A0A096MCH3_POEFO Loading...

Inhibitor of growth protein

Component of an histone acetyltransferase complex.

AlphaFold DB , UniProt , Accession A0A096MCH3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 418 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.8	Low	69	Low	189 Å²	189	106.8 Å²	106.8	93%	0.931	51%	0.514	S	S	*	.				0	-65.3	0	-62	-79.8	-89.8	0	0	107.7	Y3 L4	M1-Y3 VanDerWaalsContact C-N 3.3Å; M1-Y3 PolarHBondContact O-N 3Å; M1-L4 WeakPolarHBondContact O-CB 3.48Å; M1-L4 PolarHBondContact O-N 3.32Å
2	L	59.3	Low	70.2	Confident	124 Å²	124	110.9 Å²	110.9	65%	0.649	53%	0.532	S	S	*	.	H	α-helix	trans	-29.7	-51.9	175.4	-64	171.2	0	0	0	116.6	L4 E5 D6	L2-L4 PolarHBondContact O-N 3.08Å; L2-L4 VanDerWaalsContact O-N 3.16Å; L2-E5 VanDerWaalsContact CA-OE2 3.26Å; L2-E5 WeakPolarHBondContact CA-OE2 3.48Å; L2-E5 PolarHBondContact N-OE2 3.29Å; L2-E5 CarbonylContact O-C 3.57Å; L2-E5 WeakPolarHBondContact O-CA 3.38Å; L2-E5 WeakPolarHBondContact O-CB 3.46Å; L2-E5 PolarHBondContact O-N 3.1Å; L2-D6 PolarHBondContact O-N 3.13Å
3	Y	62.8	Low	71	Confident	111 Å²	111	109.1 Å²	109.1	44%	0.435	52%	0.522	S	S	.	.	H	α-helix	trans	-56.9	-31.6	179.9	-48.1	-81.4	0	0	0	115	M1 Y7 F104 E107	M1-Y3 VanDerWaalsContact C-N 3.3Å; M1-Y3 PolarHBondContact O-N 3Å; Y3-Y7 WeakPolarHBondContact O-CB 3.29Å; Y3-Y7 PolarHBondContact O-N 3.29Å; Y3-Y7 VanDerWaalsContact O-N 3.17Å; Y3-F104 HydrophobicContact CG-CD2 4.48Å; Y3-E107 WeakPolarHBondContact CE1-OE1 3.25Å; Y3-E107 VanDerWaalsContact CE1-OE2 3.32Å; Y3-E107 WeakPolarHBondContact CE1-OE2 3.19Å; Y3-E107 PolarHBondContact OH-OE1 3.46Å
4	L	66.2	Low	71.9	Confident	114 Å²	114	103.2 Å²	103.2	60%	0.597	50%	0.495	S	S	*	.	H	α-helix	trans	-77.4	-29.6	174.6	-164.4	75.4	0	0	0	111.1	M1 L2 L8	M1-L4 WeakPolarHBondContact O-CB 3.48Å; M1-L4 PolarHBondContact O-N 3.32Å; L2-L4 PolarHBondContact O-N 3.08Å; L2-L4 VanDerWaalsContact O-N 3.16Å; L4-L8 HydrophobicContact CD2-CD1 4.4Å; L4-L8 HydrophobicContact CG-CD1 4.06Å; L4-L8 HydrophobicContact CG-CG 4.49Å; L4-L8 VanDerWaalsContact O-CB 3.26Å; L4-L8 WeakPolarHBondContact O-CB 3.32Å; L4-L8 WeakPolarHBondContact O-CD1 3.48Å; L4-L8 WeakPolarHBondContact O-CG 3.11Å; L4-L8 PolarHBondContact O-N 3.39Å
5	E	70.6	Confident	73.1	Confident	109 Å²	109	100.3 Å²	100.3	51%	0.509	49%	0.488	S	S	.	.	H	α-helix	trans	-72.3	-48.9	177.5	-64.7	162.1	117.7	0	0	109.6	L2 Y7 L8 E9	L2-E5 VanDerWaalsContact CA-OE2 3.26Å; L2-E5 WeakPolarHBondContact CA-OE2 3.48Å; L2-E5 PolarHBondContact N-OE2 3.29Å; L2-E5 CarbonylContact O-C 3.57Å; L2-E5 WeakPolarHBondContact O-CA 3.38Å; L2-E5 WeakPolarHBondContact O-CB 3.46Å; L2-E5 PolarHBondContact O-N 3.1Å; E5-Y7 VanDerWaalsContact C-N 3.34Å; E5-Y7 PolarHBondContact O-N 3.3Å; E5-L8 PolarHBondContact O-N 3.49Å; E5-E9 WeakPolarHBondContact O-CB 3.3Å; E5-E9 PolarHBondContact O-N 3.27Å
6	D	69.6	Low	74.1	Confident	87 Å²	87	99.1 Å²	99.1	47%	0.465	48%	0.482	S	S	.	.	H	α-helix	trans	-56	-44.2	171.6	-76.9	5.9	0	0	0	112	L2 M10	L2-D6 PolarHBondContact O-N 3.13Å; D6-M10 WeakPolarHBondContact O-CB 3.41Å; D6-M10 PolarHBondContact O-N 3.08Å
7	Y	73.5	Confident	74.9	Confident	107 Å²	107	96.2 Å²	96.2	42%	0.42	47%	0.47	S	S	.	.	H	α-helix	trans	-66.5	-40.9	179.1	-178.9	-90.5	0	0	0	112.4	Y3 E5 I11 L97	Y3-Y7 WeakPolarHBondContact O-CB 3.29Å; Y3-Y7 PolarHBondContact O-N 3.29Å; Y3-Y7 VanDerWaalsContact O-N 3.17Å; E5-Y7 VanDerWaalsContact C-N 3.34Å; E5-Y7 PolarHBondContact O-N 3.3Å; Y7-I11 HydrophobicContact CD1-CD1 3.97Å; Y7-I11 HydrophobicContact CE1-CD1 3.38Å; Y7-I11 HydrophobicContact CE2-CD1 4.22Å; Y7-I11 WeakPolarHBondContact O-CG1 3.42Å; Y7-I11 PolarHBondContact O-N 2.93Å; Y7-L97 HydrophobicContact CD2-CD2 3.93Å; Y7-L97 HydrophobicContact CE2-CD2 3.45Å; Y7-L97 VanDerWaalsContact CE2-CD2 3.45Å
8	L	76	Confident	75.8	Confident	97 Å²	97	92.8 Å²	92.8	51%	0.508	45%	0.454	S	S	.	.	H	α-helix	trans	-70.2	-44.5	177.1	-74.6	168.9	0	0	0	111.4	L4 E5 M10 I11 E12	L4-L8 HydrophobicContact CD2-CD1 4.4Å; L4-L8 HydrophobicContact CG-CD1 4.06Å; L4-L8 HydrophobicContact CG-CG 4.49Å; L4-L8 VanDerWaalsContact O-CB 3.26Å; L4-L8 WeakPolarHBondContact O-CB 3.32Å; L4-L8 WeakPolarHBondContact O-CD1 3.48Å; L4-L8 WeakPolarHBondContact O-CG 3.11Å; L4-L8 PolarHBondContact O-N 3.39Å; E5-L8 PolarHBondContact O-N 3.49Å; L8-M10 VanDerWaalsContact C-N 3.27Å; L8-M10 PolarHBondContact O-N 3.17Å; L8-I11 CarbonylContact O-C 3.59Å; L8-I11 PolarHBondContact O-N 3.02Å; L8-E12 WeakPolarHBondContact O-CB 3.21Å; L8-E12 PolarHBondContact O-N 3.41Å
9	E	76.6	Confident	76.8	Confident	146 Å²	146	95.3 Å²	95.3	68%	0.682	46%	0.458	S	S	*	.	H	α-helix	trans	-59.9	-37.6	176.6	-173.1	172.4	-175.9	0	0	111.4	E5 I11	E5-E9 WeakPolarHBondContact O-CB 3.3Å; E5-E9 PolarHBondContact O-N 3.27Å; E9-I11 VanDerWaalsContact C-N 3.34Å; E9-I11 PolarHBondContact O-N 3.37Å
10	M	71.4	Confident	77.6	Confident	46 Å²	46	95.4 Å²	95.4	23%	0.227	46%	0.461	C	S	.	.	H	α-helix	trans	-71.8	-22.6	176	-171	165.3	68.3	0	0	114.3	D6 L8 K96 L97 E100	D6-M10 WeakPolarHBondContact O-CB 3.41Å; D6-M10 PolarHBondContact O-N 3.08Å; L8-M10 VanDerWaalsContact C-N 3.27Å; L8-M10 PolarHBondContact O-N 3.17Å; M10-K96 HydrophobicContact CE-CB 4.04Å; M10-K96 HydrophobicContact CG-CD 4.49Å; M10-K96 HydrophobicContact SD-CB 3.75Å; M10-K96 HydrophobicContact SD-CD 3.93Å; M10-K96 HydrophobicContact SD-CG 4.28Å; M10-L97 HydrophobicContact CE-CD2 3.87Å; M10-L97 HydrophobicContact CE-CG 4.38Å; M10-E100 HydrophobicContact CE-CB 4.2Å; M10-E100 HydrophobicContact CE-CG 3.8Å
11	I	79.8	Confident	78.4	Confident	45 Å²	45	95.1 Å²	95.1	23%	0.231	46%	0.455	C	S	.	.	H	α-helix	trans	-93.9	-32	176	-69.6	-179.6	0	0	0	112.2	Y7 L8 E9 Q13 L14 P15 L97	Y7-I11 HydrophobicContact CD1-CD1 3.97Å; Y7-I11 HydrophobicContact CE1-CD1 3.38Å; Y7-I11 HydrophobicContact CE2-CD1 4.22Å; Y7-I11 WeakPolarHBondContact O-CG1 3.42Å; Y7-I11 PolarHBondContact O-N 2.93Å; L8-I11 CarbonylContact O-C 3.59Å; L8-I11 PolarHBondContact O-N 3.02Å; E9-I11 VanDerWaalsContact C-N 3.34Å; E9-I11 PolarHBondContact O-N 3.37Å; I11-Q13 PolarHBondContact O-N 3.27Å; I11-Q13 VanDerWaalsContact O-N 3.08Å; I11-L14 WeakPolarHBondContact O-CB 3.46Å; I11-L14 PolarHBondContact O-N 2.75Å; I11-P15 WeakPolarHBondContact O-CD 3.17Å; I11-L97 HydrophobicContact CD1-CD1 4.45Å; I11-L97 HydrophobicContact CD1-CD2 3.75Å; I11-L97 HydrophobicContact CG1-CD2 3.82Å
12	E	83.3	Confident	80.4	Confident	156 Å²	156	91.4 Å²	91.4	73%	0.729	43%	0.434	S	S	*	.	H	α-helix	trans	-54	-37.3	-168.6	-176	165.9	-155.9	0	0	113.7	L8	L8-E12 WeakPolarHBondContact O-CB 3.21Å; L8-E12 PolarHBondContact O-N 3.41Å
13	Q	80.9	Confident	82.2	Confident	87 Å²	87	89.9 Å²	89.9	41%	0.407	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-31.4	178.2	-171.3	61	32.1	0	0	113.8	I11 M16 D17	I11-Q13 PolarHBondContact O-N 3.27Å; I11-Q13 VanDerWaalsContact O-N 3.08Å; Q13-M16 WeakPolarHBondContact O-CA 3.41Å; Q13-M16 WeakPolarHBondContact O-CB 3.38Å; Q13-M16 PolarHBondContact O-N 3.11Å; Q13-D17 PolarHBondContact NE2-OD1 3.46Å; Q13-D17 PolarHBondContact O-N 3.31Å
14	L	84.4	Confident	83.8	Confident	27 Å²	27	88.1 Å²	88.1	14%	0.141	43%	0.426	C	S	.	.	H	α-helix	trans	-59.9	-44.9	-172.3	173	67.5	0	0	0	113.3	I11 M16 D17 L18 L89 H93	I11-L14 WeakPolarHBondContact O-CB 3.46Å; I11-L14 PolarHBondContact O-N 2.75Å; L14-M16 PolarHBondContact O-N 3.25Å; L14-D17 PolarHBondContact O-N 3.02Å; L14-L18 HydrophobicContact CD1-CD1 3.76Å; L14-L18 HydrophobicContact CD1-CD2 4.48Å; L14-L18 HydrophobicContact CD1-CG 3.81Å; L14-L18 HydrophobicContact CG-CD1 3.86Å; L14-L18 HydrophobicContact CG-CG 4.33Å; L14-L18 WeakPolarHBondContact O-CB 3.14Å; L14-L18 WeakPolarHBondContact O-CG 3.48Å; L14-L18 PolarHBondContact O-N 2.87Å; L14-L89 HydrophobicContact CD1-CD2 4.36Å; L14-L89 HydrophobicContact CD1-CG 4.19Å; L14-H93 HydrophobicContact CD1-CB 4.27Å; L14-H93 HydrophobicContact CD2-CB 3.91Å
15	P	89.1	Confident	85.2	Confident	60 Å²	60	84.4 Å²	84.4	39%	0.39	41%	0.406	S	S	.	.	H	α-helix	trans	-60.7	-23.1	173	-26.6	35.3	0	0	0	114.5	I11 R19	I11-P15 WeakPolarHBondContact O-CD 3.17Å; P15-R19 VanDerWaalsContact O-CG 3.24Å; P15-R19 WeakPolarHBondContact O-CG 3.1Å; P15-R19 PolarHBondContact O-N 3.43Å; P15-R19 PolarHBondContact O-NE 3.05Å; P15-R19 PolarHBondContact O-NH1 3.17Å
16	M	89.1	Confident	86.5	Confident	81 Å²	81	88.2 Å²	88.2	40%	0.399	42%	0.415	S	S	.	.	H	α-helix	trans	-81.3	-52.4	176.4	-166	148.3	67.1	0	0	110.8	Q13 L14 L18 R19 D20	Q13-M16 WeakPolarHBondContact O-CA 3.41Å; Q13-M16 WeakPolarHBondContact O-CB 3.38Å; Q13-M16 PolarHBondContact O-N 3.11Å; L14-M16 PolarHBondContact O-N 3.25Å; M16-L18 VanDerWaalsContact C-N 3.25Å; M16-L18 PolarHBondContact O-N 3.5Å; M16-R19 PolarHBondContact O-N 2.88Å; M16-D20 PolarHBondContact O-N 2.98Å
17	D	88.6	Confident	87.7	Confident	49 Å²	49	90.7 Å²	90.7	26%	0.262	42%	0.424	S	S	.	.	H	α-helix	trans	-56.3	-40.4	176.9	-68.1	-2.8	0	0	0	111.7	Q13 L14 D20 R21 L89	Q13-D17 PolarHBondContact NE2-OD1 3.46Å; Q13-D17 PolarHBondContact O-N 3.31Å; L14-D17 PolarHBondContact O-N 3.02Å; D17-D20 PolarHBondContact O-N 3.04Å; D17-R21 WeakPolarHBondContact O-CG 3.24Å; D17-R21 PolarHBondContact O-N 3.02Å; D17-L89 HydrophobicContact CB-CD2 3.77Å
18	L	91.2	Very high	88.8	Confident	35 Å²	35	86.9 Å²	86.9	18%	0.183	41%	0.41	C	S	.	.	H	α-helix	trans	-65.6	-41.2	175	-74.2	174.3	0	0	0	113	L14 M16 D20 R21 F22 I86 L89 V90	L14-L18 HydrophobicContact CD1-CD1 3.76Å; L14-L18 HydrophobicContact CD1-CD2 4.48Å; L14-L18 HydrophobicContact CD1-CG 3.81Å; L14-L18 HydrophobicContact CG-CD1 3.86Å; L14-L18 HydrophobicContact CG-CG 4.33Å; L14-L18 WeakPolarHBondContact O-CB 3.14Å; L14-L18 WeakPolarHBondContact O-CG 3.48Å; L14-L18 PolarHBondContact O-N 2.87Å; M16-L18 VanDerWaalsContact C-N 3.25Å; M16-L18 PolarHBondContact O-N 3.5Å; L18-D20 VanDerWaalsContact C-N 3.31Å; L18-D20 PolarHBondContact O-N 3.24Å; L18-R21 PolarHBondContact O-N 3Å; L18-F22 HydrophobicContact CB-CD2 4.23Å; L18-F22 HydrophobicContact CB-CE2 4.21Å; L18-F22 HydrophobicContact CD2-CE2 4.07Å; L18-F22 WeakPolarHBondContact O-CB 3.36Å; L18-F22 WeakPolarHBondContact O-CD2 3.32Å; L18-F22 WeakPolarHBondContact O-CG 3.39Å; L18-F22 PolarHBondContact O-N 3.05Å; L18-I86 HydrophobicContact CD2-CG2 4.08Å; L18-L89 HydrophobicContact CD2-CD2 4.08Å; L18-L89 HydrophobicContact CG-CD2 4.39Å; L18-V90 HydrophobicContact CD2-CG2 3.86Å
19	R	93.6	Very high	89.8	Confident	140 Å²	140	84.8 Å²	84.8	53%	0.528	40%	0.4	S	S	.	.	H	α-helix	trans	-61.9	-42.5	177.3	-81.8	-177	-54.7	-100	5.7	111.2	P15 M16 T23	P15-R19 VanDerWaalsContact O-CG 3.24Å; P15-R19 WeakPolarHBondContact O-CG 3.1Å; P15-R19 PolarHBondContact O-N 3.43Å; P15-R19 PolarHBondContact O-NE 3.05Å; P15-R19 PolarHBondContact O-NH1 3.17Å; M16-R19 PolarHBondContact O-N 2.88Å; R19-T23 WeakPolarHBondContact O-CB 3.27Å; R19-T23 PolarHBondContact O-N 2.88Å; R19-T23 PolarHBondContact O-OG1 3.25Å
20	D	94.3	Very high	90.8	Very high	97 Å²	97	82.6 Å²	82.6	52%	0.519	39%	0.392	S	S	.	.	H	α-helix	trans	-66.3	-47.7	-179.2	-66.4	-5.1	0	0	0	110.2	M16 D17 L18 F22 T23 E24	M16-D20 PolarHBondContact O-N 2.98Å; D17-D20 PolarHBondContact O-N 3.04Å; L18-D20 VanDerWaalsContact C-N 3.31Å; L18-D20 PolarHBondContact O-N 3.24Å; D20-F22 PolarHBondContact O-N 3.38Å; D20-T23 WeakPolarHBondContact O-CB 3.38Å; D20-T23 PolarHBondContact O-N 3.39Å; D20-T23 VanDerWaalsContact O-N 3.14Å; D20-E24 WeakPolarHBondContact O-CB 3.47Å; D20-E24 PolarHBondContact O-N 3.25Å
21	R	92.9	Very high	91.9	Very high	91 Å²	91	84 Å²	84	34%	0.343	40%	0.398	S	S	.	.	H	α-helix	trans	-67	-36.2	178.5	-61.7	-72.5	148.3	-159.1	-7.8	113.5	D17 L18 T23 E24 M25 I86	D17-R21 WeakPolarHBondContact O-CG 3.24Å; D17-R21 PolarHBondContact O-N 3.02Å; L18-R21 PolarHBondContact O-N 3Å; R21-T23 VanDerWaalsContact C-N 3.31Å; R21-E24 VanDerWaalsContact CD-OE2 3.31Å; R21-E24 WeakPolarHBondContact CD-OE2 3.47Å; R21-E24 IonicContact CZ-OE2 3.86Å; R21-E24 IonicContact NE-OE2 2.69Å; R21-E24 IonicContact NH1-OE1 2.79Å; R21-E24 PolarHBondContact NH1-OE1 3.36Å; R21-E24 IonicContact NH1-OE2 2.62Å; R21-E24 PolarHBondContact NH1-OE2 3.01Å; R21-M25 VanDerWaalsContact O-CB 3.31Å; R21-M25 WeakPolarHBondContact O-CB 3.16Å; R21-M25 PolarHBondContact O-N 2.94Å; R21-I86 HydrophobicContact CB-CD1 3.76Å; R21-I86 HydrophobicContact CB-CG1 3.58Å; R21-I86 HydrophobicContact CG-CG1 4.36Å
22	F	95.9	Very high	92.8	Very high	110 Å²	110	83 Å²	83	48%	0.482	39%	0.394	S	S	.	.	H	α-helix	trans	-71	-25.9	172.7	-75.8	-54.3	0	0	0	112.8	L18 D20 M25 R26 I86	L18-F22 HydrophobicContact CB-CD2 4.23Å; L18-F22 HydrophobicContact CB-CE2 4.21Å; L18-F22 HydrophobicContact CD2-CE2 4.07Å; L18-F22 WeakPolarHBondContact O-CB 3.36Å; L18-F22 WeakPolarHBondContact O-CD2 3.32Å; L18-F22 WeakPolarHBondContact O-CG 3.39Å; L18-F22 PolarHBondContact O-N 3.05Å; D20-F22 PolarHBondContact O-N 3.38Å; F22-M25 HydrophobicContact CD1-SD 4.31Å; F22-R26 WeakPolarHBondContact O-CB 3.32Å; F22-R26 PolarHBondContact O-N 2.97Å; F22-R26 VanDerWaalsContact O-N 3.14Å; F22-I86 HydrophobicContact CD1-CD1 3.89Å; F22-I86 HydrophobicContact CE1-CD1 3.98Å; F22-I86 HydrophobicContact CE1-CG2 4.16Å; F22-I86 HydrophobicContact CG-CD1 4.5Å; F22-I86 HydrophobicContact CZ-CG2 4.01Å
23	T	96.2	Very high	93.4	Very high	93 Å²	93	81 Å²	81	57%	0.571	38%	0.384	S	S	*	.	H	α-helix	trans	-72	-47.9	172.9	-57.9	0	0	0	0	110.4	R19 D20 R21 M25 R26 E27	R19-T23 WeakPolarHBondContact O-CB 3.27Å; R19-T23 PolarHBondContact O-N 2.88Å; R19-T23 PolarHBondContact O-OG1 3.25Å; D20-T23 WeakPolarHBondContact O-CB 3.38Å; D20-T23 PolarHBondContact O-N 3.39Å; D20-T23 VanDerWaalsContact O-N 3.14Å; R21-T23 VanDerWaalsContact C-N 3.31Å; T23-M25 VanDerWaalsContact C-N 3.34Å; T23-M25 PolarHBondContact O-N 3.49Å; T23-R26 WeakPolarHBondContact O-CB 3.48Å; T23-R26 PolarHBondContact O-N 3.03Å; T23-R26 VanDerWaalsContact O-N 3.09Å; T23-E27 PolarHBondContact O-N 3.17Å
