	R134-F138 WeakPolarHBondContact O-CB 3.43Å; R134-F138 PolarHBondContact O-N 3.31Å; E135-F138 WeakPolarHBondContact O-CB 3.44Å; E135-F138 PolarHBondContact O-N 3.11Å; F138-R140 PolarHBondContact O-N 3.04Å; F138-R140 VanDerWaalsContact O-N 3.09Å; F138-N141 PolarHBondContact O-N 3.06Å; F138-Q142 PolarHBondContact O-N 2.96Å; F138-Q142 VanDerWaalsContact O-N 3.13Å; F138-C143 HydrophobicContact CB-CB 4.4Å; F138-C143 WeakPolarHBondContact CD1-OXT 3.47Å; F138-C143 HydrophobicContact CD2-CB 3.11Å; F138-C143 VanDerWaalsContact CE1-O 3.28Å; F138-C143 WeakPolarHBondContact CE1-O 3.39Å; F138-C143 WeakPolarHBondContact CE1-OXT 3.19Å; F138-C143 HydrophobicContact CE2-CB 3.34Å; F138-C143 VanDerWaalsContact CE2-O 3.26Å; F138-C143 WeakPolarHBondContact CE2-O 3.13Å; F138-C143 HydrophobicContact CG-CB 3.79Å; F138-C143 WeakPolarHBondContact CG-OXT 3.43Å; F138-C143 HydrophobicContact CZ-CB 4.18Å; F138-C143 WeakPolarHBondContact CZ-O 3.41Å; F138-C143 WeakPolarHBondContact CZ-OXT 3.46Å; F138-C143 VanDerWaalsContact O-OXT 3.14Å
139	R	77.7	Confident	77.5	Confident	175 Å²	175	93.2 Å²	93.2	66%	0.66	40%	0.402	S	S	*	.	H	α-helix	trans	-56.8	-30.6	176.5	-161.3	-176	-57.2	143.7	2.7	114.3	E135 R137	E135-R139 PolarHBondContact O-N 3.44Å; E135-R139 IonicContact OE1-CZ 2.69Å; E135-R139 IonicContact OE1-NH2 3.86Å; E135-R139 PolarHBondContact OE1-NH2 2.83Å; R137-R139 PolarHBondContact O-N 2.8Å
140	R	73.1	Confident	76.6	Confident	204 Å²	204	91.6 Å²	91.6	77%	0.77	39%	0.392	S	S	*	.	H	α-helix	trans	-83	-34.5	-179.6	-77	179.8	179.7	-169.8	0.7	113.8	R136 R137 F138	R136-R140 WeakPolarHBondContact O-CG 3.19Å; R136-R140 PolarHBondContact O-N 2.88Å; R137-R140 PolarHBondContact O-N 3.02Å; R137-R140 VanDerWaalsContact O-N 3.07Å; F138-R140 PolarHBondContact O-N 3.04Å; F138-R140 VanDerWaalsContact O-N 3.09Å
141	N	66.7	Low	75.8	Confident	25 Å²	25	98.2 Å²	98.2	13%	0.134	42%	0.419	C	S	.	.	H	α-helix	trans	-108.8	4.6	-169.8	-65.3	-86.3	0	0	0	113.9	I42 R137 F138 C143	I42-N141 HydrophobicContact CG2-CB 3.84Å; R137-N141 VanDerWaalsContact CD-ND2 3.31Å; R137-N141 WeakPolarHBondContact CD-ND2 3.47Å; R137-N141 WeakPolarHBondContact CG-ND2 2.94Å; R137-N141 PolarHBondContact NE-ND2 2.96Å; R137-N141 VanDerWaalsContact NE-ND2 3.11Å; R137-N141 PolarHBondContact O-N 2.88Å; R137-N141 PolarHBondContact O-ND2 3.01Å; R137-N141 VanDerWaalsContact O-ND2 3.07Å; F138-N141 PolarHBondContact O-N 3.06Å; N141-C143 PolarHBondContact O-N 3.05Å
142	Q	61.7	Low	74.9	Confident	178 Å²	178	102.4 Å²	102.4	83%	0.832	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	41.8	-173.7	-58.4	177.3	35.4	0	0	111.8	F138	F138-Q142 PolarHBondContact O-N 2.96Å; F138-Q142 VanDerWaalsContact O-N 3.13Å
143	C	59.7	Low	73.8	Confident	36 Å²	36	103 Å²	103	24%	0.243	44%	0.44	C	S	.	.			trans	-67.6	0	135.3	-59	0	0	0	0	104.8	V53 C57 F138 N141	V53-C143 WeakPolarHBondContact CG1-SG 3.31Å; C57-C143 HydrophobicContact CB-CB 3.63Å; C57-C143 WeakPolarHBondContact CB-SG 3.36Å; C57-C143 WeakPolarHBondContact SG-CB 3.32Å; C57-C143 CovalentContact SG-SG 2.02Å; C57-C143 PolarHBondContact SG-SG 3.09Å; F138-C143 HydrophobicContact CB-CB 4.4Å; F138-C143 WeakPolarHBondContact CD1-OXT 3.47Å; F138-C143 HydrophobicContact CD2-CB 3.11Å; F138-C143 VanDerWaalsContact CE1-O 3.28Å; F138-C143 WeakPolarHBondContact CE1-O 3.39Å; F138-C143 WeakPolarHBondContact CE1-OXT 3.19Å; F138-C143 HydrophobicContact CE2-CB 3.34Å; F138-C143 VanDerWaalsContact CE2-O 3.26Å; F138-C143 WeakPolarHBondContact CE2-O 3.13Å; F138-C143 HydrophobicContact CG-CB 3.79Å; F138-C143 WeakPolarHBondContact CG-OXT 3.43Å; F138-C143 HydrophobicContact CZ-CB 4.18Å; F138-C143 WeakPolarHBondContact CZ-O 3.41Å; F138-C143 WeakPolarHBondContact CZ-OXT 3.46Å; F138-C143 VanDerWaalsContact O-OXT 3.14Å; N141-C143 PolarHBondContact O-N 3.05Å

Retrieved 143 of 143 residues in 48.6 ms (Link to these results)

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