24	E	95.9	Very high	94.2	Very high	74 Å²	74	80.5 Å²	80.5	35%	0.346	39%	0.385	S	S	.	.	H	α-helix	trans	-58	-43.1	173.6	-167.9	-176.2	-152	0	0	111.6	D20 R21 R26 E27 M28 L82	D20-E24 WeakPolarHBondContact O-CB 3.47Å; D20-E24 PolarHBondContact O-N 3.25Å; R21-E24 VanDerWaalsContact CD-OE2 3.31Å; R21-E24 WeakPolarHBondContact CD-OE2 3.47Å; R21-E24 IonicContact CZ-OE2 3.86Å; R21-E24 IonicContact NE-OE2 2.69Å; R21-E24 IonicContact NH1-OE1 2.79Å; R21-E24 PolarHBondContact NH1-OE1 3.36Å; R21-E24 IonicContact NH1-OE2 2.62Å; R21-E24 PolarHBondContact NH1-OE2 3.01Å; E24-R26 VanDerWaalsContact C-N 3.3Å; E24-R26 PolarHBondContact O-N 3.07Å; E24-E27 PolarHBondContact O-N 3.14Å; E24-M28 WeakPolarHBondContact O-CG 3.34Å; E24-M28 PolarHBondContact O-N 3.31Å; E24-L82 HydrophobicContact CB-CD2 4Å; E24-L82 HydrophobicContact CG-CD1 4.48Å; E24-L82 HydrophobicContact CG-CD2 3.68Å; E24-L82 VanDerWaalsContact OE2-CD1 3.25Å; E24-L82 WeakPolarHBondContact OE2-CD1 3.39Å
25	M	96.4	Very high	94.7	Very high	36 Å²	36	80.1 Å²	80.1	18%	0.177	39%	0.386	C	S	.	.	H	α-helix	trans	-60.8	-38.7	174.2	175.1	173.6	-80.6	0	0	112.2	R21 F22 T23 E27 M28 D29 L82 A83 I86	R21-M25 VanDerWaalsContact O-CB 3.31Å; R21-M25 WeakPolarHBondContact O-CB 3.16Å; R21-M25 PolarHBondContact O-N 2.94Å; F22-M25 HydrophobicContact CD1-SD 4.31Å; T23-M25 VanDerWaalsContact C-N 3.34Å; T23-M25 PolarHBondContact O-N 3.49Å; M25-E27 VanDerWaalsContact C-N 3.35Å; M25-M28 PolarHBondContact O-N 2.9Å; M25-D29 WeakPolarHBondContact O-CB 3.27Å; M25-D29 VanDerWaalsContact O-CG 3.31Å; M25-D29 PolarHBondContact O-N 3.45Å; M25-L82 HydrophobicContact CB-CD2 4.07Å; M25-A83 VanDerWaalsContact CE-CA 3.47Å; M25-A83 HydrophobicContact CE-CB 3.61Å; M25-I86 HydrophobicContact CB-CD1 4.43Å; M25-I86 HydrophobicContact CE-CD1 3.73Å; M25-I86 HydrophobicContact SD-CD1 4.24Å
26	R	97.2	Very high	95.1	Very high	188 Å²	188	80.5 Å²	80.5	71%	0.709	39%	0.387	S	S	*	.	H	α-helix	trans	-73.3	-27.5	178.4	-166.9	173.5	-173	80	3.7	112.8	F22 T23 E24 L30	F22-R26 WeakPolarHBondContact O-CB 3.32Å; F22-R26 PolarHBondContact O-N 2.97Å; F22-R26 VanDerWaalsContact O-N 3.14Å; T23-R26 WeakPolarHBondContact O-CB 3.48Å; T23-R26 PolarHBondContact O-N 3.03Å; T23-R26 VanDerWaalsContact O-N 3.09Å; E24-R26 VanDerWaalsContact C-N 3.3Å; E24-R26 PolarHBondContact O-N 3.07Å; R26-L30 WeakPolarHBondContact O-CB 3.36Å; R26-L30 PolarHBondContact O-N 2.72Å
27	E	96.5	Very high	95.4	Very high	140 Å²	140	80.6 Å²	80.6	65%	0.654	39%	0.389	S	S	*	.	H	α-helix	trans	-70.6	-44.7	170.1	-172.2	161.9	-160.6	0	0	110.7	T23 E24 M25 L30 Q31	T23-E27 PolarHBondContact O-N 3.17Å; E24-E27 PolarHBondContact O-N 3.14Å; M25-E27 VanDerWaalsContact C-N 3.35Å; E27-L30 PolarHBondContact O-N 3.49Å; E27-Q31 PolarHBondContact O-N 2.89Å
28	M	95.6	Very high	95.8	Very high	26 Å²	26	83.1 Å²	83.1	13%	0.128	40%	0.399	C	S	.	.	H	α-helix	trans	-64.4	-40.1	174	-68.6	-56.9	-63.2	0	0	113.2	E24 M25 L30 Q31 V32 D75 E78 K79 L82	E24-M28 WeakPolarHBondContact O-CG 3.34Å; E24-M28 PolarHBondContact O-N 3.31Å; M25-M28 PolarHBondContact O-N 2.9Å; M28-L30 VanDerWaalsContact C-N 3.28Å; M28-L30 PolarHBondContact O-N 3.13Å; M28-Q31 PolarHBondContact O-N 3.34Å; M28-V32 WeakPolarHBondContact O-CG2 3.5Å; M28-V32 PolarHBondContact O-N 2.79Å; M28-D75 WeakPolarHBondContact CE-O 3.23Å; M28-E78 HydrophobicContact CE-CB 3.61Å; M28-K79 HydrophobicContact CB-CB 4.24Å; M28-L82 HydrophobicContact CG-CD2 4.21Å
29	D	96.8	Very high	96	Very high	54 Å²	54	82.6 Å²	82.6	29%	0.289	40%	0.396	S	S	.	.	H	α-helix	trans	-52.8	-47.9	170.8	-82.9	-24.1	0	0	0	111.2	M25 Q33 K79	M25-D29 WeakPolarHBondContact O-CB 3.27Å; M25-D29 VanDerWaalsContact O-CG 3.31Å; M25-D29 PolarHBondContact O-N 3.45Å; D29-Q33 WeakPolarHBondContact O-CB 3.37Å; D29-Q33 PolarHBondContact O-N 3.49Å; D29-K79 WeakPolarHBondContact OD1-CD 3.42Å; D29-K79 WeakPolarHBondContact OD1-CE 3.5Å; D29-K79 IonicContact OD1-NZ 2.67Å; D29-K79 PolarHBondContact OD1-NZ 2.88Å
30	L	97	Very high	96.1	Very high	100 Å²	100	82.2 Å²	82.2	52%	0.524	40%	0.401	S	S	.	.	H	α-helix	trans	-70.2	-34.8	-179.4	-176.5	59.3	0	0	0	111.8	R26 E27 M28 N34	R26-L30 WeakPolarHBondContact O-CB 3.36Å; R26-L30 PolarHBondContact O-N 2.72Å; E27-L30 PolarHBondContact O-N 3.49Å; M28-L30 VanDerWaalsContact C-N 3.28Å; M28-L30 PolarHBondContact O-N 3.13Å; L30-N34 WeakPolarHBondContact CD1-ND2 3.25Å; L30-N34 WeakPolarHBondContact CG-ND2 3.44Å; L30-N34 VanDerWaalsContact O-CB 3.29Å; L30-N34 WeakPolarHBondContact O-CB 3.48Å; L30-N34 VanDerWaalsContact O-CG 3.3Å; L30-N34 PolarHBondContact O-N 2.76Å; L30-N34 PolarHBondContact O-ND2 3.18Å
31	Q	96.3	Very high	96.2	Very high	76 Å²	76	83 Å²	83	36%	0.355	40%	0.401	S	S	.	.	H	α-helix	trans	-64.3	-50.9	173.8	179	159.8	-48.8	0	0	111.6	E27 M28 Q33 N34 A35 D75	E27-Q31 PolarHBondContact O-N 2.89Å; M28-Q31 PolarHBondContact O-N 3.34Å; Q31-Q33 PolarHBondContact O-N 3.26Å; Q31-N34 PolarHBondContact O-N 2.95Å; Q31-A35 WeakPolarHBondContact O-CB 3.32Å; Q31-A35 PolarHBondContact O-N 2.87Å; Q31-D75 PolarHBondContact NE2-OD1 2.85Å
32	V	97.1	Very high	96.2	Very high	22 Å²	22	81.8 Å²	81.8	13%	0.133	40%	0.399	C	S	.	.	H	α-helix	trans	-60.1	-43.9	177.5	173.3	0	0	0	0	111.3	M28 A35 T36 D75 A76 K79	M28-V32 WeakPolarHBondContact O-CG2 3.5Å; M28-V32 PolarHBondContact O-N 2.79Å; V32-A35 PolarHBondContact O-N 2.82Å; V32-T36 WeakPolarHBondContact O-CB 3.25Å; V32-T36 PolarHBondContact O-N 2.86Å; V32-T36 PolarHBondContact O-OG1 3.41Å; V32-D75 VanDerWaalsContact CG2-C 3.44Å; V32-D75 HydrophobicContact CG2-CB 3.8Å; V32-D75 VanDerWaalsContact CG2-O 3.23Å; V32-D75 WeakPolarHBondContact CG2-O 3.26Å; V32-A76 HydrophobicContact CG1-CB 4.24Å; V32-A76 HydrophobicContact CG2-CB 4.28Å; V32-K79 HydrophobicContact CG2-CB 4.43Å; V32-K79 HydrophobicContact CG2-CD 4.43Å
33	Q	97.1	Very high	96.2	Very high	114 Å²	114	78.8 Å²	78.8	53%	0.533	39%	0.389	S	S	.	.	H	α-helix	trans	-64.4	-49.8	177.3	-173.6	167.3	8.3	0	0	111.5	D29 Q31 A35 T36 D37	D29-Q33 WeakPolarHBondContact O-CB 3.37Å; D29-Q33 PolarHBondContact O-N 3.49Å; Q31-Q33 PolarHBondContact O-N 3.26Å; Q33-A35 VanDerWaalsContact C-N 3.27Å; Q33-A35 PolarHBondContact O-N 3.45Å; Q33-T36 PolarHBondContact O-N 3.16Å; Q33-T36 VanDerWaalsContact O-N 3.12Å; Q33-D37 VanDerWaalsContact O-CG 3.29Å; Q33-D37 PolarHBondContact O-N 2.87Å
34	N	96.7	Very high	96.1	Very high	78 Å²	78	78 Å²	78	42%	0.417	38%	0.384	S	S	.	.	H	α-helix	trans	-59.8	-35.4	176.7	-79	-56.2	0	0	0	112.9	L30 Q31 Q38	L30-N34 WeakPolarHBondContact CD1-ND2 3.25Å; L30-N34 WeakPolarHBondContact CG-ND2 3.44Å; L30-N34 VanDerWaalsContact O-CB 3.29Å; L30-N34 WeakPolarHBondContact O-CB 3.48Å; L30-N34 VanDerWaalsContact O-CG 3.3Å; L30-N34 PolarHBondContact O-N 2.76Å; L30-N34 PolarHBondContact O-ND2 3.18Å; Q31-N34 PolarHBondContact O-N 2.95Å; N34-Q38 WeakPolarHBondContact O-CB 3.24Å; N34-Q38 VanDerWaalsContact O-CG 3.23Å; N34-Q38 WeakPolarHBondContact O-CG 3.44Å; N34-Q38 PolarHBondContact O-N 2.91Å; N34-Q38 VanDerWaalsContact O-N 3.17Å; N34-Q38 PolarHBondContact O-NE2 3.08Å
35	A	95.6	Very high	95.9	Very high	19 Å²	19	79 Å²	79	16%	0.157	39%	0.389	C	S	.	.	H	α-helix	trans	-67.7	-42.7	175.3	0	0	0	0	0	111.5	Q31 V32 Q33 L39 A72	Q31-A35 WeakPolarHBondContact O-CB 3.32Å; Q31-A35 PolarHBondContact O-N 2.87Å; V32-A35 PolarHBondContact O-N 2.82Å; Q33-A35 VanDerWaalsContact C-N 3.27Å; Q33-A35 PolarHBondContact O-N 3.45Å; A35-L39 WeakPolarHBondContact O-CB 3.38Å; A35-L39 PolarHBondContact O-N 3.44Å; A35-A72 HydrophobicContact CB-CB 4Å
36	T	96.7	Very high	95.7	Very high	67 Å²	67	78.2 Å²	78.2	41%	0.411	38%	0.384	S	S	.	.	H	α-helix	trans	-64.6	-47.5	177.6	-54.8	0	0	0	0	111.8	V32 Q33 Q38 L39 E40	V32-T36 WeakPolarHBondContact O-CB 3.25Å; V32-T36 PolarHBondContact O-N 2.86Å; V32-T36 PolarHBondContact O-OG1 3.41Å; Q33-T36 PolarHBondContact O-N 3.16Å; Q33-T36 VanDerWaalsContact O-N 3.12Å; T36-Q38 PolarHBondContact O-N 3.03Å; T36-L39 WeakPolarHBondContact O-CB 3.35Å; T36-L39 PolarHBondContact O-N 3.44Å; T36-L39 VanDerWaalsContact O-N 3.13Å; T36-E40 PolarHBondContact O-N 3.35Å
37	D	96.7	Very high	95.4	Very high	83 Å²	83	76 Å²	76	44%	0.444	38%	0.38	S	S	.	.	H	α-helix	trans	-63	-41.2	179.7	-66.5	-6.9	0	0	0	111.2	Q33 L39 E40 Q41	Q33-D37 VanDerWaalsContact O-CG 3.29Å; Q33-D37 PolarHBondContact O-N 2.87Å; D37-L39 VanDerWaalsContact C-N 3.34Å; D37-L39 PolarHBondContact O-N 2.87Å; D37-E40 PolarHBondContact O-N 3.43Å; D37-Q41 PolarHBondContact O-N 3.02Å
38	Q	95.6	Very high	95.1	Very high	103 Å²	103	73.3 Å²	73.3	48%	0.481	37%	0.373	S	S	.	.	H	α-helix	trans	-64.5	-36.4	173.7	-78.8	173	81.9	0	0	112.8	N34 T36 K42	N34-Q38 WeakPolarHBondContact O-CB 3.24Å; N34-Q38 VanDerWaalsContact O-CG 3.23Å; N34-Q38 WeakPolarHBondContact O-CG 3.44Å; N34-Q38 PolarHBondContact O-N 2.91Å; N34-Q38 VanDerWaalsContact O-N 3.17Å; N34-Q38 PolarHBondContact O-NE2 3.08Å; T36-Q38 PolarHBondContact O-N 3.03Å; Q38-K42 VanDerWaalsContact O-CG 3.29Å; Q38-K42 WeakPolarHBondContact O-CG 3.45Å; Q38-K42 PolarHBondContact O-N 3.25Å
39	L	96.1	Very high	94.8	Very high	23 Å²	23	74.2 Å²	74.2	12%	0.12	38%	0.379	C	S	.	.	H	α-helix	trans	-67.9	-45.8	176.1	-178.2	68.5	0	0	0	111	A35 T36 D37 Q41 K42 V43 I65 D68 Y69	A35-L39 WeakPolarHBondContact O-CB 3.38Å; A35-L39 PolarHBondContact O-N 3.44Å; T36-L39 WeakPolarHBondContact O-CB 3.35Å; T36-L39 PolarHBondContact O-N 3.44Å; T36-L39 VanDerWaalsContact O-N 3.13Å; D37-L39 VanDerWaalsContact C-N 3.34Å; D37-L39 PolarHBondContact O-N 2.87Å; L39-Q41 VanDerWaalsContact C-N 3.32Å; L39-Q41 PolarHBondContact O-N 2.97Å; L39-K42 PolarHBondContact O-N 2.95Å; L39-V43 HydrophobicContact CD1-CG2 4.48Å; L39-V43 HydrophobicContact CG-CG2 4.49Å; L39-V43 WeakPolarHBondContact O-CB 3.4Å; L39-V43 VanDerWaalsContact O-CG2 3.27Å; L39-V43 WeakPolarHBondContact O-CG2 3.45Å; L39-V43 PolarHBondContact O-N 3.22Å; L39-I65 HydrophobicContact CD1-CG2 3.98Å; L39-I65 WeakPolarHBondContact CD1-O 3.45Å; L39-D68 HydrophobicContact CD1-CB 3.84Å; L39-Y69 HydrophobicContact CD2-CD2 3.92Å; L39-Y69 HydrophobicContact CD2-CG 4.44Å
40	E	96	Very high	94.1	Very high	132 Å²	132	72.8 Å²	72.8	62%	0.617	37%	0.374	S	S	*	.	H	α-helix	trans	-62.2	-39.4	176.6	-174.7	171.5	-157.2	0	0	111.6	T36 D37 V43 T44	T36-E40 PolarHBondContact O-N 3.35Å; D37-E40 PolarHBondContact O-N 3.43Å; E40-V43 PolarHBondContact O-N 3.35Å; E40-T44 WeakPolarHBondContact O-CB 3.38Å; E40-T44 PolarHBondContact O-N 3.07Å; E40-T44 PolarHBondContact O-OG1 2.81Å
41	Q	95.9	Very high	93.4	Very high	115 Å²	115	77.6 Å²	77.6	54%	0.537	39%	0.391	S	S	.	.	H	α-helix	trans	-59.7	-51.3	172.1	-176.5	-179.4	-14.9	0	0	111.3	D37 L39 V43 T44 E45	D37-Q41 PolarHBondContact O-N 3.02Å; L39-Q41 VanDerWaalsContact C-N 3.32Å; L39-Q41 PolarHBondContact O-N 2.97Å; Q41-V43 VanDerWaalsContact C-N 3.34Å; Q41-V43 PolarHBondContact O-N 3.48Å; Q41-T44 WeakPolarHBondContact O-CB 3.46Å; Q41-T44 PolarHBondContact O-N 3.06Å; Q41-T44 VanDerWaalsContact O-N 3.16Å; Q41-E45 HydrophobicContact CG-CG 4.46Å; Q41-E45 WeakPolarHBondContact CG-OE1 3.35Å; Q41-E45 PolarHBondContact NE2-OE1 3.33Å; Q41-E45 WeakPolarHBondContact O-CG 3.28Å; Q41-E45 PolarHBondContact O-N 3.33Å
42	K	93.4	Very high	92.9	Very high	65 Å²	65	80.8 Å²	80.8	28%	0.283	40%	0.403	S	S	.	.	H	α-helix	trans	-60.4	-41.5	179.4	-74.1	168.2	179.7	171.3	0	112.2	Q38 L39 E45 F46 I65 D68	Q38-K42 VanDerWaalsContact O-CG 3.29Å; Q38-K42 WeakPolarHBondContact O-CG 3.45Å; Q38-K42 PolarHBondContact O-N 3.25Å; L39-K42 PolarHBondContact O-N 2.95Å; K42-E45 PolarHBondContact O-N 2.92Å; K42-F46 VanDerWaalsContact O-CB 3.25Å; K42-F46 WeakPolarHBondContact O-CB 3.25Å; K42-F46 PolarHBondContact O-N 3.45Å; K42-I65 HydrophobicContact CB-CD1 4.48Å; K42-I65 HydrophobicContact CB-CG1 4.06Å; K42-D68 WeakPolarHBondContact CD-OD2 3.46Å; K42-D68 WeakPolarHBondContact CE-OD2 3.45Å; K42-D68 IonicContact NZ-OD1 3.94Å; K42-D68 PolarHBondContact NZ-OD1 2.99Å; K42-D68 VanDerWaalsContact NZ-OD1 3.13Å; K42-D68 IonicContact NZ-OD2 3.76Å; K42-D68 PolarHBondContact NZ-OD2 3.27Å
43	V	95	Very high	92.3	Very high	47 Å²	47	82.8 Å²	82.8	29%	0.285	41%	0.413	S	S	.	.	H	α-helix	trans	-62.6	-42.7	174.8	169.5	0	0	0	0	111.1	L39 E40 Q41 F46 F47 I65	L39-V43 HydrophobicContact CD1-CG2 4.48Å; L39-V43 HydrophobicContact CG-CG2 4.49Å; L39-V43 WeakPolarHBondContact O-CB 3.4Å; L39-V43 VanDerWaalsContact O-CG2 3.27Å; L39-V43 WeakPolarHBondContact O-CG2 3.45Å; L39-V43 PolarHBondContact O-N 3.22Å; E40-V43 PolarHBondContact O-N 3.35Å; Q41-V43 VanDerWaalsContact C-N 3.34Å; Q41-V43 PolarHBondContact O-N 3.48Å; V43-F46 WeakPolarHBondContact O-CB 3.47Å; V43-F46 PolarHBondContact O-N 2.98Å; V43-F47 HydrophobicContact CG1-CD2 3.86Å; V43-F47 HydrophobicContact CG1-CE2 3.69Å; V43-F47 WeakPolarHBondContact O-CD2 3.46Å; V43-F47 PolarHBondContact O-N 2.87Å; V43-I65 HydrophobicContact CG2-CD1 4.27Å; V43-I65 HydrophobicContact CG2-CG1 4.49Å; V43-I65 HydrophobicContact CG2-CG2 3.74Å
44	T	94.6	Very high	92	Very high	75 Å²	75	83.9 Å²	83.9	46%	0.46	42%	0.416	S	S	.	.	H	α-helix	trans	-64.5	-48.2	177.2	-61.6	0	0	0	0	111.7	E40 Q41 F46 F47 V48	E40-T44 WeakPolarHBondContact O-CB 3.38Å; E40-T44 PolarHBondContact O-N 3.07Å; E40-T44 PolarHBondContact O-OG1 2.81Å; Q41-T44 WeakPolarHBondContact O-CB 3.46Å; Q41-T44 PolarHBondContact O-N 3.06Å; Q41-T44 VanDerWaalsContact O-N 3.16Å; T44-F46 VanDerWaalsContact C-N 3.33Å; T44-F46 PolarHBondContact O-N 3.34Å; T44-F47 PolarHBondContact O-N 2.9Å; T44-V48 WeakPolarHBondContact O-CG2 3.47Å; T44-V48 PolarHBondContact O-N 2.66Å
45	E	91.6	Very high	91.4	Very high	96 Å²	96	83.5 Å²	83.5	45%	0.449	42%	0.418	S	S	.	.	H	α-helix	trans	-62	-39.9	176.5	-73	-174.7	-155.3	0	0	112.1	Q41 K42 V48 N49	Q41-E45 HydrophobicContact CG-CG 4.46Å; Q41-E45 WeakPolarHBondContact CG-OE1 3.35Å; Q41-E45 PolarHBondContact NE2-OE1 3.33Å; Q41-E45 WeakPolarHBondContact O-CG 3.28Å; Q41-E45 PolarHBondContact O-N 3.33Å; K42-E45 PolarHBondContact O-N 2.92Å; E45-V48 PolarHBondContact O-N 2.93Å; E45-N49 WeakPolarHBondContact O-CB 3.5Å; E45-N49 PolarHBondContact O-N 3.32Å; E45-N49 PolarHBondContact O-ND2 3.39Å
46	F	92.8	Very high	91	Very high	20 Å²	20	88.4 Å²	88.4	9%	0.088	44%	0.438	C	S	.	.	H	α-helix	trans	-56.8	-51.8	172.5	172.7	-97.4	0	0	0	111.3	K42 V43 T44 V48 N49 A50 W57 R58 Q61 M62 I65	K42-F46 VanDerWaalsContact O-CB 3.25Å; K42-F46 WeakPolarHBondContact O-CB 3.25Å; K42-F46 PolarHBondContact O-N 3.45Å; V43-F46 WeakPolarHBondContact O-CB 3.47Å; V43-F46 PolarHBondContact O-N 2.98Å; T44-F46 VanDerWaalsContact C-N 3.33Å; T44-F46 PolarHBondContact O-N 3.34Å; F46-V48 PolarHBondContact O-N 2.85Å; F46-N49 PolarHBondContact O-N 3.08Å; F46-A50 WeakPolarHBondContact O-CA 3.43Å; F46-A50 WeakPolarHBondContact O-CB 3.32Å; F46-A50 PolarHBondContact O-N 3.38Å; F46-W57 HydrophobicContact CD2-CZ3 4.47Å; F46-R58 HydrophobicContact CE2-CB 3.98Å; F46-R58 HydrophobicContact CE2-CG 4.19Å; F46-R58 WeakPolarHBondContact CE2-O 3.09Å; F46-R58 HydrophobicContact CZ-CB 4.45Å; F46-Q61 HydrophobicContact CD2-CB 3.8Å; F46-Q61 HydrophobicContact CE2-CB 4.29Å; F46-M62 HydrophobicContact CE1-CE 3.81Å; F46-M62 HydrophobicContact CE2-CE 4.4Å; F46-M62 HydrophobicContact CZ-CE 3.65Å; F46-I65 HydrophobicContact CB-CD1 3.68Å; F46-I65 HydrophobicContact CD2-CD1 4.32Å; F46-I65 HydrophobicContact CG-CD1 3.97Å
47	F	90.1	Very high	90.8	Very high	141 Å²	141	88.4 Å²	88.4	62%	0.618	43%	0.43	S	S	*	.	H	α-helix	trans	-65.7	-34.5	179.7	-78.2	-62.4	0	0	0	113.7	V43 T44 N49	V43-F47 HydrophobicContact CG1-CD2 3.86Å; V43-F47 HydrophobicContact CG1-CE2 3.69Å; V43-F47 WeakPolarHBondContact O-CD2 3.46Å; V43-F47 PolarHBondContact O-N 2.87Å; T44-F47 PolarHBondContact O-N 2.9Å; F47-N49 VanDerWaalsContact C-N 3.35Å
48	V	90.8	Very high	90.4	Very high	84 Å²	84	89.5 Å²	89.5	51%	0.509	43%	0.428	S	S	.	.	H	α-helix	trans	-68.6	-32.3	175.9	170.4	0	0	0	0	112.3	T44 E45 F46 K52	T44-V48 WeakPolarHBondContact O-CG2 3.47Å; T44-V48 PolarHBondContact O-N 2.66Å; E45-V48 PolarHBondContact O-N 2.93Å; F46-V48 PolarHBondContact O-N 2.85Å; V48-K52 VanDerWaalsContact O-CE 3.29Å; V48-K52 WeakPolarHBondContact O-CE 3.34Å; V48-K52 PolarHBondContact O-NZ 3.45Å
49	N	88.6	Confident	90.1	Very high	45 Å²	45	91.1 Å²	91.1	24%	0.241	44%	0.436	C	S	.	.	H	α-helix	trans	-103.5	-17.2	-174.8	-67.5	-26.9	0	0	0	114.3	E45 F46 F47 K51 K52 N53 W57	E45-N49 WeakPolarHBondContact O-CB 3.5Å; E45-N49 PolarHBondContact O-N 3.32Å; E45-N49 PolarHBondContact O-ND2 3.39Å; F46-N49 PolarHBondContact O-N 3.08Å; F47-N49 VanDerWaalsContact C-N 3.35Å; N49-K51 PolarHBondContact O-N 3.3Å; N49-K51 VanDerWaalsContact O-N 3.11Å; N49-K52 PolarHBondContact O-N 3.37Å; N49-K52 PolarHBondContact OD1-NZ 2.8Å; N49-K52 VanDerWaalsContact OD1-NZ 3.08Å; N49-N53 PolarHBondContact O-N 2.94Å; N49-W57 HydrophobicContact CB-CH2 3.61Å; N49-W57 HydrophobicContact CB-CZ2 4.5Å; N49-W57 HydrophobicContact CB-CZ3 3.97Å
50	A	83.4	Confident	89.9	Confident	23 Å²	23	95.2 Å²	95.2	19%	0.19	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-24.3	177.8	0	0	0	0	0	114	F46 R58	F46-A50 WeakPolarHBondContact O-CA 3.43Å; F46-A50 WeakPolarHBondContact O-CB 3.32Å; F46-A50 PolarHBondContact O-N 3.38Å; A50-R58 HydrophobicContact CB-CG 4.22Å; A50-R58 WeakPolarHBondContact O-CD 3.49Å
51	K	81.9	Confident	89.8	Confident	201 Å²	201	91.1 Å²	91.1	87%	0.874	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-9	174	-67	-178.6	-179.8	175.1	0	114.2	N49	N49-K51 PolarHBondContact O-N 3.3Å; N49-K51 VanDerWaalsContact O-N 3.11Å
52	K	84.8	Confident	89.5	Confident	144 Å²	144	89 Å²	89	63%	0.626	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	-28.6	-175.4	-54.2	172.4	-163.4	152.6	0	112.5	V48 N49	V48-K52 VanDerWaalsContact O-CE 3.29Å; V48-K52 WeakPolarHBondContact O-CE 3.34Å; V48-K52 PolarHBondContact O-NZ 3.45Å; N49-K52 PolarHBondContact O-N 3.37Å; N49-K52 PolarHBondContact OD1-NZ 2.8Å; N49-K52 VanDerWaalsContact OD1-NZ 3.08Å
53	N	85.9	Confident	89.6	Confident	63 Å²	63	92.9 Å²	92.9	34%	0.337	45%	0.445	S	S	.	.	S	Bend	trans	-100.7	161.2	-169.7	-67.8	-5.6	0	0	0	112.9	N49 W57	N49-N53 PolarHBondContact O-N 2.94Å; N53-W57 HydrophobicContact CB-CB 4.43Å; N53-W57 HydrophobicContact CB-CD2 3.83Å; N53-W57 HydrophobicContact CB-CE3 3.37Å; N53-W57 HydrophobicContact CB-CG 4.3Å; N53-W57 HydrophobicContact CB-CZ3 3.94Å; N53-W57 VanDerWaalsContact ND2-CD2 3.25Å; N53-W57 VanDerWaalsContact ND2-CE2 3.34Å; N53-W57 WeakPolarHBondContact ND2-CH2 3.38Å; N53-W57 WeakPolarHBondContact ND2-CZ2 3.36Å; N53-W57 VanDerWaalsContact ND2-CZ3 3.25Å; N53-W57 WeakPolarHBondContact ND2-CZ3 3.37Å
54	K	89.8	Confident	89.6	Confident	138 Å²	138	93.7 Å²	93.7	60%	0.6	45%	0.447	S	S	*	.			trans	-62.7	159.8	178	-74.3	-169.8	176.3	-175.1	0	113.3	E56 W57 R58	K54-E56 WeakPolarHBondContact CD-OE2 3.32Å; K54-E56 IonicContact NZ-OE2 3.58Å; K54-E56 PolarHBondContact NZ-OE2 2.78Å; K54-E56 VanDerWaalsContact NZ-OE2 3.17Å; K54-E56 PolarHBondContact O-N 2.98Å; K54-W57 PolarHBondContact O-N 3.44Å; K54-R58 PolarHBondContact O-N 2.89Å
55	P	84.5	Confident	89.6	Confident	69 Å²	69	91 Å²	91	45%	0.448	43%	0.43	S	S	.	.	H	α-helix	trans	-56.9	-45.7	171.4	23.1	-33.4	0	0	0	113.1	W57 R58 E59	P55-W57 VanDerWaalsContact C-N 3.31Å; P55-W57 PolarHBondContact O-N 2.9Å; P55-R58 WeakPolarHBondContact O-CA 3.19Å; P55-R58 WeakPolarHBondContact O-CB 3.45Å; P55-R58 PolarHBondContact O-N 3.13Å; P55-E59 PolarHBondContact O-N 3.03Å
56	E	87.7	Confident	89.8	Confident	123 Å²	123	92 Å²	92	58%	0.575	43%	0.433	S	S	*	.	H	α-helix	trans	-49.5	-49.4	179	-58.1	165.2	124.7	0	0	112	K54 R58 E59 E60	K54-E56 WeakPolarHBondContact CD-OE2 3.32Å; K54-E56 IonicContact NZ-OE2 3.58Å; K54-E56 PolarHBondContact NZ-OE2 2.78Å; K54-E56 VanDerWaalsContact NZ-OE2 3.17Å; K54-E56 PolarHBondContact O-N 2.98Å; E56-R58 VanDerWaalsContact C-N 3.34Å; E56-R58 PolarHBondContact O-N 3.44Å; E56-E59 PolarHBondContact O-N 3.02Å; E56-E60 PolarHBondContact O-N 3.47Å
57	W	91.1	Very high	90	Very high	67 Å²	67	98.7 Å²	98.7	25%	0.254	46%	0.462	S	S	.	.	H	α-helix	trans	-66.2	-33.2	177.6	-178.8	82.4	0	0	0	112.9	F46 N49 N53 K54 P55 E59 Q61	F46-W57 HydrophobicContact CD2-CZ3 4.47Å; N49-W57 HydrophobicContact CB-CH2 3.61Å; N49-W57 HydrophobicContact CB-CZ2 4.5Å; N49-W57 HydrophobicContact CB-CZ3 3.97Å; N53-W57 HydrophobicContact CB-CB 4.43Å; N53-W57 HydrophobicContact CB-CD2 3.83Å; N53-W57 HydrophobicContact CB-CE3 3.37Å; N53-W57 HydrophobicContact CB-CG 4.3Å; N53-W57 HydrophobicContact CB-CZ3 3.94Å; N53-W57 VanDerWaalsContact ND2-CD2 3.25Å; N53-W57 VanDerWaalsContact ND2-CE2 3.34Å; N53-W57 WeakPolarHBondContact ND2-CH2 3.38Å; N53-W57 WeakPolarHBondContact ND2-CZ2 3.36Å; N53-W57 VanDerWaalsContact ND2-CZ3 3.25Å; N53-W57 WeakPolarHBondContact ND2-CZ3 3.37Å; K54-W57 PolarHBondContact O-N 3.44Å; P55-W57 VanDerWaalsContact C-N 3.31Å; P55-W57 PolarHBondContact O-N 2.9Å; W57-E59 VanDerWaalsContact C-N 3.33Å; W57-Q61 HydrophobicContact CD2-CG 3.77Å; W57-Q61 VanDerWaalsContact CE2-CG 3.41Å; W57-Q61 HydrophobicContact CE3-CG 4.1Å; W57-Q61 HydrophobicContact CG-CG 4.37Å; W57-Q61 HydrophobicContact CH2-CG 3.84Å; W57-Q61 HydrophobicContact CZ2-CG 3.49Å; W57-Q61 VanDerWaalsContact CZ2-CG 3.49Å; W57-Q61 HydrophobicContact CZ3-CG 4.13Å; W57-Q61 WeakPolarHBondContact O-CB 3.41Å; W57-Q61 VanDerWaalsContact O-CG 3.24Å; W57-Q61 WeakPolarHBondContact O-CG 3.39Å; W57-Q61 PolarHBondContact O-N 3.31Å
58	R	88.5	Confident	90.2	Very high	105 Å²	105	94 Å²	94	40%	0.396	44%	0.443	S	S	.	.	H	α-helix	trans	-69.9	-32.7	175.7	-69.6	-173.2	-65.6	128.8	3.5	112	F46 A50 K54 P55 E56 M62	F46-R58 HydrophobicContact CE2-CB 3.98Å; F46-R58 HydrophobicContact CE2-CG 4.19Å; F46-R58 WeakPolarHBondContact CE2-O 3.09Å; F46-R58 HydrophobicContact CZ-CB 4.45Å; A50-R58 HydrophobicContact CB-CG 4.22Å; A50-R58 WeakPolarHBondContact O-CD 3.49Å; K54-R58 PolarHBondContact O-N 2.89Å; P55-R58 WeakPolarHBondContact O-CA 3.19Å; P55-R58 WeakPolarHBondContact O-CB 3.45Å; P55-R58 PolarHBondContact O-N 3.13Å; E56-R58 VanDerWaalsContact C-N 3.34Å; E56-R58 PolarHBondContact O-N 3.44Å; R58-M62 WeakPolarHBondContact O-CB 3.29Å; R58-M62 PolarHBondContact O-N 3.23Å
59	E	90.4	Very high	90.5	Very high	137 Å²	137	96 Å²	96	64%	0.64	44%	0.443	S	S	*	.	H	α-helix	trans	-70.9	-47.1	176.2	-73.4	161.6	-158.9	0	0	110.5	P55 E56 W57 Q61 M62 E63	P55-E59 PolarHBondContact O-N 3.03Å; E56-E59 PolarHBondContact O-N 3.02Å; W57-E59 VanDerWaalsContact C-N 3.33Å; E59-Q61 PolarHBondContact O-N 3.45Å; E59-M62 PolarHBondContact O-N 2.92Å; E59-E63 PolarHBondContact O-N 2.67Å
60	E	92.2	Very high	90.9	Very high	109 Å²	109	100.6 Å²	100.6	51%	0.509	46%	0.458	S	S	.	.	H	α-helix	trans	-56.6	-49.5	173.7	-179.1	-176.3	-136.1	0	0	112.6	E56 M62 E63 I64	E56-E60 PolarHBondContact O-N 3.47Å; E60-M62 VanDerWaalsContact C-N 3.34Å; E60-M62 PolarHBondContact O-N 3.37Å; E60-E63 PolarHBondContact O-N 3.39Å; E60-I64 HydrophobicContact CG-CD1 4.17Å; E60-I64 WeakPolarHBondContact O-CG1 3.49Å; E60-I64 PolarHBondContact O-N 2.87Å
61	Q	92.4	Very high	91.5	Very high	47 Å²	47	104 Å²	104	22%	0.22	47%	0.468	C	S	.	.	H	α-helix	trans	-67.5	-33	178.1	-65.5	-56.7	-70.3	0	0	112.8	F46 W57 E59 E63 I64 I65	F46-Q61 HydrophobicContact CD2-CB 3.8Å; F46-Q61 HydrophobicContact CE2-CB 4.29Å; W57-Q61 HydrophobicContact CD2-CG 3.77Å; W57-Q61 VanDerWaalsContact CE2-CG 3.41Å; W57-Q61 HydrophobicContact CE3-CG 4.1Å; W57-Q61 HydrophobicContact CG-CG 4.37Å; W57-Q61 HydrophobicContact CH2-CG 3.84Å; W57-Q61 HydrophobicContact CZ2-CG 3.49Å; W57-Q61 VanDerWaalsContact CZ2-CG 3.49Å; W57-Q61 HydrophobicContact CZ3-CG 4.13Å; W57-Q61 WeakPolarHBondContact O-CB 3.41Å; W57-Q61 VanDerWaalsContact O-CG 3.24Å; W57-Q61 WeakPolarHBondContact O-CG 3.39Å; W57-Q61 PolarHBondContact O-N 3.31Å; E59-Q61 PolarHBondContact O-N 3.45Å; Q61-E63 VanDerWaalsContact C-N 3.33Å; Q61-I64 PolarHBondContact O-N 2.94Å; Q61-I65 WeakPolarHBondContact O-CB 3.35Å; Q61-I65 WeakPolarHBondContact O-CD1 3.18Å; Q61-I65 VanDerWaalsContact O-CG1 3.26Å; Q61-I65 WeakPolarHBondContact O-CG1 3.41Å; Q61-I65 PolarHBondContact O-N 3.34Å
62	M	91.1	Very high	92.2	Very high	71 Å²	71	94.9 Å²	94.9	35%	0.35	43%	0.43	S	S	.	.	H	α-helix	trans	-67.6	-34.1	174.6	178.5	60.8	56.7	0	0	111.7	F46 R58 E59 E60 K66	F46-M62 HydrophobicContact CE1-CE 3.81Å; F46-M62 HydrophobicContact CE2-CE 4.4Å; F46-M62 HydrophobicContact CZ-CE 3.65Å; R58-M62 WeakPolarHBondContact O-CB 3.29Å; R58-M62 PolarHBondContact O-N 3.23Å; E59-M62 PolarHBondContact O-N 2.92Å; E60-M62 VanDerWaalsContact C-N 3.34Å; E60-M62 PolarHBondContact O-N 3.37Å; M62-K66 WeakPolarHBondContact O-CB 3.41Å; M62-K66 VanDerWaalsContact O-CG 3.25Å; M62-K66 WeakPolarHBondContact O-CG 3.35Å; M62-K66 PolarHBondContact O-N 3.02Å
63	E	94.8	Very high	92.8	Very high	145 Å²	145	91.8 Å²	91.8	68%	0.678	42%	0.42	S	S	*	.	H	α-helix	trans	-69.1	-43.4	173.3	-171.1	171.8	-174.9	0	0	111.8	E59 E60 Q61 K66 K67	E59-E63 PolarHBondContact O-N 2.67Å; E60-E63 PolarHBondContact O-N 3.39Å; Q61-E63 VanDerWaalsContact C-N 3.33Å; E63-K66 PolarHBondContact O-N 3.08Å; E63-K67 PolarHBondContact O-N 2.98Å
64	I	94.5	Very high	93.2	Very high	65 Å²	65	94.4 Å²	94.4	33%	0.333	43%	0.43	S	S	.	.	H	α-helix	trans	-59.5	-50.7	174.1	-68.2	163.6	0	0	0	110.9	E60 Q61 K66 K67 D68	E60-I64 HydrophobicContact CG-CD1 4.17Å; E60-I64 WeakPolarHBondContact O-CG1 3.49Å; E60-I64 PolarHBondContact O-N 2.87Å; Q61-I64 PolarHBondContact O-N 2.94Å; I64-K66 VanDerWaalsContact C-N 3.32Å; I64-K66 PolarHBondContact O-N 2.88Å; I64-K67 WeakPolarHBondContact O-CB 3.37Å; I64-K67 PolarHBondContact O-N 2.82Å; I64-K67 VanDerWaalsContact O-N 3.08Å; I64-D68 WeakPolarHBondContact CG2-OD2 3.14Å; I64-D68 PolarHBondContact O-N 3.01Å
65	I	95.7	Very high	93.5	Very high	18 Å²	18	88.1 Å²	88.1	9%	0.092	40%	0.403	C	S	.	.	H	α-helix	trans	-59.6	-40.1	178.7	-74	166.7	0	0	0	111.7	L39 K42 V43 F46 Q61 Y69	L39-I65 HydrophobicContact CD1-CG2 3.98Å; L39-I65 WeakPolarHBondContact CD1-O 3.45Å; K42-I65 HydrophobicContact CB-CD1 4.48Å; K42-I65 HydrophobicContact CB-CG1 4.06Å; V43-I65 HydrophobicContact CG2-CD1 4.27Å; V43-I65 HydrophobicContact CG2-CG1 4.49Å; V43-I65 HydrophobicContact CG2-CG2 3.74Å; F46-I65 HydrophobicContact CB-CD1 3.68Å; F46-I65 HydrophobicContact CD2-CD1 4.32Å; F46-I65 HydrophobicContact CG-CD1 3.97Å; Q61-I65 WeakPolarHBondContact O-CB 3.35Å; Q61-I65 WeakPolarHBondContact O-CD1 3.18Å; Q61-I65 VanDerWaalsContact O-CG1 3.26Å; Q61-I65 WeakPolarHBondContact O-CG1 3.41Å; Q61-I65 PolarHBondContact O-N 3.34Å; I65-Y69 WeakPolarHBondContact O-CB 3.47Å; I65-Y69 PolarHBondContact O-N 3.28Å
66	K	95.6	Very high	94.1	Very high	117 Å²	117	86.3 Å²	86.3	51%	0.509	39%	0.394	S	S	.	.	H	α-helix	trans	-63	-43.9	173.7	-77.9	171.4	179.8	180	0	112.1	M62 E63 I64 Y69 Y70	M62-K66 WeakPolarHBondContact O-CB 3.41Å; M62-K66 VanDerWaalsContact O-CG 3.25Å; M62-K66 WeakPolarHBondContact O-CG 3.35Å; M62-K66 PolarHBondContact O-N 3.02Å; E63-K66 PolarHBondContact O-N 3.08Å; I64-K66 VanDerWaalsContact C-N 3.32Å; I64-K66 PolarHBondContact O-N 2.88Å; K66-Y69 PolarHBondContact O-N 3.49Å; K66-Y70 WeakPolarHBondContact O-CD2 3.46Å; K66-Y70 PolarHBondContact O-N 2.96Å
67	K	96.4	Very high	94.5	Very high	161 Å²	161	84.7 Å²	84.7	70%	0.7	39%	0.389	S	S	*	.	H	α-helix	trans	-63.5	-44.5	178.5	-176.6	178	178	179	0	111.7	E63 I64 Y69 Y70 K71	E63-K67 PolarHBondContact O-N 2.98Å; I64-K67 WeakPolarHBondContact O-CB 3.37Å; I64-K67 PolarHBondContact O-N 2.82Å; I64-K67 VanDerWaalsContact O-N 3.08Å; K67-Y69 VanDerWaalsContact C-N 3.33Å; K67-Y70 PolarHBondContact O-N 2.75Å; K67-K71 PolarHBondContact O-N 2.97Å
68	D	94.9	Very high	94.8	Very high	43 Å²	43	86.5 Å²	86.5	23%	0.23	40%	0.401	C	S	.	.	H	α-helix	trans	-63.3	-38.9	175.9	-67.6	-46.7	0	0	0	111.6	L39 K42 I64 K71 A72	L39-D68 HydrophobicContact CD1-CB 3.84Å; K42-D68 WeakPolarHBondContact CD-OD2 3.46Å; K42-D68 WeakPolarHBondContact CE-OD2 3.45Å; K42-D68 IonicContact NZ-OD1 3.94Å; K42-D68 PolarHBondContact NZ-OD1 2.99Å; K42-D68 VanDerWaalsContact NZ-OD1 3.13Å; K42-D68 IonicContact NZ-OD2 3.76Å; K42-D68 PolarHBondContact NZ-OD2 3.27Å; I64-D68 WeakPolarHBondContact CG2-OD2 3.14Å; I64-D68 PolarHBondContact O-N 3.01Å; D68-K71 PolarHBondContact O-N 2.96Å; D68-A72 WeakPolarHBondContact O-CB 3.07Å; D68-A72 PolarHBondContact O-N 3.25Å
69	Y	96.8	Very high	95.1	Very high	126 Å²	126	85 Å²	85	49%	0.494	40%	0.397	S	S	.	.	H	α-helix	trans	-62.5	-46.6	174	173.9	-90.2	0	0	0	112.7	L39 I65 K66 K67 K71 A72 L73	L39-Y69 HydrophobicContact CD2-CD2 3.92Å; L39-Y69 HydrophobicContact CD2-CG 4.44Å; I65-Y69 WeakPolarHBondContact O-CB 3.47Å; I65-Y69 PolarHBondContact O-N 3.28Å; K66-Y69 PolarHBondContact O-N 3.49Å; K67-Y69 VanDerWaalsContact C-N 3.33Å; Y69-K71 VanDerWaalsContact C-N 3.31Å; Y69-K71 PolarHBondContact O-N 3.43Å; Y69-A72 PolarHBondContact O-N 2.84Å; Y69-L73 PolarHBondContact O-N 3.48Å
70	Y	96.7	Very high	95.5	Very high	141 Å²	141	82.3 Å²	82.3	55%	0.553	39%	0.389	S	S	*	.	H	α-helix	trans	-63.2	-38.4	176.1	-73.4	-61.1	0	0	0	111.7	K66 K67 L73 E74	K66-Y70 WeakPolarHBondContact O-CD2 3.46Å; K66-Y70 PolarHBondContact O-N 2.96Å; K67-Y70 PolarHBondContact O-N 2.75Å; Y70-L73 WeakPolarHBondContact O-CB 3.3Å; Y70-L73 PolarHBondContact O-N 3.41Å; Y70-E74 WeakPolarHBondContact O-CG 3.41Å; Y70-E74 PolarHBondContact O-N 3Å
71	K	95.6	Very high	95.7	Very high	94 Å²	94	82.3 Å²	82.3	41%	0.409	39%	0.389	S	S	.	.	H	α-helix	trans	-66.2	-39.8	175.8	-160.7	-126.8	171.6	-124.5	0	112.5	K67 D68 Y69 L73 E74 D75	K67-K71 PolarHBondContact O-N 2.97Å; D68-K71 PolarHBondContact O-N 2.96Å; Y69-K71 VanDerWaalsContact C-N 3.31Å; Y69-K71 PolarHBondContact O-N 3.43Å; K71-L73 PolarHBondContact O-N 2.96Å; K71-E74 PolarHBondContact O-N 3.17Å; K71-D75 IonicContact NZ-OD1 2.75Å; K71-D75 PolarHBondContact NZ-OD1 3.28Å; K71-D75 IonicContact NZ-OD2 3.19Å; K71-D75 PolarHBondContact NZ-OD2 2.91Å; K71-D75 PolarHBondContact O-N 3.12Å
72	A	96.3	Very high	95.9	Very high	10 Å²	10	80.5 Å²	80.5	8%	0.083	38%	0.381	C	S	.	.	H	α-helix	trans	-66.2	-26.9	174.7	0	0	0	0	0	112.8	A35 D68 Y69 A76	A35-A72 HydrophobicContact CB-CB 4Å; D68-A72 WeakPolarHBondContact O-CB 3.07Å; D68-A72 PolarHBondContact O-N 3.25Å; Y69-A72 PolarHBondContact O-N 2.84Å; A72-A76 WeakPolarHBondContact O-CB 3.34Å; A72-A76 PolarHBondContact O-N 2.91Å
73	L	96.9	Very high	96.1	Very high	78 Å²	78	79 Å²	79	41%	0.408	38%	0.381	S	S	.	.	H	α-helix	trans	-72	-45.6	170.9	-169.3	72.3	0	0	0	111.3	Y69 Y70 K71 A76 D77	Y69-L73 PolarHBondContact O-N 3.48Å; Y70-L73 WeakPolarHBondContact O-CB 3.3Å; Y70-L73 PolarHBondContact O-N 3.41Å; K71-L73 PolarHBondContact O-N 2.96Å; L73-A76 WeakPolarHBondContact O-CB 3.29Å; L73-A76 PolarHBondContact O-N 3.25Å; L73-A76 VanDerWaalsContact O-N 3.11Å; L73-D77 PolarHBondContact O-N 3.22Å
74	E	96.3	Very high	96.2	Very high	119 Å²	119	76.4 Å²	76.4	56%	0.556	37%	0.371	S	S	*	.	H	α-helix	trans	-58	-48.3	174	-69.4	167.2	168.1	0	0	111.3	Y70 K71 A76 D77 E78	Y70-E74 WeakPolarHBondContact O-CG 3.41Å; Y70-E74 PolarHBondContact O-N 3Å; K71-E74 PolarHBondContact O-N 3.17Å; E74-A76 PolarHBondContact O-N 3.33Å; E74-D77 PolarHBondContact O-N 3.25Å; E74-E78 PolarHBondContact O-N 2.86Å
75	D	95.5	Very high	96.2	Very high	6 Å²	6	77.8 Å²	77.8	3%	0.032	38%	0.376	C	S	.	.	H	α-helix	trans	-55.7	-36.1	174.7	-68.2	-42.5	0	0	0	111.8	M28 Q31 V32 K71 K79	M28-D75 WeakPolarHBondContact CE-O 3.23Å; Q31-D75 PolarHBondContact NE2-OD1 2.85Å; V32-D75 VanDerWaalsContact CG2-C 3.44Å; V32-D75 HydrophobicContact CG2-CB 3.8Å; V32-D75 VanDerWaalsContact CG2-O 3.23Å; V32-D75 WeakPolarHBondContact CG2-O 3.26Å; K71-D75 IonicContact NZ-OD1 2.75Å; K71-D75 PolarHBondContact NZ-OD1 3.28Å; K71-D75 IonicContact NZ-OD2 3.19Å; K71-D75 PolarHBondContact NZ-OD2 2.91Å; K71-D75 PolarHBondContact O-N 3.12Å; D75-K79 PolarHBondContact O-N 3.22Å
76	A	96.6	Very high	96.1	Very high	30 Å²	30	77.6 Å²	77.6	25%	0.248	38%	0.375	C	S	.	.	H	α-helix	trans	-78.8	-36.8	-179.2	0	0	0	0	0	113.1	V32 A72 L73 E74 K79 V80	V32-A76 HydrophobicContact CG1-CB 4.24Å; V32-A76 HydrophobicContact CG2-CB 4.28Å; A72-A76 WeakPolarHBondContact O-CB 3.34Å; A72-A76 PolarHBondContact O-N 2.91Å; L73-A76 WeakPolarHBondContact O-CB 3.29Å; L73-A76 PolarHBondContact O-N 3.25Å; L73-A76 VanDerWaalsContact O-N 3.11Å; E74-A76 PolarHBondContact O-N 3.33Å; A76-K79 WeakPolarHBondContact O-CB 3.4Å; A76-K79 PolarHBondContact O-N 3.05Å; A76-V80 WeakPolarHBondContact O-CG2 3.39Å; A76-V80 PolarHBondContact O-N 3.11Å
77	D	97.3	Very high	96	Very high	89 Å²	89	79.8 Å²	79.8	48%	0.476	38%	0.382	S	S	.	.	H	α-helix	trans	-68.6	-34.1	174.5	-78.3	-23.2	0	0	0	111.6	L73 E74 V80 Q81	L73-D77 PolarHBondContact O-N 3.22Å; E74-D77 PolarHBondContact O-N 3.25Å; D77-V80 PolarHBondContact O-N 3.26Å; D77-Q81 WeakPolarHBondContact O-CG 3.49Å; D77-Q81 PolarHBondContact O-N 2.63Å; D77-Q81 PolarHBondContact O-NE2 2.92Å; D77-Q81 VanDerWaalsContact O-NE2 3.13Å
78	E	96.1	Very high	96	Very high	106 Å²	106	76.2 Å²	76.2	50%	0.495	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-43.1	170.6	-74	-174.9	172.7	0	0	111.7	M28 E74 V80 Q81 L82	M28-E78 HydrophobicContact CE-CB 3.61Å; E74-E78 PolarHBondContact O-N 2.86Å; E78-V80 VanDerWaalsContact C-N 3.33Å; E78-V80 PolarHBondContact O-N 2.97Å; E78-Q81 WeakPolarHBondContact O-CB 3.48Å; E78-Q81 PolarHBondContact O-N 3.38Å; E78-L82 PolarHBondContact O-N 3.39Å
79	K	96.1	Very high	95.8	Very high	73 Å²	73	74.9 Å²	74.9	32%	0.317	36%	0.363	S	S	.	.	H	α-helix	trans	-58	-41.4	172.2	164	178	165.4	169.6	0	112.4	M28 D29 V32 D75 A76 L82 A83	M28-K79 HydrophobicContact CB-CB 4.24Å; D29-K79 WeakPolarHBondContact OD1-CD 3.42Å; D29-K79 WeakPolarHBondContact OD1-CE 3.5Å; D29-K79 IonicContact OD1-NZ 2.67Å; D29-K79 PolarHBondContact OD1-NZ 2.88Å; V32-K79 HydrophobicContact CG2-CB 4.43Å; V32-K79 HydrophobicContact CG2-CD 4.43Å; D75-K79 PolarHBondContact O-N 3.22Å; A76-K79 WeakPolarHBondContact O-CB 3.4Å; A76-K79 PolarHBondContact O-N 3.05Å; K79-L82 PolarHBondContact O-N 3.13Å; K79-A83 PolarHBondContact O-N 3.02Å
80	V	97.5	Very high	95.6	Very high	80 Å²	80	72 Å²	72	49%	0.485	36%	0.358	S	S	.	.	H	α-helix	trans	-66.3	-41.1	177	170.7	0	0	0	0	111.2	A76 D77 E78 L82 A83 N84	A76-V80 WeakPolarHBondContact O-CG2 3.39Å; A76-V80 PolarHBondContact O-N 3.11Å; D77-V80 PolarHBondContact O-N 3.26Å; E78-V80 VanDerWaalsContact C-N 3.33Å; E78-V80 PolarHBondContact O-N 2.97Å; V80-L82 VanDerWaalsContact C-N 3.33Å; V80-L82 PolarHBondContact O-N 3.2Å; V80-A83 WeakPolarHBondContact O-CB 3.21Å; V80-A83 PolarHBondContact O-N 3.48Å; V80-N84 PolarHBondContact O-N 3.22Å; V80-N84 VanDerWaalsContact O-N 3.12Å; V80-N84 PolarHBondContact O-ND2 3.36Å
81	Q	96.6	Very high	95.4	Very high	109 Å²	109	67.2 Å²	67.2	51%	0.509	34%	0.342	S	S	.	.	H	α-helix	trans	-60.2	-42.1	174.6	-72.3	167.6	72.3	0	0	111.9	D77 E78 N84 Q85	D77-Q81 WeakPolarHBondContact O-CG 3.49Å; D77-Q81 PolarHBondContact O-N 2.63Å; D77-Q81 PolarHBondContact O-NE2 2.92Å; D77-Q81 VanDerWaalsContact O-NE2 3.13Å; E78-Q81 WeakPolarHBondContact O-CB 3.48Å; E78-Q81 PolarHBondContact O-N 3.38Å; Q81-N84 PolarHBondContact O-N 3.45Å; Q81-Q85 WeakPolarHBondContact O-CG 3.41Å; Q81-Q85 PolarHBondContact O-N 2.87Å
82	L	95.9	Very high	95.1	Very high	9 Å²	9	69.4 Å²	69.4	5%	0.047	35%	0.348	C	S	.	.	H	α-helix	trans	-66.1	-36.7	176.7	-179.4	56.2	0	0	0	112.7	E24 M25 M28 E78 K79 V80 N84 Q85 I86	E24-L82 HydrophobicContact CB-CD2 4Å; E24-L82 HydrophobicContact CG-CD1 4.48Å; E24-L82 HydrophobicContact CG-CD2 3.68Å; E24-L82 VanDerWaalsContact OE2-CD1 3.25Å; E24-L82 WeakPolarHBondContact OE2-CD1 3.39Å; M25-L82 HydrophobicContact CB-CD2 4.07Å; M28-L82 HydrophobicContact CG-CD2 4.21Å; E78-L82 PolarHBondContact O-N 3.39Å; K79-L82 PolarHBondContact O-N 3.13Å; V80-L82 VanDerWaalsContact C-N 3.33Å; V80-L82 PolarHBondContact O-N 3.2Å; L82-N84 VanDerWaalsContact C-N 3.34Å; L82-N84 PolarHBondContact O-N 2.97Å; L82-Q85 PolarHBondContact O-N 2.79Å; L82-I86 PolarHBondContact O-N 3.25Å; L82-I86 VanDerWaalsContact O-N 3.09Å
83	A	96	Very high	94.7	Very high	41 Å²	41	69.9 Å²	69.9	34%	0.339	35%	0.348	S	S	.	.	H	α-helix	trans	-60.5	-42.4	172.9	0	0	0	0	0	112.3	M25 K79 V80 I86 Y87	M25-A83 VanDerWaalsContact CE-CA 3.47Å; M25-A83 HydrophobicContact CE-CB 3.61Å; K79-A83 PolarHBondContact O-N 3.02Å; V80-A83 WeakPolarHBondContact O-CB 3.21Å; V80-A83 PolarHBondContact O-N 3.48Å; A83-I86 PolarHBondContact O-N 3.12Å; A83-Y87 PolarHBondContact O-N 3.25Å; A83-Y87 VanDerWaalsContact O-N 3.08Å
84	N	96.1	Very high	94.4	Very high	90 Å²	90	70.5 Å²	70.5	48%	0.481	35%	0.351	S	S	.	.	H	α-helix	trans	-64	-40.8	174.6	-65	-35.7	0	0	0	111.7	V80 Q81 L82 I86 Y87 D88	V80-N84 PolarHBondContact O-N 3.22Å; V80-N84 VanDerWaalsContact O-N 3.12Å; V80-N84 PolarHBondContact O-ND2 3.36Å; Q81-N84 PolarHBondContact O-N 3.45Å; L82-N84 VanDerWaalsContact C-N 3.34Å; L82-N84 PolarHBondContact O-N 2.97Å; N84-I86 VanDerWaalsContact C-N 3.3Å; N84-I86 PolarHBondContact O-N 2.9Å; N84-Y87 WeakPolarHBondContact O-CB 3.09Å; N84-Y87 PolarHBondContact O-N 3.44Å; N84-Y87 VanDerWaalsContact O-N 3.13Å; N84-D88 WeakPolarHBondContact O-CB 3.26Å; N84-D88 PolarHBondContact O-N 3.33Å
85	Q	94.9	Very high	94.1	Very high	94 Å²	94	71.6 Å²	71.6	44%	0.439	35%	0.351	S	S	.	.	H	α-helix	trans	-61.1	-35.5	175.9	-69.4	173.1	37.3	0	0	113.3	Q81 L82 L89	Q81-Q85 WeakPolarHBondContact O-CG 3.41Å; Q81-Q85 PolarHBondContact O-N 2.87Å; L82-Q85 PolarHBondContact O-N 2.79Å; Q85-L89 WeakPolarHBondContact O-CB 3.34Å; Q85-L89 PolarHBondContact O-N 2.95Å
86	I	93.8	Very high	93.6	Very high	13 Å²	13	75.9 Å²	75.9	7%	0.067	37%	0.369	C	S	.	.	H	α-helix	trans	-67.9	-44.2	173.2	-66.6	178.2	0	0	0	110.6	L18 R21 F22 M25 L82 A83 N84 L89 V90	L18-I86 HydrophobicContact CD2-CG2 4.08Å; R21-I86 HydrophobicContact CB-CD1 3.76Å; R21-I86 HydrophobicContact CB-CG1 3.58Å; R21-I86 HydrophobicContact CG-CG1 4.36Å; F22-I86 HydrophobicContact CD1-CD1 3.89Å; F22-I86 HydrophobicContact CE1-CD1 3.98Å; F22-I86 HydrophobicContact CE1-CG2 4.16Å; F22-I86 HydrophobicContact CG-CD1 4.5Å; F22-I86 HydrophobicContact CZ-CG2 4.01Å; M25-I86 HydrophobicContact CB-CD1 4.43Å; M25-I86 HydrophobicContact CE-CD1 3.73Å; M25-I86 HydrophobicContact SD-CD1 4.24Å; L82-I86 PolarHBondContact O-N 3.25Å; L82-I86 VanDerWaalsContact O-N 3.09Å; A83-I86 PolarHBondContact O-N 3.12Å; N84-I86 VanDerWaalsContact C-N 3.3Å; N84-I86 PolarHBondContact O-N 2.9Å; I86-L89 WeakPolarHBondContact O-CB 3.49Å; I86-L89 PolarHBondContact O-N 3.47Å; I86-V90 WeakPolarHBondContact O-CG2 3.33Å; I86-V90 PolarHBondContact O-N 3.3Å
87	Y	94.7	Very high	93.1	Very high	164 Å²	164	76.4 Å²	76.4	64%	0.643	37%	0.367	S	S	*	.	H	α-helix	trans	-60.4	-48.9	177.1	-169.5	-88.5	0	0	0	111.5	A83 N84 L89 V90 D91	A83-Y87 PolarHBondContact O-N 3.25Å; A83-Y87 VanDerWaalsContact O-N 3.08Å; N84-Y87 WeakPolarHBondContact O-CB 3.09Å; N84-Y87 PolarHBondContact O-N 3.44Å; N84-Y87 VanDerWaalsContact O-N 3.13Å; Y87-L89 VanDerWaalsContact C-N 3.26Å; Y87-L89 PolarHBondContact O-N 3.23Å; Y87-V90 PolarHBondContact O-N 3Å; Y87-V90 VanDerWaalsContact O-N 3.15Å; Y87-D91 WeakPolarHBondContact O-CB 3.23Å; Y87-D91 PolarHBondContact O-N 3.41Å
88	D	94.8	Very high	92.7	Very high	86 Å²	86	76.1 Å²	76.1	46%	0.46	37%	0.366	S	S	.	.	H	α-helix	trans	-63.2	-28.7	176.9	-71.2	-18.4	0	0	0	112.7	N84 R92	N84-D88 WeakPolarHBondContact O-CB 3.26Å; N84-D88 PolarHBondContact O-N 3.33Å; D88-R92 WeakPolarHBondContact O-CB 3.38Å; D88-R92 WeakPolarHBondContact O-CG 3.43Å; D88-R92 PolarHBondContact O-N 2.73Å; D88-R92 PolarHBondContact O-NE 3.4Å
89	L	91.4	Very high	92.3	Very high	15 Å²	15	77.2 Å²	77.2	8%	0.079	37%	0.371	C	S	.	.	H	α-helix	trans	-67.8	-51.1	171.1	-179.7	67.3	0	0	0	111.1	L14 D17 L18 Q85 I86 Y87 R92 H93	L14-L89 HydrophobicContact CD1-CD2 4.36Å; L14-L89 HydrophobicContact CD1-CG 4.19Å; D17-L89 HydrophobicContact CB-CD2 3.77Å; L18-L89 HydrophobicContact CD2-CD2 4.08Å; L18-L89 HydrophobicContact CG-CD2 4.39Å; Q85-L89 WeakPolarHBondContact O-CB 3.34Å; Q85-L89 PolarHBondContact O-N 2.95Å; I86-L89 WeakPolarHBondContact O-CB 3.49Å; I86-L89 PolarHBondContact O-N 3.47Å; Y87-L89 VanDerWaalsContact C-N 3.26Å; Y87-L89 PolarHBondContact O-N 3.23Å; L89-R92 PolarHBondContact O-N 2.74Å; L89-H93 PolarHBondContact O-CD2 3.04Å; L89-H93 PolarHBondContact O-N 2.74Å; L89-H93 VanDerWaalsContact O-N 3.12Å
90	V	91.8	Very high	91.7	Very high	65 Å²	65	76.9 Å²	76.9	39%	0.394	37%	0.37	S	S	.	.	H	α-helix	trans	-62.3	-46.8	-179.7	175.8	0	0	0	0	111.1	L18 I86 Y87 R92 H93 L94	L18-V90 HydrophobicContact CD2-CG2 3.86Å; I86-V90 WeakPolarHBondContact O-CG2 3.33Å; I86-V90 PolarHBondContact O-N 3.3Å; Y87-V90 PolarHBondContact O-N 3Å; Y87-V90 VanDerWaalsContact O-N 3.15Å; V90-R92 PolarHBondContact O-N 2.99Å; V90-H93 PolarHBondContact O-N 3.3Å; V90-H93 VanDerWaalsContact O-N 3.12Å; V90-L94 WeakPolarHBondContact O-CB 3.49Å; V90-L94 PolarHBondContact O-N 3.49Å
91	D	93.3	Very high	91	Very high	40 Å²	40	78.4 Å²	78.4	21%	0.214	38%	0.375	C	S	.	.	H	α-helix	trans	-60	-42.5	178.3	178.6	71.2	0	0	0	112.2	Y87 H93 L94 R95	Y87-D91 WeakPolarHBondContact O-CB 3.23Å; Y87-D91 PolarHBondContact O-N 3.41Å; D91-H93 VanDerWaalsContact C-N 3.33Å; D91-H93 PolarHBondContact O-N 3.13Å; D91-L94 PolarHBondContact O-N 2.93Å; D91-R95 VanDerWaalsContact CG-NE 3.34Å; D91-R95 WeakPolarHBondContact O-CG 3.39Å; D91-R95 PolarHBondContact O-N 3.19Å; D91-R95 IonicContact OD1-CZ 3.13Å; D91-R95 IonicContact OD1-NE 3.2Å; D91-R95 PolarHBondContact OD1-NE 3.38Å; D91-R95 IonicContact OD1-NH2 2.73Å; D91-R95 PolarHBondContact OD1-NH2 3.14Å; D91-R95 VanDerWaalsContact OD1-NH2 3.15Å; D91-R95 IonicContact OD2-CZ 3.68Å; D91-R95 IonicContact OD2-NE 2.74Å; D91-R95 PolarHBondContact OD2-NE 3.09Å; D91-R95 IonicContact OD2-NH2 2.63Å; D91-R95 PolarHBondContact OD2-NH2 3.45Å
92	R	90	Very high	90.5	Very high	140 Å²	140	76.1 Å²	76.1	53%	0.528	38%	0.375	S	S	.	.	H	α-helix	trans	-64.6	-32.7	174.7	-78.1	178.7	-65.7	145	1.7	113.5	D88 L89 V90 K96	D88-R92 WeakPolarHBondContact O-CB 3.38Å; D88-R92 WeakPolarHBondContact O-CG 3.43Å; D88-R92 PolarHBondContact O-N 2.73Å; D88-R92 PolarHBondContact O-NE 3.4Å; L89-R92 PolarHBondContact O-N 2.74Å; V90-R92 PolarHBondContact O-N 2.99Å; R92-K96 VanDerWaalsContact O-CG 3.28Å; R92-K96 WeakPolarHBondContact O-CG 3.29Å; R92-K96 PolarHBondContact O-N 2.88Å
93	H	87.4	Confident	89.9	Confident	20 Å²	20	79.9 Å²	79.9	9%	0.093	39%	0.391	C	S	.	.	H	α-helix	trans	-76.2	-41.6	174.3	-84.2	-100.6	0	0	0	111.7	L14 L89 V90 D91 K96 L97	L14-H93 HydrophobicContact CD1-CB 4.27Å; L14-H93 HydrophobicContact CD2-CB 3.91Å; L89-H93 PolarHBondContact O-CD2 3.04Å; L89-H93 PolarHBondContact O-N 2.74Å; L89-H93 VanDerWaalsContact O-N 3.12Å; V90-H93 PolarHBondContact O-N 3.3Å; V90-H93 VanDerWaalsContact O-N 3.12Å; D91-H93 VanDerWaalsContact C-N 3.33Å; D91-H93 PolarHBondContact O-N 3.13Å; H93-K96 WeakPolarHBondContact O-CB 3.45Å; H93-K96 PolarHBondContact O-N 3.21Å; H93-L97 VanDerWaalsContact O-CG 3.3Å; H93-L97 WeakPolarHBondContact O-CG 3.31Å; H93-L97 PolarHBondContact O-N 2.8Å
94	L	90.1	Very high	89	Confident	91 Å²	91	81.9 Å²	81.9	48%	0.476	39%	0.392	S	S	.	.	H	α-helix	trans	-58.2	-51.9	176.1	-173.9	144.5	0	0	0	111.2	V90 D91 K96 L97 D98	V90-L94 WeakPolarHBondContact O-CB 3.49Å; V90-L94 PolarHBondContact O-N 3.49Å; D91-L94 PolarHBondContact O-N 2.93Å; L94-K96 PolarHBondContact O-N 2.82Å; L94-K96 VanDerWaalsContact O-N 3.16Å; L94-L97 WeakPolarHBondContact O-CB 3.4Å; L94-L97 PolarHBondContact O-N 3.4Å; L94-D98 VanDerWaalsContact CD2-OD2 3.28Å; L94-D98 WeakPolarHBondContact CD2-OD2 3.44Å; L94-D98 PolarHBondContact O-N 2.94Å
95	R	90.5	Very high	88.3	Confident	143 Å²	143	81.4 Å²	81.4	54%	0.54	39%	0.386	S	S	.	.	H	α-helix	trans	-58.4	-31.7	176.3	-68.6	-179.3	-156.7	-108	-1.4	113.9	D91 Q99	D91-R95 VanDerWaalsContact CG-NE 3.34Å; D91-R95 WeakPolarHBondContact O-CG 3.39Å; D91-R95 PolarHBondContact O-N 3.19Å; D91-R95 IonicContact OD1-CZ 3.13Å; D91-R95 IonicContact OD1-NE 3.2Å; D91-R95 PolarHBondContact OD1-NE 3.38Å; D91-R95 IonicContact OD1-NH2 2.73Å; D91-R95 PolarHBondContact OD1-NH2 3.14Å; D91-R95 VanDerWaalsContact OD1-NH2 3.15Å; D91-R95 IonicContact OD2-CZ 3.68Å; D91-R95 IonicContact OD2-NE 2.74Å; D91-R95 PolarHBondContact OD2-NE 3.09Å; D91-R95 IonicContact OD2-NH2 2.63Å; D91-R95 PolarHBondContact OD2-NH2 3.45Å; R95-Q99 WeakPolarHBondContact O-CG 3.35Å; R95-Q99 PolarHBondContact O-N 2.99Å; R95-Q99 PolarHBondContact O-NE2 3.26Å
96	K	85.6	Confident	87.7	Confident	96 Å²	96	83.4 Å²	83.4	42%	0.417	40%	0.397	S	S	.	.	H	α-helix	trans	-72	-42.1	175.9	-80.9	174.5	174.2	-175	0	111.5	M10 R92 H93 L94 D98 Q99 E100	M10-K96 HydrophobicContact CE-CB 4.04Å; M10-K96 HydrophobicContact CG-CD 4.49Å; M10-K96 HydrophobicContact SD-CB 3.75Å; M10-K96 HydrophobicContact SD-CD 3.93Å; M10-K96 HydrophobicContact SD-CG 4.28Å; R92-K96 VanDerWaalsContact O-CG 3.28Å; R92-K96 WeakPolarHBondContact O-CG 3.29Å; R92-K96 PolarHBondContact O-N 2.88Å; H93-K96 WeakPolarHBondContact O-CB 3.45Å; H93-K96 PolarHBondContact O-N 3.21Å; L94-K96 PolarHBondContact O-N 2.82Å; L94-K96 VanDerWaalsContact O-N 3.16Å; K96-D98 VanDerWaalsContact C-N 3.33Å; K96-Q99 PolarHBondContact O-N 3.29Å; K96-E100 PolarHBondContact O-N 2.84Å
97	L	85.7	Confident	87.1	Confident	41 Å²	41	86 Å²	86	22%	0.215	41%	0.409	C	S	.	.	H	α-helix	trans	-63	-41.8	176.4	-66.6	165.1	0	0	0	110.6	Y7 M10 I11 H93 L94 Q99 E100 L101	Y7-L97 HydrophobicContact CD2-CD2 3.93Å; Y7-L97 HydrophobicContact CE2-CD2 3.45Å; Y7-L97 VanDerWaalsContact CE2-CD2 3.45Å; M10-L97 HydrophobicContact CE-CD2 3.87Å; M10-L97 HydrophobicContact CE-CG 4.38Å; I11-L97 HydrophobicContact CD1-CD1 4.45Å; I11-L97 HydrophobicContact CD1-CD2 3.75Å; I11-L97 HydrophobicContact CG1-CD2 3.82Å; H93-L97 VanDerWaalsContact O-CG 3.3Å; H93-L97 WeakPolarHBondContact O-CG 3.31Å; H93-L97 PolarHBondContact O-N 2.8Å; L94-L97 WeakPolarHBondContact O-CB 3.4Å; L94-L97 PolarHBondContact O-N 3.4Å; L97-Q99 PolarHBondContact O-N 3.15Å; L97-E100 PolarHBondContact O-N 2.73Å; L97-L101 WeakPolarHBondContact O-CB 3.49Å; L97-L101 PolarHBondContact O-N 3.15Å
98	D	88.3	Confident	86.3	Confident	82 Å²	82	80.3 Å²	80.3	44%	0.439	39%	0.389	S	S	.	.	H	α-helix	trans	-61.5	-40.4	173.7	-63.9	-29.1	0	0	0	112.6	L94 K96 L101 A102	L94-D98 VanDerWaalsContact CD2-OD2 3.28Å; L94-D98 WeakPolarHBondContact CD2-OD2 3.44Å; L94-D98 PolarHBondContact O-N 2.94Å; K96-D98 VanDerWaalsContact C-N 3.33Å; D98-L101 PolarHBondContact O-N 3.3Å; D98-A102 VanDerWaalsContact O-CB 3.28Å; D98-A102 WeakPolarHBondContact O-CB 3.43Å; D98-A102 PolarHBondContact O-N 3.08Å
99	Q	87.3	Confident	85.6	Confident	129 Å²	129	80 Å²	80	60%	0.603	39%	0.385	S	S	*	.	H	α-helix	trans	-65.8	-45.1	177.8	-81.7	165.8	79.2	0	0	112.3	R95 K96 L97 A102 K103	R95-Q99 WeakPolarHBondContact O-CG 3.35Å; R95-Q99 PolarHBondContact O-N 2.99Å; R95-Q99 PolarHBondContact O-NE2 3.26Å; K96-Q99 PolarHBondContact O-N 3.29Å; L97-Q99 PolarHBondContact O-N 3.15Å; Q99-A102 PolarHBondContact O-N 3.03Å; Q99-K103 VanDerWaalsContact O-CB 3.26Å; Q99-K103 WeakPolarHBondContact O-CB 3.44Å; Q99-K103 PolarHBondContact O-N 3.24Å
100	E	83.3	Confident	84.9	Confident	66 Å²	66	83.3 Å²	83.3	31%	0.308	41%	0.414	S	S	.	.	H	α-helix	trans	-69.8	-34.9	176.6	-74.3	-62	143.5	0	0	112	M10 K96 L97 K103 F104	M10-E100 HydrophobicContact CE-CB 4.2Å; M10-E100 HydrophobicContact CE-CG 3.8Å; K96-E100 PolarHBondContact O-N 2.84Å; L97-E100 PolarHBondContact O-N 2.73Å; E100-K103 PolarHBondContact O-N 3.34Å; E100-K103 IonicContact OE1-NZ 2.63Å; E100-K103 PolarHBondContact OE1-NZ 3.32Å; E100-K103 WeakPolarHBondContact OE2-CD 3.48Å; E100-K103 WeakPolarHBondContact OE2-CE 3.44Å; E100-K103 IonicContact OE2-NZ 3.35Å; E100-K103 PolarHBondContact OE2-NZ 3.09Å; E100-F104 VanDerWaalsContact O-CB 3.24Å; E100-F104 WeakPolarHBondContact O-CB 3.47Å; E100-F104 PolarHBondContact O-N 3.03Å
101	L	84.1	Confident	84.1	Confident	113 Å²	113	86.2 Å²	86.2	59%	0.592	43%	0.427	S	S	*	.	H	α-helix	trans	-63.6	-44.1	171.7	-178.8	64.5	0	0	0	112	L97 D98 F104 K105	L97-L101 WeakPolarHBondContact O-CB 3.49Å; L97-L101 PolarHBondContact O-N 3.15Å; D98-L101 PolarHBondContact O-N 3.3Å; L101-F104 PolarHBondContact O-N 2.88Å; L101-K105 WeakPolarHBondContact O-CB 3.38Å; L101-K105 PolarHBondContact O-N 3.13Å
102	A	85.2	Confident	83.2	Confident	61 Å²	61	88.7 Å²	88.7	50%	0.504	44%	0.441	S	S	.	.	H	α-helix	trans	-66.5	-41.6	177.5	0	0	0	0	0	112.2	D98 Q99 K105 M106	D98-A102 VanDerWaalsContact O-CB 3.28Å; D98-A102 WeakPolarHBondContact O-CB 3.43Å; D98-A102 PolarHBondContact O-N 3.08Å; Q99-A102 PolarHBondContact O-N 3.03Å; A102-K105 PolarHBondContact O-N 3.04Å; A102-M106 PolarHBondContact O-N 2.91Å
103	K	82.9	Confident	82.5	Confident	87 Å²	87	86.4 Å²	86.4	38%	0.378	45%	0.452	S	S	.	.	H	α-helix	trans	-59.6	-47.9	172.8	172.9	-179.8	156.4	-141.7	0	111.2	Q99 E100 K105 M106 E107	Q99-K103 VanDerWaalsContact O-CB 3.26Å; Q99-K103 WeakPolarHBondContact O-CB 3.44Å; Q99-K103 PolarHBondContact O-N 3.24Å; E100-K103 PolarHBondContact O-N 3.34Å; E100-K103 IonicContact OE1-NZ 2.63Å; E100-K103 PolarHBondContact OE1-NZ 3.32Å; E100-K103 WeakPolarHBondContact OE2-CD 3.48Å; E100-K103 WeakPolarHBondContact OE2-CE 3.44Å; E100-K103 IonicContact OE2-NZ 3.35Å; E100-K103 PolarHBondContact OE2-NZ 3.09Å; K103-K105 PolarHBondContact O-N 2.89Å; K103-M106 PolarHBondContact O-N 3.13Å; K103-E107 WeakPolarHBondContact O-CB 3.4Å; K103-E107 PolarHBondContact O-N 2.88Å
104	F	78.1	Confident	81.8	Confident	84 Å²	84	87 Å²	87	37%	0.368	46%	0.463	S	S	.	.	H	α-helix	trans	-62.1	-40.6	175.7	179	-111.5	0	0	0	112.7	Y3 E100 L101 E107 L108	Y3-F104 HydrophobicContact CG-CD2 4.48Å; E100-F104 VanDerWaalsContact O-CB 3.24Å; E100-F104 WeakPolarHBondContact O-CB 3.47Å; E100-F104 PolarHBondContact O-N 3.03Å; L101-F104 PolarHBondContact O-N 2.88Å; F104-E107 PolarHBondContact O-N 3.24Å; F104-L108 HydrophobicContact CD1-CD1 4.05Å; F104-L108 HydrophobicContact CD2-CG 4.5Å; F104-L108 HydrophobicContact CE1-CD1 3.5Å; F104-L108 VanDerWaalsContact CE1-CD1 3.5Å; F104-L108 HydrophobicContact CE1-CG 4.25Å; F104-L108 HydrophobicContact CE2-CD1 4.23Å; F104-L108 HydrophobicContact CE2-CD2 4.38Å; F104-L108 HydrophobicContact CE2-CG 4.13Å; F104-L108 HydrophobicContact CZ-CD1 3.6Å; F104-L108 HydrophobicContact CZ-CD2 4.29Å; F104-L108 HydrophobicContact CZ-CG 4Å; F104-L108 WeakPolarHBondContact O-CB 3.44Å; F104-L108 WeakPolarHBondContact O-CG 3.07Å; F104-L108 PolarHBondContact O-N 3.37Å
105	K	81.9	Confident	81.2	Confident	80 Å²	80	85.6 Å²	85.6	35%	0.348	46%	0.456	S	S	.	.	H	α-helix	trans	-60.6	-45.2	174.2	-171.1	168.6	177.8	159.7	0	111.3	L101 A102 K103 E109 T116 E120	L101-K105 WeakPolarHBondContact O-CB 3.38Å; L101-K105 PolarHBondContact O-N 3.13Å; A102-K105 PolarHBondContact O-N 3.04Å; K103-K105 PolarHBondContact O-N 2.89Å; K105-E109 WeakPolarHBondContact CE-OE1 3.42Å; K105-E109 WeakPolarHBondContact CG-OE1 3.5Å; K105-E109 WeakPolarHBondContact O-CB 3.46Å; K105-E109 PolarHBondContact O-N 3.05Å; K105-T116 HydrophobicContact CB-CG2 4.49Å; K105-T116 HydrophobicContact CG-CG2 3.69Å; K105-T116 WeakPolarHBondContact O-CG2 3.33Å; K105-E120 IonicContact NZ-OE1 2.67Å; K105-E120 IonicContact NZ-OE2 3.11Å; K105-E120 PolarHBondContact NZ-OE2 3.41Å
106	M	81.9	Confident	80.5	Confident	136 Å²	136	79.4 Å²	79.4	67%	0.67	43%	0.434	S	S	*	.	H	α-helix	trans	-66.3	-36.7	177.5	-167.5	-176.7	72.3	0	0	112.8	A102 K103 E109 A110	A102-M106 PolarHBondContact O-N 2.91Å; K103-M106 PolarHBondContact O-N 3.13Å; M106-E109 PolarHBondContact O-N 3.16Å; M106-A110 WeakPolarHBondContact O-CB 3.28Å; M106-A110 PolarHBondContact O-N 2.85Å
107	E	81.8	Confident	80	Confident	67 Å²	67	80 Å²	80	31%	0.313	44%	0.438	S	S	.	.	H	α-helix	trans	-69.4	-43.1	177.8	-163.7	166.6	178.1	0	0	111.4	Y3 K103 F104 E109 A110 D111	Y3-E107 WeakPolarHBondContact CE1-OE1 3.25Å; Y3-E107 VanDerWaalsContact CE1-OE2 3.32Å; Y3-E107 WeakPolarHBondContact CE1-OE2 3.19Å; Y3-E107 PolarHBondContact OH-OE1 3.46Å; K103-E107 WeakPolarHBondContact O-CB 3.4Å; K103-E107 PolarHBondContact O-N 2.88Å; F104-E107 PolarHBondContact O-N 3.24Å; E107-E109 PolarHBondContact O-N 2.94Å; E107-A110 PolarHBondContact O-N 3.35Å; E107-D111 PolarHBondContact O-N 3.12Å; E107-D111 VanDerWaalsContact O-N 3.07Å
108	L	77.1	Confident	79.5	Confident	44 Å²	44	82.9 Å²	82.9	23%	0.23	45%	0.453	C	S	.	.	H	α-helix	trans	-61.3	-39.1	171.2	-75.8	180	0	0	0	113	F104 A110 N112 T116	F104-L108 HydrophobicContact CD1-CD1 4.05Å; F104-L108 HydrophobicContact CD2-CG 4.5Å; F104-L108 HydrophobicContact CE1-CD1 3.5Å; F104-L108 VanDerWaalsContact CE1-CD1 3.5Å; F104-L108 HydrophobicContact CE1-CG 4.25Å; F104-L108 HydrophobicContact CE2-CD1 4.23Å; F104-L108 HydrophobicContact CE2-CD2 4.38Å; F104-L108 HydrophobicContact CE2-CG 4.13Å; F104-L108 HydrophobicContact CZ-CD1 3.6Å; F104-L108 HydrophobicContact CZ-CD2 4.29Å; F104-L108 HydrophobicContact CZ-CG 4Å; F104-L108 WeakPolarHBondContact O-CB 3.44Å; F104-L108 WeakPolarHBondContact O-CG 3.07Å; F104-L108 PolarHBondContact O-N 3.37Å; L108-A110 VanDerWaalsContact C-N 3.32Å; L108-N112 CarbonylContact O-C 3.32Å; L108-N112 WeakPolarHBondContact O-CA 3.29Å; L108-N112 PolarHBondContact O-N 2.69Å; L108-T116 HydrophobicContact CB-CG2 3.64Å; L108-T116 HydrophobicContact CD1-CG2 4.09Å
109	E	79.3	Confident	78.9	Confident	81 Å²	81	83.7 Å²	83.7	38%	0.379	46%	0.457	S	S	.	.	H	α-helix	trans	-70.2	-27.5	176.8	-82.6	165	-151.1	0	0	113.1	K105 M106 E107 A113 T116	K105-E109 WeakPolarHBondContact CE-OE1 3.42Å; K105-E109 WeakPolarHBondContact CG-OE1 3.5Å; K105-E109 WeakPolarHBondContact O-CB 3.46Å; K105-E109 PolarHBondContact O-N 3.05Å; M106-E109 PolarHBondContact O-N 3.16Å; E107-E109 PolarHBondContact O-N 2.94Å; E109-A113 VanDerWaalsContact O-CA 3.27Å; E109-A113 WeakPolarHBondContact O-CA 3.47Å; E109-A113 PolarHBondContact O-N 3.43Å; E109-A113 VanDerWaalsContact O-N 3.16Å; E109-T116 VanDerWaalsContact CD-OG1 3.31Å; E109-T116 HydrophobicContact CG-CG2 3.72Å; E109-T116 VanDerWaalsContact CG-OG1 3.23Å; E109-T116 WeakPolarHBondContact CG-OG1 3.36Å; E109-T116 WeakPolarHBondContact OE1-CB 3.47Å; E109-T116 PolarHBondContact OE1-OG1 3.14Å
110	A	77.3	Confident	78.5	Confident	83 Å²	83	82.3 Å²	82.3	69%	0.686	45%	0.45	S	S	*	.	H	α-helix	trans	-74.7	-46	174.9	0	0	0	0	0	112.4	M106 E107 L108	M106-A110 WeakPolarHBondContact O-CB 3.28Å; M106-A110 PolarHBondContact O-N 2.85Å; E107-A110 PolarHBondContact O-N 3.35Å; L108-A110 VanDerWaalsContact C-N 3.32Å
111	D	74.6	Confident	78.1	Confident	126 Å²	126	85.1 Å²	85.1	67%	0.674	46%	0.458	S	S	*	.	H	α-helix	trans	-73.7	-38.1	178	-84.4	-5.3	0	0	0	112.1	E107	E107-D111 PolarHBondContact O-N 3.12Å; E107-D111 VanDerWaalsContact O-N 3.07Å
112	N	74.6	Confident	77.8	Confident	92 Å²	92	88 Å²	88	49%	0.492	46%	0.461	S	S	.	.	S	Bend	trans	-145.3	79.4	-178.2	-67.5	126.4	0	0	0	112.7	L108 G114 I115	L108-N112 CarbonylContact O-C 3.32Å; L108-N112 WeakPolarHBondContact O-CA 3.29Å; L108-N112 PolarHBondContact O-N 2.69Å; N112-G114 PolarHBondContact O-N 3.46Å; N112-I115 HydrophobicContact CB-CB 4.02Å; N112-I115 HydrophobicContact CB-CD1 3.42Å; N112-I115 VanDerWaalsContact CB-CD1 3.42Å; N112-I115 HydrophobicContact CB-CG1 3.68Å; N112-I115 WeakPolarHBondContact O-CB 3.44Å; N112-I115 PolarHBondContact O-N 3.48Å
113	A	76.5	Confident	77.3	Confident	92 Å²	92	87.7 Å²	87.7	76%	0.76	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.6	121.5	176.2	0	0	0	0	0	113.5	E109	E109-A113 VanDerWaalsContact O-CA 3.27Å; E109-A113 WeakPolarHBondContact O-CA 3.47Å; E109-A113 PolarHBondContact O-N 3.43Å; E109-A113 VanDerWaalsContact O-N 3.16Å
114	G	72.8	Confident	76.7	Confident	33 Å²	33	89.2 Å²	89.2	34%	0.34	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	89	-7.1	179.9	0	0	0	0	0	116.2	N112 T116 E117 I118	N112-G114 PolarHBondContact O-N 3.46Å; G114-T116 VanDerWaalsContact C-N 3.27Å; G114-T116 PolarHBondContact O-N 2.89Å; G114-E117 PolarHBondContact O-N 2.98Å; G114-I118 WeakPolarHBondContact O-CG1 3.42Å; G114-I118 PolarHBondContact O-N 3.49Å
115	I	77.7	Confident	76.3	Confident	61 Å²	61	91.6 Å²	91.6	31%	0.313	48%	0.479	S	S	.	.	H	α-helix	trans	-64.8	-31.7	177.1	-81.8	-164.5	0	0	0	112.4	N112 I118 L119	N112-I115 HydrophobicContact CB-CB 4.02Å; N112-I115 HydrophobicContact CB-CD1 3.42Å; N112-I115 VanDerWaalsContact CB-CD1 3.42Å; N112-I115 HydrophobicContact CB-CG1 3.68Å; N112-I115 WeakPolarHBondContact O-CB 3.44Å; N112-I115 PolarHBondContact O-N 3.48Å; I115-I118 PolarHBondContact O-N 3.04Å; I115-L119 HydrophobicContact CG2-CD1 3.6Å; I115-L119 VanDerWaalsContact O-CD1 3.28Å; I115-L119 WeakPolarHBondContact O-CD1 3.49Å; I115-L119 PolarHBondContact O-N 3.18Å
116	T	74.8	Confident	75.2	Confident	13 Å²	13	94.9 Å²	94.9	8%	0.08	50%	0.497	C	S	.	.	H	α-helix	trans	-61.2	-48.8	176.8	50.8	0	0	0	0	112.1	K105 L108 E109 G114 I118 L119 E120	K105-T116 HydrophobicContact CB-CG2 4.49Å; K105-T116 HydrophobicContact CG-CG2 3.69Å; K105-T116 WeakPolarHBondContact O-CG2 3.33Å; L108-T116 HydrophobicContact CB-CG2 3.64Å; L108-T116 HydrophobicContact CD1-CG2 4.09Å; E109-T116 VanDerWaalsContact CD-OG1 3.31Å; E109-T116 HydrophobicContact CG-CG2 3.72Å; E109-T116 VanDerWaalsContact CG-OG1 3.23Å; E109-T116 WeakPolarHBondContact CG-OG1 3.36Å; E109-T116 WeakPolarHBondContact OE1-CB 3.47Å; E109-T116 PolarHBondContact OE1-OG1 3.14Å; G114-T116 VanDerWaalsContact C-N 3.27Å; G114-T116 PolarHBondContact O-N 2.89Å; T116-I118 PolarHBondContact O-N 2.95Å; T116-L119 PolarHBondContact O-N 3.44Å; T116-E120 VanDerWaalsContact O-CB 3.25Å; T116-E120 WeakPolarHBondContact O-CB 3.34Å; T116-E120 PolarHBondContact O-N 3.18Å
117	E	75.9	Confident	74.6	Confident	108 Å²	108	94.8 Å²	94.8	51%	0.505	50%	0.5	S	S	.	.	H	α-helix	trans	-61.7	-31.8	175.2	-161	-153.1	118.9	0	0	112.3	G114 R121	G114-E117 PolarHBondContact O-N 2.98Å; E117-R121 WeakPolarHBondContact O-CB 3.32Å; E117-R121 PolarHBondContact O-N 3.12Å; E117-R121 PolarHBondContact O-NH1 3.23Å; E117-R121 IonicContact OE1-CZ 3.29Å; E117-R121 IonicContact OE1-NH1 2.69Å; E117-R121 PolarHBondContact OE1-NH1 3.35Å; E117-R121 IonicContact OE1-NH2 3.58Å; E117-R121 PolarHBondContact OE1-NH2 2.77Å
118	I	74.9	Confident	73.7	Confident	102 Å²	102	95.3 Å²	95.3	52%	0.523	51%	0.511	S	S	.	.	H	α-helix	trans	-72.8	-40	175.9	-65.7	167	0	0	0	111.1	G114 I115 T116 R122	G114-I118 WeakPolarHBondContact O-CG1 3.42Å; G114-I118 PolarHBondContact O-N 3.49Å; I115-I118 PolarHBondContact O-N 3.04Å; T116-I118 PolarHBondContact O-N 2.95Å; I118-R122 VanDerWaalsContact O-CB 3.25Å; I118-R122 WeakPolarHBondContact O-CB 3.33Å; I118-R122 PolarHBondContact O-N 2.63Å; I118-R122 VanDerWaalsContact O-N 3.16Å
119	L	75.1	Confident	72.5	Confident	100 Å²	100	98.5 Å²	98.5	52%	0.524	53%	0.534	S	S	.	.	H	α-helix	trans	-68.5	-44.4	173.6	-94.3	78.4	0	0	0	111.7	I115 T116 R122 S123	I115-L119 HydrophobicContact CG2-CD1 3.6Å; I115-L119 VanDerWaalsContact O-CD1 3.28Å; I115-L119 WeakPolarHBondContact O-CD1 3.49Å; I115-L119 PolarHBondContact O-N 3.18Å; T116-L119 PolarHBondContact O-N 3.44Å; L119-R122 CarbonylContact O-C 3.51Å; L119-R122 WeakPolarHBondContact O-CA 3.28Å; L119-R122 WeakPolarHBondContact O-CB 3.22Å; L119-R122 PolarHBondContact O-N 3.06Å; L119-S123 PolarHBondContact O-N 3.25Å; L119-S123 PolarHBondContact O-OG 2.79Å
120	E	77.9	Confident	70.9	Confident	100 Å²	100	100.4 Å²	100.4	47%	0.467	56%	0.556	S	S	.	*	H	α-helix	trans	-64.4	-40.9	-177.6	-169.7	167.6	176	0	0	111.4	K105 T116 R122 S123 L124	K105-E120 IonicContact NZ-OE1 2.67Å; K105-E120 IonicContact NZ-OE2 3.11Å; K105-E120 PolarHBondContact NZ-OE2 3.41Å; T116-E120 VanDerWaalsContact O-CB 3.25Å; T116-E120 WeakPolarHBondContact O-CB 3.34Å; T116-E120 PolarHBondContact O-N 3.18Å; E120-R122 VanDerWaalsContact C-N 3.35Å; E120-S123 PolarHBondContact O-OG 2.94Å; E120-L124 WeakPolarHBondContact O-CD1 3.31Å; E120-L124 VanDerWaalsContact O-CG 3.29Å; E120-L124 WeakPolarHBondContact O-CG 3.22Å; E120-L124 PolarHBondContact O-N 2.95Å
121	R	76.8	Confident	69.6	Low	124 Å²	124	104.6 Å²	104.6	47%	0.468	56%	0.562	S	S	.	*	H	α-helix	trans	-60.3	-42.9	168	180	176.5	-71.6	106.6	-4.3	111.9	E117 E125	E117-R121 WeakPolarHBondContact O-CB 3.32Å; E117-R121 PolarHBondContact O-N 3.12Å; E117-R121 PolarHBondContact O-NH1 3.23Å; E117-R121 IonicContact OE1-CZ 3.29Å; E117-R121 IonicContact OE1-NH1 2.69Å; E117-R121 PolarHBondContact OE1-NH1 3.35Å; E117-R121 IonicContact OE1-NH2 3.58Å; E117-R121 PolarHBondContact OE1-NH2 2.77Å; R121-E125 WeakPolarHBondContact O-CG 3.39Å; R121-E125 PolarHBondContact O-N 3.39Å; R121-E125 VanDerWaalsContact O-N 3.09Å
122	R	76.4	Confident	68.2	Low	173 Å²	173	104.5 Å²	104.5	65%	0.653	57%	0.568	S	S	*	*	H	α-helix	trans	-73.8	-30.6	-176.6	-172.5	175.1	-178.4	170.6	1.8	114	I118 L119 E120 M126	I118-R122 VanDerWaalsContact O-CB 3.25Å; I118-R122 WeakPolarHBondContact O-CB 3.33Å; I118-R122 PolarHBondContact O-N 2.63Å; I118-R122 VanDerWaalsContact O-N 3.16Å; L119-R122 CarbonylContact O-C 3.51Å; L119-R122 WeakPolarHBondContact O-CA 3.28Å; L119-R122 WeakPolarHBondContact O-CB 3.22Å; L119-R122 PolarHBondContact O-N 3.06Å; E120-R122 VanDerWaalsContact C-N 3.35Å; R122-M126 WeakPolarHBondContact O-CG 3.46Å; R122-M126 PolarHBondContact O-N 3.29Å
123	S	75.8	Confident	66.8	Low	55 Å²	55	106.4 Å²	106.4	39%	0.385	58%	0.582	S	S	.	*	H	α-helix	trans	-68.2	-45.4	172.2	48	0	0	0	0	110.8	L119 E120 E125 M126 D127	L119-S123 PolarHBondContact O-N 3.25Å; L119-S123 PolarHBondContact O-OG 2.79Å; E120-S123 PolarHBondContact O-OG 2.94Å; S123-E125 PolarHBondContact O-N 2.93Å; S123-M126 PolarHBondContact O-N 3.16Å; S123-D127 PolarHBondContact O-N 3.03Å
124	L	70.8	Confident	65.1	Low	120 Å²	120	108.9 Å²	108.9	63%	0.628	58%	0.583	S	S	*	*	H	α-helix	trans	-60.3	-32.3	175.1	-66.8	168.7	0	0	0	112.7	E120 S128	E120-L124 WeakPolarHBondContact O-CD1 3.31Å; E120-L124 VanDerWaalsContact O-CG 3.29Å; E120-L124 WeakPolarHBondContact O-CG 3.22Å; E120-L124 PolarHBondContact O-N 2.95Å; L124-S128 PolarHBondContact O-N 3.09Å
125	E	69.3	Low	63.6	Low	133 Å²	133	114.3 Å²	114.3	62%	0.621	60%	0.604	S	S	*	*	H	α-helix	trans	-70.7	-24.1	172.1	-76.5	172.5	-171.2	0	0	114.1	R121 S123	R121-E125 WeakPolarHBondContact O-CG 3.39Å; R121-E125 PolarHBondContact O-N 3.39Å; R121-E125 VanDerWaalsContact O-N 3.09Å; S123-E125 PolarHBondContact O-N 2.93Å
126	M	59	Low	61.9	Low	149 Å²	149	119.2 Å²	119.2	73%	0.734	63%	0.626	S	S	*	*	H	α-helix	trans	-92.3	-31	176.7	-64.5	-153.1	-45	0	0	113.8	R122 S123 S128	R122-M126 WeakPolarHBondContact O-CG 3.46Å; R122-M126 PolarHBondContact O-N 3.29Å; S123-M126 PolarHBondContact O-N 3.16Å; M126-S128 PolarHBondContact O-N 3.27Å
127	D	67.8	Low	60.3	Low	135 Å²	135	127.3 Å²	127.3	72%	0.722	66%	0.662	S	S	*	*	S	Bend	trans	-74.4	-8.9	173.8	-71.3	-35.4	0	0	0	112.8	S123 P129	S123-D127 PolarHBondContact O-N 3.03Å; D127-P129 WeakPolarHBondContact O-CD 3.2Å
128	S	64.6	Low	58.5	Low	77 Å²	77	127.4 Å²	127.4	54%	0.538	67%	0.67	S	S	.	*	S	Bend	trans	-80.6	107.1	170.3	-172.3	0	0	0	0	110.8	L124 M126 S130	L124-S128 PolarHBondContact O-N 3.09Å; M126-S128 PolarHBondContact O-N 3.27Å; S128-S130 PolarHBondContact O-N 3.32Å
129	P	50.3	Low	56.8	Low	111 Å²	111	131.6 Å²	131.6	72%	0.721	69%	0.687	S	S	*	*			trans	-65.1	125.1	176.3	27.5	-34.4	0	0	0	109.8	D127 Q131	D127-P129 WeakPolarHBondContact O-CD 3.2Å; P129-Q131 PolarHBondContact O-N 2.82Å
130	S	47	Very low	54.8	Low	121 Å²	121	131.5 Å²	131.5	85%	0.846	69%	0.694	S	S	*	*			trans	-63.9	96.9	-174.1	42.7	0	0	0	0	112.2	S128	S128-S130 PolarHBondContact O-N 3.32Å
131	Q	48.8	Very low	52.8	Low	172 Å²	172	136 Å²	136	80%	0.804	72%	0.715	S	S	*	*			trans	-61.5	141.3	176.7	-71.6	-156.1	0.2	0	0	111.3	P129 V133	P129-Q131 PolarHBondContact O-N 2.82Å; Q131-V133 PolarHBondContact O-N 2.75Å; Q131-V133 VanDerWaalsContact O-N 3.13Å
132	P	45.3	Very low	50.7	Low	123 Å²	123	135.2 Å²	135.2	80%	0.799	73%	0.728	S	S	*	*			trans	-67	114.5	178.9	27.5	-33.8	0	0	0	110.2	N134	P132-N134 PolarHBondContact O-N 3.44Å
133	V	46.3	Very low	48.5	Very low	132 Å²	132	132.4 Å²	132.4	80%	0.8	74%	0.736	S	S	*	*			trans	-61.8	98.9	177.9	-76.6	0	0	0	0	111.1	Q131 N135	Q131-V133 PolarHBondContact O-N 2.75Å; Q131-V133 VanDerWaalsContact O-N 3.13Å; V133-N135 VanDerWaalsContact C-N 3.32Å; V133-N135 PolarHBondContact O-N 3.29Å
134	N	39.3	Very low	46.3	Very low	144 Å²	144	135.1 Å²	135.1	77%	0.77	76%	0.755	S	S	*	*			trans	-73.2	86	178.5	-172.1	16.6	0	0	0	110.3	P132 H136	P132-N134 PolarHBondContact O-N 3.44Å; N134-H136 PolarHBondContact O-N 3.21Å
135	N	40.9	Very low	44.6	Very low	148 Å²	148	136.5 Å²	136.5	79%	0.791	76%	0.758	S	S	*	*			trans	-81.1	79.4	-160.3	-148.1	24.3	0	0	0	112.6	V133	V133-N135 VanDerWaalsContact C-N 3.32Å; V133-N135 PolarHBondContact O-N 3.29Å
136	H	43.5	Very low	43	Very low	164 Å²	164	137.3 Å²	137.3	76%	0.759	76%	0.759	S	S	*	*			trans	-116.8	83.3	174.6	-103.7	-71.6	0	0	0	112.1	N134	N134-H136 PolarHBondContact O-N 3.21Å
137	H	41.2	Very low	41.8	Very low	182 Å²	182	140.9 Å²	140.9	84%	0.843	76%	0.764	S	S	*	*			trans	-123.5	137.4	153.6	-156.7	71.6	0	0	0	110.1
138	V	37.7	Very low	40.3	Very low	110 Å²	110	143.7 Å²	143.7	67%	0.667	77%	0.77	S	S	*	*			trans	-95.7	148.2	-163	177.7	0	0	0	0	111	S140	V138-S140 PolarHBondContact O-N 3.31Å
139	H	38.9	Very low	38.7	Very low	190 Å²	190	151.1 Å²	151.1	88%	0.88	79%	0.788	S	S	*	*			trans	-58.7	132.3	173.2	-74.1	-33	0	0	0	113
140	S	33.1	Very low	37.6	Very low	98 Å²	98	150.5 Å²	150.5	69%	0.685	79%	0.787	S	S	*	*			trans	-153.2	90	154.2	48.3	0	0	0	0	113.7	V138	V138-S140 PolarHBondContact O-N 3.31Å
141	H	35.9	Very low	36.8	Very low	195 Å²	195	149.3 Å²	149.3	90%	0.903	78%	0.784	S	S	*	*			trans	63.1	146.9	148.2	-59.6	-75.5	0	0	0	122
142	S	32.4	Very low	36.6	Very low	107 Å²	107	146.3 Å²	146.3	75%	0.748	78%	0.779	S	S	*	*			trans	-126.9	175.6	176.5	60.3	0	0	0	0	110.4
143	S	30.1	Very low	35.9	Very low	115 Å²	115	146.2 Å²	146.2	80%	0.804	78%	0.776	S	S	*	*			trans	89.7	143.8	-175.9	-46.3	0	0	0	0	114.5
144	S	29.6	Very low	35.2	Very low	112 Å²	112	148 Å²	148	78%	0.783	78%	0.776	S	S	*	*			cis	-160.2	138.8	-7.8	34.6	0	0	0	0	114
145	E	34.7	Very low	34.9	Very low	148 Å²	148	149.8 Å²	149.8	69%	0.692	78%	0.779	S	S	*	*			trans	2.8	125.4	144.3	-136.3	-153.9	123.5	0	0	120.5
146	K	36.8	Very low	34.4	Very low	150 Å²	150	147.6 Å²	147.6	65%	0.652	77%	0.771	S	S	*	*				158.7	144.4	111.3	-87.5	167.9	172.9	76.7	0	118.2
147	R	33.3	Very low	33.8	Very low	224 Å²	224	146.5 Å²	146.5	85%	0.845	78%	0.776	S	S	*	*			trans	91.9	105.9	138.6	-165.2	171	-69.7	171.4	-1.1	123.5
148	K	36.6	Very low	33.1	Very low	195 Å²	195	146.3 Å²	146.3	85%	0.848	78%	0.776	S	S	*	*			trans	-22.4	151	152.4	-55.5	174.5	175.1	-178.2	0	120.8
149	Y	31.4	Very low	32.9	Very low	233 Å²	233	149.8 Å²	149.8	91%	0.914	79%	0.785	S	S	*	*			trans	-150.2	173.7	130.2	-137	-95.7	0	0	0	111.3
150	S	26.7	Very low	32.7	Very low	98 Å²	98	146.5 Å²	146.5	69%	0.685	78%	0.778	S	S	*	*			trans	-154.4	138.8	-166.7	59.3	0	0	0	0	119
151	A	29.5	Very low	33	Very low	95 Å²	95	147 Å²	147	79%	0.785	78%	0.778	S	S	*	*			trans	66.6	173.6	148.8	0	0	0	0	0	118.4
152	P	46.1	Very low	32.9	Very low	109 Å²	109	147.1 Å²	147.1	71%	0.708	78%	0.779	S	S	*	*			cis	-137.9	-173.1	-1.7	32.9	-9.2	0	0	0	117.5
153	T	30.9	Very low	33.1	Very low	121 Å²	121	151.5 Å²	151.5	74%	0.742	79%	0.785	S	S	*	*			trans	104.2	110.7	152.1	63.1	0	0	0	0	123.8
154	H	31.6	Very low	33.4	Very low	171 Å²	171	156 Å²	156	79%	0.792	79%	0.79	S	S	*	*			trans	46.1	124.4	138.6	-72.4	-94.9	0	0	0	123.9
155	H	31.9	Very low	33.5	Very low	180 Å²	180	160 Å²	160	83%	0.833	79%	0.794	S	S	*	*				-156.7	-165.5	81.1	69.7	-74.7	0	0	0	111.7
156	T	30.2	Very low	33.6	Very low	103 Å²	103	161.8 Å²	161.8	63%	0.632	80%	0.799	S	S	*	*			trans	-114	144.4	-156.2	51.7	0	0	0	0	115.2
157	T	31.4	Very low	33.9	Very low	141 Å²	141	159.1 Å²	159.1	87%	0.865	80%	0.8	S	S	*	*				-179.5	154.2	109.8	33.2	0	0	0	0	113.1
158	E	26.1	Very low	34.4	Very low	178 Å²	178	157.4 Å²	157.4	83%	0.832	80%	0.801	S	S	*	*			trans	-52.3	135	-179.8	-61.6	-72.1	108	0	0	116.6
159	H	33.9	Very low	34.7	Very low	183 Å²	183	152.1 Å²	152.1	85%	0.847	79%	0.794	S	S	*	*			trans	-157.1	153.1	132.1	-144.3	-92	0	0	0	112.6
160	V	34.3	Very low	35.2	Very low	121 Å²	121	147 Å²	147	73%	0.733	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-86.6	140.4	-171.9	179.8	0	0	0	0	111.9
161	P	38.8	Very low	36.2	Very low	108 Å²	108	149.2 Å²	149.2	70%	0.701	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-96.6	149.2	-171.3	36.5	-36.2	0	0	0	115.7
162	E	34.8	Very low	36.7	Very low	197 Å²	197	149.6 Å²	149.6	92%	0.921	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-70.4	155	165.7	-58.1	179.4	121.6	0	0	112.1
163	K	36	Very low	36.6	Very low	200 Å²	200	150 Å²	150	87%	0.87	78%	0.782	S	S	*	*			trans	-121.2	112.9	175.5	-74.4	-177.6	179	174.4	0	111.9	F165	K163-F165 PolarHBondContact O-N 3.04Å
164	K	36.9	Very low	37	Very low	210 Å²	210	151.6 Å²	151.6	91%	0.913	79%	0.786	S	S	*	*			trans	-63.2	125.9	164.7	-63.7	-177.1	178.4	-175.5	0	109.6
165	F	30.7	Very low	37.8	Very low	196 Å²	196	149.1 Å²	149.1	86%	0.86	78%	0.783	S	S	*	*			trans	-84.6	154.9	174.6	-156.8	-98.5	0	0	0	110.9	K163	K163-F165 PolarHBondContact O-N 3.04Å
166	K	37.9	Very low	38.5	Very low	184 Å²	184	145.7 Å²	145.7	80%	0.8	78%	0.779	S	S	*	*			trans	-115.6	126.8	-177.6	-60.2	-179.8	-179.7	-176.3	0	109.8
167	S	42.9	Very low	38.5	Very low	95 Å²	95	148 Å²	148	66%	0.664	79%	0.787	S	S	*	*			trans	-104	-18.6	-172.5	43.8	0	0	0	0	115.6	A169	S167-A169 PolarHBondContact O-N 2.84Å
168	E	43	Very low	38.6	Very low	188 Å²	188	146 Å²	146	88%	0.879	79%	0.785	S	S	*	*	G	3₁₀ helix	trans	-62.9	-16.7	-174.2	-70.8	-177.7	105.7	0	0	115.3	L170	E168-L170 PolarHBondContact O-N 3Å
169	A	43.3	Very low	39	Very low	84 Å²	84	142.2 Å²	142.2	69%	0.694	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-85.8	4.7	-172.8	0	0	0	0	0	115.4	S167	S167-A169 PolarHBondContact O-N 2.84Å
170	L	42	Very low	38.9	Very low	124 Å²	124	142.1 Å²	142.1	65%	0.649	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-110.7	-13	-174.8	-65.4	179.4	0	0	0	115.3	E168 S172	E168-L170 PolarHBondContact O-N 3Å; L170-S172 VanDerWaalsContact C-N 3.31Å; L170-S172 PolarHBondContact O-N 3.29Å
171	L	48.7	Very low	38.6	Very low	146 Å²	146	143.8 Å²	143.8	76%	0.764	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-8.2	-176	-105.7	76.7	0	0	0	115
172	S	40.2	Very low	38.2	Very low	102 Å²	102	143.8 Å²	143.8	71%	0.713	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	0.6	-177.2	-53.5	0	0	0	0	115.1	L170	L170-S172 VanDerWaalsContact C-N 3.31Å; L170-S172 PolarHBondContact O-N 3.29Å
173	T	43.1	Very low	37.9	Very low	117 Å²	117	140.9 Å²	140.9	72%	0.718	77%	0.765	S	S	*	*	S	Bend	trans	-114.6	5.8	-170.1	-35.1	0	0	0	0	113.8
174	L	39.3	Very low	38.2	Very low	156 Å²	156	136.9 Å²	136.9	82%	0.817	76%	0.759	S	S	*	*	S	Bend	trans	-109.8	2.2	-176.7	-68.2	176.3	0	0	0	114.8
175	T	47.5	Very low	37.7	Very low	119 Å²	119	130.6 Å²	130.6	73%	0.73	76%	0.755	S	S	*	*	S	Bend	trans	-118.2	20.8	-176.3	54.9	0	0	0	0	113.7
176	S	47.4	Very low	37.6	Very low	107 Å²	107	127.6 Å²	127.6	75%	0.748	76%	0.756	S	S	*	*	S	Bend	trans	-153.7	46.3	-176.3	-66.3	0	0	0	0	115.4
177	D	31.3	Very low	37.2	Very low	152 Å²	152	130.8 Å²	130.8	81%	0.813	76%	0.763	S	S	*	*			trans	-154.8	113.9	146.6	-147.7	-60.3	0	0	0	111.8
178	A	32.5	Very low	36.6	Very low	98 Å²	98	131.3 Å²	131.3	81%	0.81	77%	0.773	S	S	*	*			trans	-166.3	49.7	179.7	0	0	0	0	0	112.4
179	S	34.2	Very low	36	Very low	99 Å²	99	129.3 Å²	129.3	69%	0.692	77%	0.769	S	S	*	*			trans	-159.6	114.5	173.1	-83.6	0	0	0	0	113
180	K	31.4	Very low	35.4	Very low	182 Å²	182	131 Å²	131	79%	0.791	78%	0.775	S	S	*	*			trans	76.8	153	-177.6	-49.2	167.2	-174.2	173.1	0	112.4
181	E	28.2	Very low	34.8	Very low	156 Å²	156	131.3 Å²	131.3	73%	0.729	78%	0.782	S	S	*	*			cis	-163.2	175.9	-6	-122.6	178.3	89.7	0	0	108.6
182	N	30.3	Very low	34	Very low	108 Å²	108	129.9 Å²	129.9	58%	0.578	79%	0.785	S	S	*	*			cis	-153	153.2	3.9	179.8	-86	0	0	0	108.9
183	T	29.8	Very low	33.5	Very low	136 Å²	136	130.3 Å²	130.3	83%	0.834	79%	0.787	S	S	*	*			trans	-133.3	150.7	154.3	36.5	0	0	0	0	111.1
184	P	41.7	Very low	32.9	Very low	115 Å²	115	129.7 Å²	129.7	75%	0.747	79%	0.788	S	S	*	*			trans	-114.5	150.4	-136	39.1	-32.9	0	0	0	117.1
185	G	26.1	Very low	32.5	Very low	79 Å²	79	128 Å²	128	81%	0.814	78%	0.784	S	S	*	*			trans	103.5	143.8	166.4	0	0	0	0	0	114.3
186	C	29.1	Very low	31.6	Very low	132 Å²	132	129.4 Å²	129.4	89%	0.892	79%	0.788	S	S	*	*			cis	-150.5	179.7	-2.2	65.6	0	0	0	0	112.2
187	R	29.2	Very low	30.8	Very low	252 Å²	252	129.7 Å²	129.7	95%	0.951	79%	0.79	S	S	*	*			trans	-62.8	135.7	-162.6	-62.4	168.5	170.6	171.8	-5.6	116.1
188	A	30.6	Very low	30.7	Very low	105 Å²	105	126.8 Å²	126.8	87%	0.868	78%	0.777	S	S	*	*			trans	-153.9	151.9	132.6	0	0	0	0	0	109.8
189	N	30.3	Very low	30.6	Very low	147 Å²	147	132.3 Å²	132.3	79%	0.786	78%	0.778	S	S	*	*			trans	-138.9	131	-178.1	175.3	53.3	0	0	0	111
190	S	30.1	Very low	30.3	Very low	120 Å²	120	132.9 Å²	132.9	84%	0.839	78%	0.783	S	S	*	*			trans	-168.9	134.6	152.7	-83.8	0	0	0	0	111.8
191	T	29.4	Very low	30.2	Very low	129 Å²	129	130.6 Å²	130.6	79%	0.791	78%	0.783	S	S	*	*			trans	-91.7	144.4	176.4	45.4	0	0	0	0	112.6
192	S	31.9	Very low	30.3	Very low	117 Å²	117	130.2 Å²	130.2	82%	0.818	79%	0.787	S	S	*	*			trans	-167.8	115.8	134.3	55.8	0	0	0	0	114.9
193	S	30.7	Very low	31.3	Very low	110 Å²	110	129.9 Å²	129.9	77%	0.769	79%	0.79	S	S	*	*			trans	-20.5	145	153.9	-38.9	0	0	0	0	121.2
194	S	30.3	Very low	31.3	Very low	104 Å²	104	129.3 Å²	129.3	73%	0.727	79%	0.792	S	S	*	*				96	132.5	124.9	-71.9	0	0	0	0	124.7
195	T	30.1	Very low	31.1	Very low	121 Å²	121	132.6 Å²	132.6	74%	0.742	80%	0.797	S	S	*	*			trans	71.9	110.9	140.4	48.6	0	0	0	0	123.3
196	N	29.5	Very low	32.1	Very low	149 Å²	149	133.8 Å²	133.8	80%	0.797	79%	0.79	S	S	*	*				45.4	146.4	122.4	-68.9	-1.8	0	0	0	123.3
197	S	30.9	Very low	32.1	Very low	113 Å²	113	134.9 Å²	134.9	79%	0.79	79%	0.787	S	S	*	*			trans	77.7	144.9	149.5	-81	0	0	0	0	118.4
198	V	28.5	Very low	32.5	Very low	91 Å²	91	127.2 Å²	127.2	55%	0.552	78%	0.777	S	S	*	*			cis	-168.2	150.6	-13.3	75.2	0	0	0	0	112.1
199	Y	30.7	Very low	33.3	Very low	213 Å²	213	127.3 Å²	127.3	84%	0.835	77%	0.769	S	S	*	*			trans	53	175	169.5	-40.2	-54.6	0	0	0	116.3
200	S	27.1	Very low	33.5	Very low	112 Å²	112	131.8 Å²	131.8	78%	0.783	78%	0.776	S	S	*	*			cis	-150	-172	-11.8	-147.8	0	0	0	0	111.3
201	V	29.6	Very low	33.6	Very low	133 Å²	133	131.6 Å²	131.6	81%	0.806	78%	0.775	S	S	*	*			trans	-70.4	153.3	-171.5	-67.2	0	0	0	0	118.6
202	N	31.3	Very low	33.8	Very low	149 Å²	149	133.8 Å²	133.8	80%	0.797	78%	0.781	S	S	*	*			trans	-16.1	167.6	144.5	-133.7	10.8	0	0	0	118.4
203	P	50.4	Low	33.8	Very low	101 Å²	101	133.8 Å²	133.8	66%	0.656	78%	0.781	S	S	*	*			cis	-134.8	173.6	-8.6	41.9	-26.5	0	0	0	116.1
204	S	30.3	Very low	33.9	Very low	124 Å²	124	133.6 Å²	133.6	87%	0.867	78%	0.779	S	S	*	*			trans	169.7	154.3	133.3	-78	0	0	0	0	114.8
205	Q	37.7	Very low	34.2	Very low	184 Å²	184	136.8 Å²	136.8	86%	0.86	79%	0.787	S	S	*	*			trans	-106.9	-178	172.4	-113.3	-168	19.9	0	0	110.2
206	P	47.2	Very low	34.7	Very low	103 Å²	103	137 Å²	137	67%	0.669	79%	0.791	S	S	*	*			cis	-147.6	-164.8	29.7	34.3	-7.5	0	0	0	118.2
207	L	28.6	Very low	34.9	Very low	156 Å²	156	134.7 Å²	134.7	82%	0.817	79%	0.792	S	S	*	*			trans	87.8	96.6	162.8	-49.1	179.4	0	0	0	118
208	A	37.6	Very low	34.8	Very low	90 Å²	90	132.9 Å²	132.9	74%	0.744	79%	0.792	S	S	*	*				71.3	159.1	67	0	0	0	0	0	115.7
209	P	47.9	Very low	35.5	Very low	107 Å²	107	135 Å²	135	70%	0.695	81%	0.808	S	S	*	*			cis	-141.6	170.8	-44.6	39.9	-24.2	0	0	0	115.1
210	Y	33.6	Very low	35.5	Very low	241 Å²	241	128.5 Å²	128.5	95%	0.945	81%	0.805	S	S	*	*			trans	-149.2	159.2	148.6	17.1	-94.5	0	0	0	112.3
211	S	31.9	Very low	35.9	Very low	116 Å²	116	128.8 Å²	128.8	81%	0.811	81%	0.814	S	S	*	*			trans	-125.7	161.3	-149.9	-52.9	0	0	0	0	116.4
212	L	34	Very low	36	Very low	176 Å²	176	126.1 Å²	126.1	92%	0.921	81%	0.813	S	S	*	*			trans	-88.8	134.3	168.2	-79.9	160.8	0	0	0	112.4
213	S	32.1	Very low	36.9	Very low	116 Å²	116	124.3 Å²	124.3	81%	0.811	82%	0.819	S	S	*	*			trans	-165.9	153.7	165.9	-76.6	0	0	0	0	107.7
214	S	32.3	Very low	36.9	Very low	106 Å²	106	122 Å²	122	74%	0.741	81%	0.814	S	S	*	*			cis	-174.2	156.4	-21.1	50.1	0	0	0	0	107.4
215	L	38	Very low	37.7	Very low	171 Å²	171	120.4 Å²	120.4	90%	0.895	81%	0.809	S	S	*	*			trans	-69.6	156.7	-177.4	-68.8	160.5	0	0	0	114.5
216	P	39.9	Very low	38.1	Very low	125 Å²	125	119.1 Å²	119.1	81%	0.812	81%	0.806	S	S	*	*			trans	-124.6	174	133.2	37.6	-30.5	0	0	0	112.4
217	A	33.4	Very low	38.1	Very low	101 Å²	101	119.5 Å²	119.5	84%	0.835	81%	0.807	S	S	*	*			trans	-125.9	127.2	-161.2	0	0	0	0	0	116.7
218	G	29.7	Very low	39.2	Very low	75 Å²	75	119 Å²	119	77%	0.773	80%	0.802	S	S	*	*			trans	68	176.1	153	0	0	0	0	0	119.3
219	P	42.3	Very low	39.4	Very low	137 Å²	137	118.8 Å²	118.8	89%	0.89	80%	0.8	S	S	*	*			cis	-131.1	143.7	-20.3	37.3	-22	0	0	0	114.6
220	G	30	Very low	39	Very low	76 Å²	76	117 Å²	117	78%	0.784	79%	0.794	S	S	*	*			trans	111.1	151.2	156.1	0	0	0	0	0	118.3
221	A	36.7	Very low	39.8	Very low	117 Å²	117	108.3 Å²	108.3	97%	0.967	77%	0.772	S	S	*	*			trans	64.3	151.6	174.7	0	0	0	0	0	118.4
222	G	32.2	Very low	40.7	Very low	77 Å²	77	110.6 Å²	110.6	79%	0.794	77%	0.77	S	S	*	*			trans	113.2	64.8	165.2	0	0	0	0	0	117.5
223	A	49.9	Very low	41.1	Very low	111 Å²	111	105.7 Å²	105.7	92%	0.917	76%	0.755	S	S	*	*			trans	-72.2	130.5	161.4	0	0	0	0	0	109.9
224	G	49.1	Very low	41.9	Very low	53 Å²	53	105.3 Å²	105.3	55%	0.546	75%	0.747	S	S	.	*			trans	-176	-17.8	-179.5	0	0	0	0	0	118.8
225	A	47.4	Very low	42.6	Very low	91 Å²	91	108.2 Å²	108.2	75%	0.752	75%	0.749	S	S	*	*	S	Bend	trans	-90	-26.1	-171.6	0	0	0	0	0	115.7
226	I	45.9	Very low	42.8	Very low	156 Å²	156	104.3 Å²	104.3	80%	0.8	74%	0.742	S	S	*	*	S	Bend	trans	-87	-27.7	-165.6	-48.5	179.1	0	0	0	112.3	M228	I226-M228 PolarHBondContact O-N 2.67Å
227	T	48.7	Very low	43.2	Very low	112 Å²	112	104.2 Å²	104.2	69%	0.687	74%	0.739	S	S	*	*	H	α-helix	trans	-73.7	-24	-167	-38.4	0	0	0	0	114.7
228	M	49.9	Very low	43.9	Very low	146 Å²	146	103.2 Å²	103.2	72%	0.719	73%	0.731	S	S	*	*	H	α-helix	trans	-79	-29.6	-172.4	-73.2	-173.5	-75.1	0	0	114.3	I226	I226-M228 PolarHBondContact O-N 2.67Å
229	A	41.8	Very low	45	Very low	84 Å²	84	107.7 Å²	107.7	69%	0.694	73%	0.731	S	S	*	*	H	α-helix	trans	-69.9	-38.6	-179.2	0	0	0	0	0	112.6	A231	A229-A231 VanDerWaalsContact C-N 3.28Å; A229-A231 PolarHBondContact O-N 3.44Å
230	A	40.5	Very low	44.7	Very low	70 Å²	70	110.6 Å²	110.6	58%	0.579	74%	0.735	S	S	*	*	H	α-helix	trans	-68.1	-24.4	-178.4	0	0	0	0	0	113.7
231	A	50.8	Low	45.4	Very low	59 Å²	59	115.5 Å²	115.5	49%	0.488	74%	0.735	S	S	.	*	H	α-helix	trans	-72.9	-30.4	-174.2	0	0	0	0	0	113.9	A229	A229-A231 VanDerWaalsContact C-N 3.28Å; A229-A231 PolarHBondContact O-N 3.44Å
232	Q	50.3	Low	46.1	Very low	163 Å²	163	117.8 Å²	117.8	76%	0.762	73%	0.726	S	S	*	*	H	α-helix	trans	-77.4	-24.7	-174.6	-71	-174	-21.5	0	0	113.6	V234	Q232-V234 VanDerWaalsContact C-N 3.3Å; Q232-V234 PolarHBondContact O-N 2.58Å
233	A	42.8	Very low	46.5	Very low	74 Å²	74	117.5 Å²	117.5	61%	0.612	72%	0.723	S	S	*	*	H	α-helix	trans	-68.7	-26.7	177.9	0	0	0	0	0	113.5
234	V	48.1	Very low	46.1	Very low	107 Å²	107	124.2 Å²	124.2	65%	0.648	73%	0.725	S	S	*	*	H	α-helix	trans	-83	-25.2	-171.7	-176.6	0	0	0	0	112.9	Q232	Q232-V234 VanDerWaalsContact C-N 3.3Å; Q232-V234 PolarHBondContact O-N 2.58Å
235	Q	47.4	Very low	45.8	Very low	167 Å²	167	133.3 Å²	133.3	78%	0.78	74%	0.743	S	S	*	*	H	α-helix	trans	-84.2	-18.5	-177	-67.3	-174	-14.5	0	0	113.7	T237	Q235-T237 PolarHBondContact O-N 3.44Å
236	A	42.2	Very low	46.1	Very low	89 Å²	89	134.4 Å²	134.4	74%	0.736	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-16.9	-176.1	0	0	0	0	0	114.7
237	T	47.5	Very low	46	Very low	123 Å²	123	132.5 Å²	132.5	76%	0.755	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-1.9	-174.3	54.1	0	0	0	0	114.3	Q235	Q235-T237 PolarHBondContact O-N 3.44Å
238	A	49.8	Very low	46.2	Very low	80 Å²	80	131 Å²	131	66%	0.661	74%	0.735	S	S	*	*	S	Bend	trans	-84.3	-7.1	-172	0	0	0	0	0	115.3
239	Q	51.8	Low	46.1	Very low	169 Å²	169	130.9 Å²	130.9	79%	0.79	74%	0.737	S	S	*	*			trans	-140.9	78.8	-171	-63.8	-170.5	13.5	0	0	114.5
240	M	36.7	Very low	46.3	Very low	198 Å²	198	133.1 Å²	133.1	98%	0.975	73%	0.731	S	S	*	*			trans	-161.6	146.2	139.7	-111.9	162.1	-106.6	0	0	111
241	K	45.1	Very low	46.6	Very low	179 Å²	179	133.1 Å²	133.1	78%	0.778	73%	0.73	S	S	*	*			trans	-105.2	141.7	-165.4	-98	175.2	160.3	-92.3	0	113.4
242	E	49.9	Very low	46.4	Very low	165 Å²	165	133.5 Å²	133.5	77%	0.771	73%	0.73	S	S	*	*			trans	36.9	99.1	139.8	-65.1	160.8	121	0	0	118.6
243	G	41.3	Very low	46	Very low	72 Å²	72	135.1 Å²	135.1	74%	0.742	73%	0.73	S	S	*	*			trans	-155.3	98.2	167.8	0	0	0	0	0	113.3
244	R	42.2	Very low	46.2	Very low	252 Å²	252	136.8 Å²	136.8	95%	0.951	73%	0.725	S	S	*	*			trans	50.6	75.6	160.3	-154.3	-177.9	-153.7	-164.9	6	117.7
245	R	42.5	Very low	46.1	Very low	244 Å²	244	135.3 Å²	135.3	92%	0.921	72%	0.724	S	S	*	*			trans	-78.3	141.9	159.8	-77.1	179.9	167.2	144.8	-2.7	111.1
246	T	53.1	Low	46.3	Very low	113 Å²	113	134.4 Å²	134.4	69%	0.693	72%	0.723	S	S	*	*			trans	-78.1	161	170.9	48.1	0	0	0	0	111.5	S248	T246-S248 PolarHBondContact O-N 2.88Å
247	S	44.1	Very low	46.4	Very low	117 Å²	117	138.8 Å²	138.8	82%	0.818	73%	0.726	S	S	*	*	S	Bend	trans	-80.5	-10.1	-161.7	38.6	0	0	0	0	116.6
248	S	52.5	Low	46.3	Very low	81 Å²	81	139.6 Å²	139.6	57%	0.566	73%	0.725	S	S	*	*	H	α-helix	trans	-70	-43.7	-172.4	51.4	0	0	0	0	114.2	T246 K250 A251	T246-S248 PolarHBondContact O-N 2.88Å; S248-K250 VanDerWaalsContact C-N 3.26Å; S248-K250 PolarHBondContact O-N 2.89Å; S248-K250 VanDerWaalsContact O-N 3.16Å; S248-A251 PolarHBondContact O-N 3.43Å
249	L	46.9	Very low	45.6	Very low	143 Å²	143	143.3 Å²	143.3	75%	0.749	73%	0.734	S	S	*	*	H	α-helix	trans	-75.8	-0.9	-168.5	-69.6	173.3	0	0	0	115.6
250	K	46.7	Very low	44.7	Very low	131 Å²	131	142.3 Å²	142.3	57%	0.57	73%	0.734	S	S	*	*	H	α-helix	trans	-88.2	-39.3	172.1	-170.4	175.3	-176.1	-142.9	0	112.5	S248 S252 Y253 E254	S248-K250 VanDerWaalsContact C-N 3.26Å; S248-K250 PolarHBondContact O-N 2.89Å; S248-K250 VanDerWaalsContact O-N 3.16Å; K250-S252 VanDerWaalsContact C-N 3.34Å; K250-S252 PolarHBondContact O-N 3.49Å; K250-Y253 PolarHBondContact O-N 3.42Å; K250-E254 WeakPolarHBondContact CE-OE1 3.25Å; K250-E254 WeakPolarHBondContact CE-OE2 3.23Å; K250-E254 VanDerWaalsContact NZ-CD 3.32Å; K250-E254 IonicContact NZ-OE1 3.06Å; K250-E254 PolarHBondContact NZ-OE1 2.86Å; K250-E254 IonicContact NZ-OE2 2.79Å; K250-E254 PolarHBondContact NZ-OE2 3.22Å; K250-E254 VanDerWaalsContact NZ-OE2 3.11Å
251	A	48	Very low	44.3	Very low	69 Å²	69	140.1 Å²	140.1	57%	0.57	72%	0.719	S	S	*	*	H	α-helix	trans	-63	-38.7	-172.1	0	0	0	0	0	113	S248 Y253 A255	S248-A251 PolarHBondContact O-N 3.43Å; A251-Y253 VanDerWaalsContact C-N 3.29Å; A251-Y253 PolarHBondContact O-N 3.46Å; A251-A255 PolarHBondContact O-N 2.96Å
252	S	45.1	Very low	43.8	Very low	68 Å²	68	138.8 Å²	138.8	48%	0.476	72%	0.716	S	S	.	*	H	α-helix	trans	-66.9	-24.3	-180	45.5	0	0	0	0	114.2	K250	K250-S252 VanDerWaalsContact C-N 3.34Å; K250-S252 PolarHBondContact O-N 3.49Å
253	Y	43.2	Very low	42.9	Very low	197 Å²	197	139.5 Å²	139.5	77%	0.773	72%	0.724	S	S	*	*	H	α-helix	trans	-90.4	-25.4	-177.6	-146.1	-88	0	0	0	113.6	K250 A251	K250-Y253 PolarHBondContact O-N 3.42Å; A251-Y253 VanDerWaalsContact C-N 3.29Å; A251-Y253 PolarHBondContact O-N 3.46Å
254	E	45.9	Very low	42.3	Very low	109 Å²	109	139.1 Å²	139.1	51%	0.509	72%	0.721	S	S	.	*	H	α-helix	trans	-82.7	-26.6	174.2	-78.1	171.6	154.8	0	0	112.1	K250 I256	K250-E254 WeakPolarHBondContact CE-OE1 3.25Å; K250-E254 WeakPolarHBondContact CE-OE2 3.23Å; K250-E254 VanDerWaalsContact NZ-CD 3.32Å; K250-E254 IonicContact NZ-OE1 3.06Å; K250-E254 PolarHBondContact NZ-OE1 2.86Å; K250-E254 IonicContact NZ-OE2 2.79Å; K250-E254 PolarHBondContact NZ-OE2 3.22Å; K250-E254 VanDerWaalsContact NZ-OE2 3.11Å; E254-I256 PolarHBondContact O-N 3.45Å
255	A	46.6	Very low	42.2	Very low	75 Å²	75	138.1 Å²	138.1	62%	0.62	72%	0.717	S	S	*	*	H	α-helix	trans	-66.4	-31.6	179.7	0	0	0	0	0	114.8	A251	A251-A255 PolarHBondContact O-N 2.96Å
256	I	50.6	Low	41.7	Very low	149 Å²	149	133.6 Å²	133.6	76%	0.764	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-18.4	-174.1	-61.9	172	0	0	0	112.3	E254	E254-I256 PolarHBondContact O-N 3.45Å
257	K	45.5	Very low	40.5	Very low	181 Å²	181	137.6 Å²	137.6	79%	0.787	71%	0.714	S	S	*	*	S	Bend	trans	-91	-17.9	-168	-168.3	173.5	176.8	-174.9	0	115.2
258	N	44.8	Very low	39.9	Very low	140 Å²	140	136.7 Å²	136.7	75%	0.749	71%	0.708	S	S	*	*			trans	-117.6	19.7	-159.2	-79.1	8.7	0	0	0	115.5
259	N	34.2	Very low	38.9	Very low	157 Å²	157	140 Å²	140	84%	0.84	72%	0.719	S	S	*	*			trans	-111.6	93.8	-179.9	-154.3	-3.4	0	0	0	112.4
260	D	34.6	Very low	38.2	Very low	148 Å²	148	138.6 Å²	138.6	79%	0.791	72%	0.716	S	S	*	*			trans	-125.4	160	163.5	178.5	-141.5	0	0	0	108.1
261	F	27.9	Very low	37.4	Very low	153 Å²	153	144.1 Å²	144.1	67%	0.671	73%	0.733	S	S	*	*			trans	84.5	79.4	172.6	-146.9	-98.7	0	0	0	119.6
262	Q	34.6	Very low	36.5	Very low	150 Å²	150	149.4 Å²	149.4	70%	0.701	75%	0.746	S	S	*	*				69.3	102.9	118.6	-170.8	174	-45.6	0	0	121.4
263	L	31	Very low	35.8	Very low	180 Å²	180	153 Å²	153	94%	0.942	76%	0.76	S	S	*	*			trans	-172.8	136.9	136.1	-103.3	157.5	0	0	0	107.8
264	G	28.6	Very low	35.4	Very low	65 Å²	65	148.4 Å²	148.4	67%	0.67	76%	0.756	S	S	*	*			cis	-162.4	177	-7.9	0	0	0	0	0	109.8
265	R	39.6	Very low	34.6	Very low	230 Å²	230	146 Å²	146	87%	0.868	76%	0.761	S	S	*	*			trans	-66.7	150	168	-72.7	178.3	168.7	-171.4	-3.2	110
266	E	32.1	Very low	34	Very low	149 Å²	149	153.4 Å²	153.4	70%	0.696	77%	0.774	S	S	*	*				-167.5	158.7	107	-92.4	-37	120.2	0	0	112.5
267	F	27.8	Very low	33.2	Very low	197 Å²	197	151.2 Å²	151.2	86%	0.864	77%	0.772	S	S	*	*			trans	63.8	137	177.6	-92.8	-95.9	0	0	0	120
268	S	31.2	Very low	32.7	Very low	98 Å²	98	148 Å²	148	69%	0.685	77%	0.773	S	S	*	*			trans	-121.2	164.1	180	175.9	0	0	0	0	108.5
269	L	32	Very low	32.3	Very low	152 Å²	152	146.8 Å²	146.8	80%	0.796	78%	0.775	S	S	*	*				-167.1	121	124.8	-101.4	174.4	0	0	0	112.5
270	T	32	Very low	32.2	Very low	112 Å²	112	143.7 Å²	143.7	69%	0.687	77%	0.771	S	S	*	*			trans	36.5	114.4	146.5	54.7	0	0	0	0	120.8
271	R	30.7	Very low	32.2	Very low	247 Å²	247	144.6 Å²	144.6	93%	0.932	78%	0.775	S	S	*	*				-144	127.7	122.6	-169.8	166.6	-179.7	169.9	-0.4	111.2
272	E	28.2	Very low	32.4	Very low	180 Å²	180	142.1 Å²	142.1	84%	0.841	78%	0.783	S	S	*	*			trans	-86	135.3	174.8	-59.6	170.5	115.4	0	0	110.2
273	N	31.6	Very low	32.4	Very low	144 Å²	144	140 Å²	140	77%	0.77	79%	0.785	S	S	*	*				177	139.2	100.4	-172.2	22.8	0	0	0	111.7
274	S	33	Very low	32.3	Very low	100 Å²	100	137.5 Å²	137.5	70%	0.699	78%	0.777	S	S	*	*			trans	-47.7	155.6	158.4	20.1	0	0	0	0	114.3
275	G	29.2	Very low	32.5	Very low	58 Å²	58	142.1 Å²	142.1	60%	0.598	79%	0.785	S	S	*	*			cis	135.9	138.8	-3	0	0	0	0	0	113
276	Y	35.1	Very low	32.1	Very low	231 Å²	231	136.5 Å²	136.5	91%	0.906	78%	0.777	S	S	*	*			trans	67.2	152.9	174	-56.2	-78.6	0	0	0	116.2
277	S	33.1	Very low	32.2	Very low	103 Å²	103	137.7 Å²	137.7	72%	0.72	78%	0.783	S	S	*	*			cis	-151.7	155.9	-4.6	-131.3	0	0	0	0	114.8
278	S	34.7	Very low	32.2	Very low	114 Å²	114	135.3 Å²	135.3	80%	0.797	78%	0.779	S	S	*	*			trans	-36.3	126.9	172.7	-46.6	0	0	0	0	119.2
279	S	36.9	Very low	32.2	Very low	115 Å²	115	138.7 Å²	138.7	80%	0.804	79%	0.788	S	S	*	*			trans	-172.7	131.3	132.3	29	0	0	0	0	108.1
280	A	31.6	Very low	32.3	Very low	91 Å²	91	137.3 Å²	137.3	75%	0.752	79%	0.786	S	S	*	*			cis	110.4	133.1	27.2	0	0	0	0	0	111.4
281	L	34.9	Very low	33	Very low	168 Å²	168	137.3 Å²	137.3	88%	0.88	79%	0.788	S	S	*	*			trans	81.7	96.5	170	-51.9	-176.5	0	0	0	119.7
282	A	33.5	Very low	33	Very low	100 Å²	100	131 Å²	131	83%	0.826	78%	0.782	S	S	*	*				69	122.8	117.3	0	0	0	0	0	121.2
283	S	33.2	Very low	33.2	Very low	106 Å²	106	127 Å²	127	74%	0.741	78%	0.779	S	S	*	*			trans	-79.2	145.1	172.7	-47.6	0	0	0	0	113.8
284	T	30.2	Very low	33.2	Very low	128 Å²	128	124.8 Å²	124.8	79%	0.785	78%	0.781	S	S	*	*			trans	46.2	123.1	139.7	57.4	0	0	0	0	121.1
285	L	31.6	Very low	33.2	Very low	161 Å²	161	125 Å²	125	84%	0.843	78%	0.783	S	S	*	*			trans	-160.2	146.5	142.2	-111.6	162.5	0	0	0	113.5
286	T	32	Very low	33.2	Very low	112 Å²	112	128 Å²	128	69%	0.687	79%	0.785	S	S	*	*			trans	61.5	92.2	160	34.5	0	0	0	0	122.6
287	Q	33.7	Very low	33.3	Very low	175 Å²	175	121.1 Å²	121.1	82%	0.818	77%	0.771	S	S	*	*				50.7	130.2	114.7	-64.2	-175.8	5.8	0	0	124.1
288	N	27.6	Very low	33.3	Very low	146 Å²	146	126.3 Å²	126.3	78%	0.781	77%	0.774	S	S	*	*			trans	52.6	123.5	140.9	-76.2	12.5	0	0	0	123.1
289	L	31.8	Very low	33.2	Very low	170 Å²	170	124.3 Å²	124.3	89%	0.89	77%	0.772	S	S	*	*				-162.8	166.7	109.5	-102.2	162.2	0	0	0	111.1
290	T	34.4	Very low	33.2	Very low	122 Å²	122	131.2 Å²	131.2	75%	0.748	78%	0.781	S	S	*	*			trans	-127.3	-173.5	-175.1	65.8	0	0	0	0	110.2
291	P	47	Very low	33.3	Very low	112 Å²	112	136.8 Å²	136.8	73%	0.727	79%	0.788	S	S	*	*			cis	-127.9	180	-21.9	39.1	-24.6	0	0	0	113.1
292	S	30.5	Very low	33.3	Very low	115 Å²	115	134 Å²	134	80%	0.804	78%	0.783	S	S	*	*			trans	179.1	124.9	130.3	-84.3	0	0	0	0	116.6
293	A	30.9	Very low	33.4	Very low	95 Å²	95	138.8 Å²	138.8	79%	0.785	79%	0.785	S	S	*	*			trans	43.6	138.8	134.9	0	0	0	0	0	125.1
294	A	31.8	Very low	33.5	Very low	98 Å²	98	138.5 Å²	138.5	81%	0.81	78%	0.782	S	S	*	*			trans	72.3	146.1	146.2	0	0	0	0	0	119.8
295	S	33	Very low	33.4	Very low	106 Å²	106	138.2 Å²	138.2	74%	0.741	79%	0.786	S	S	*	*			cis	-166	132.6	-17.3	51.1	0	0	0	0	114.1
296	D	29.2	Very low	33.7	Very low	120 Å²	120	137.8 Å²	137.8	64%	0.642	78%	0.783	S	S	*	*			trans	56.6	-170.7	145.3	-151.8	2.2	0	0	0	118.9	R298	D296-R298 IonicContact OD1-NE 2.73Å; D296-R298 IonicContact OD1-NH2 3.66Å; D296-R298 IonicContact OD2-CZ 2.8Å; D296-R298 IonicContact OD2-NE 3.15Å; D296-R298 IonicContact OD2-NH2 3.89Å; D296-R298 PolarHBondContact OD2-NH2 3.02Å
297	S	36.7	Very low	33.6	Very low	86 Å²	86	142.4 Å²	142.4	60%	0.601	79%	0.794	S	S	*	*			trans	-151.5	-165.2	-138.1	68.4	0	0	0	0	114.4
298	R	34.9	Very low	33.6	Very low	212 Å²	212	139 Å²	139	80%	0.8	79%	0.789	S	S	*	*			trans	83.8	133.7	178	-41.3	137	-150.8	-148.4	11.7	112.9	D296	D296-R298 IonicContact OD1-NE 2.73Å; D296-R298 IonicContact OD1-NH2 3.66Å; D296-R298 IonicContact OD2-CZ 2.8Å; D296-R298 IonicContact OD2-NE 3.15Å; D296-R298 IonicContact OD2-NH2 3.89Å; D296-R298 PolarHBondContact OD2-NH2 3.02Å
299	G	31.3	Very low	33.9	Very low	73 Å²	73	138.1 Å²	138.1	75%	0.753	79%	0.794	S	S	*	*			cis	114.9	124.6	-1	0	0	0	0	0	113.4
300	R	36.7	Very low	33.8	Very low	260 Å²	260	135.8 Å²	135.8	98%	0.981	78%	0.783	S	S	*	*			trans	-154.5	160.9	173.3	-110.2	172.7	-174.8	-150.8	-1.7	113.2
301	K	34	Very low	33.9	Very low	208 Å²	208	139.1 Å²	139.1	90%	0.904	79%	0.789	S	S	*	*			trans	-163.6	129.6	-156.2	179.8	-178.7	-175.8	175.8	0	114.1
302	S	34.7	Very low	33.1	Very low	110 Å²	110	141.4 Å²	141.4	77%	0.769	79%	0.79	S	S	*	*			trans	-172.8	136	167.9	47.4	0	0	0	0	109.2
303	K	36.8	Very low	33.2	Very low	200 Å²	200	141.4 Å²	141.4	87%	0.87	79%	0.79	S	S	*	*			cis	75	127.1	35.9	-161.3	177.6	-178.5	178.5	0	111.9
304	S	34.7	Very low	33.3	Very low	99 Å²	99	141.7 Å²	141.7	69%	0.692	79%	0.786	S	S	*	*			cis	-172	166.4	-3.5	45.3	0	0	0	0	110.3
305	S	28.2	Very low	33.2	Very low	123 Å²	123	142.4 Å²	142.4	86%	0.86	79%	0.785	S	S	*	*				-178	179.1	129.2	-152.4	0	0	0	0	113.6
306	I	36.7	Very low	33.2	Very low	151 Å²	151	142.4 Å²	142.4	77%	0.774	79%	0.786	S	S	*	*			trans	-126.8	144	-170.6	-62.5	165.7	0	0	0	111.1
307	K	31.7	Very low	33.3	Very low	210 Å²	210	141.6 Å²	141.6	91%	0.913	79%	0.789	S	S	*	*			trans	-154.5	152.1	141.1	-150.1	166.8	-175.5	178.5	0	112.4
308	S	33.8	Very low	33.2	Very low	103 Å²	103	142.9 Å²	142.9	72%	0.72	80%	0.798	S	S	*	*			trans	-119	154.6	-176.4	-31.1	0	0	0	0	111.5
309	S	33.1	Very low	33	Very low	128 Å²	128	137.3 Å²	137.3	90%	0.895	79%	0.792	S	S	*	*			trans	-145.3	154	156.4	52.4	0	0	0	0	110.1
310	N	29.7	Very low	33.2	Very low	120 Å²	120	139.1 Å²	139.1	64%	0.642	79%	0.793	S	S	*	*			trans	-120.3	147.5	-170.8	170.6	47	0	0	0	109
311	H	35.8	Very low	33	Very low	192 Å²	192	131 Å²	131	89%	0.889	78%	0.776	S	S	*	*			trans	-161.8	159.2	151.2	-98.3	-64.5	0	0	0	110.9
312	Q	31.5	Very low	32.9	Very low	161 Å²	161	128.8 Å²	128.8	75%	0.752	77%	0.773	S	S	*	*			trans	-119.5	-172.1	-169.6	-62.5	173.4	-13.9	0	0	111
313	S	31	Very low	33	Very low	115 Å²	115	127.7 Å²	127.7	80%	0.804	77%	0.765	S	S	*	*			trans	84.6	153.9	173	79	0	0	0	0	116.9
314	S	33.5	Very low	32.7	Very low	100 Å²	100	123.2 Å²	123.2	70%	0.699	76%	0.759	S	S	*	*				-177.5	136.9	-54.3	45.7	0	0	0	0	110.9
315	S	31.2	Very low	32.4	Very low	113 Å²	113	124 Å²	124	79%	0.79	76%	0.764	S	S	*	*			trans	42.4	105.8	149	62	0	0	0	0	121.8
316	S	31.6	Very low	32.7	Very low	107 Å²	107	123.5 Å²	123.5	75%	0.748	76%	0.76	S	S	*	*				-170.1	135.7	129.4	43.2	0	0	0	0	108.1
317	S	31.9	Very low	32.6	Very low	103 Å²	103	121.2 Å²	121.2	72%	0.72	76%	0.757	S	S	*	*			cis	85.4	144.4	33.3	81.2	0	0	0	0	114.4
318	S	34.9	Very low	32.9	Very low	112 Å²	112	116.4 Å²	116.4	78%	0.783	75%	0.751	S	S	*	*			trans	61.8	152.9	-175.4	39.3	0	0	0	0	117.1
319	S	31.1	Very low	33.1	Very low	96 Å²	96	116.6 Å²	116.6	67%	0.671	75%	0.752	S	S	*	*			cis	169.3	146.4	-45	47.1	0	0	0	0	108.9
320	S	34.6	Very low	33.1	Very low	110 Å²	110	115 Å²	115	77%	0.769	75%	0.746	S	S	*	*			trans	60.2	168.1	163.7	71.3	0	0	0	0	115.8
321	S	33	Very low	33.3	Very low	89 Å²	89	117.9 Å²	117.9	62%	0.622	76%	0.761	S	S	*	*			cis	-161.1	156.2	7	-10.9	0	0	0	0	110.6
322	L	31.2	Very low	33.2	Very low	162 Å²	162	112.5 Å²	112.5	85%	0.848	75%	0.75	S	S	*	*			trans	65.4	166.1	151.5	-59.8	166.1	0	0	0	116.5
323	S	37.6	Very low	33.5	Very low	87 Å²	87	113 Å²	113	61%	0.608	75%	0.752	S	S	*	*			cis	-152.1	146.8	-11.9	-117.1	0	0	0	0	108.4
324	S	30.9	Very low	33.8	Very low	106 Å²	106	114.3 Å²	114.3	74%	0.741	75%	0.745	S	S	*	*				73.3	96.1	75.2	-42.2	0	0	0	0	117.1
325	C	28.1	Very low	33.6	Very low	117 Å²	117	117.5 Å²	117.5	79%	0.791	75%	0.754	S	S	*	*			trans	-168.8	133.9	145.7	48.3	0	0	0	0	107.6
326	S	33.2	Very low	33.8	Very low	112 Å²	112	115.8 Å²	115.8	78%	0.783	74%	0.741	S	S	*	*				75.1	130	59.2	-57.7	0	0	0	0	113.1
327	S	36.3	Very low	34.1	Very low	102 Å²	102	118.6 Å²	118.6	71%	0.713	74%	0.743	S	S	*	*			cis	-164.1	170.4	-5	-86.1	0	0	0	0	110.9
328	S	37.3	Very low	34.1	Very low	110 Å²	110	123.1 Å²	123.1	77%	0.769	75%	0.752	S	S	*	*			trans	15.2	147.4	136.5	-51	0	0	0	0	120.8
329	S	37.6	Very low	34.3	Very low	106 Å²	106	122.6 Å²	122.6	74%	0.741	76%	0.755	S	S	*	*			cis	-178.9	158.3	-0.6	43.3	0	0	0	0	112.4
330	A	34.2	Very low	34.3	Very low	95 Å²	95	122.5 Å²	122.5	79%	0.785	76%	0.76	S	S	*	*			trans	33.2	134.1	142.1	0	0	0	0	0	122.8
331	L	32.2	Very low	34.4	Very low	181 Å²	181	124.3 Å²	124.3	95%	0.948	77%	0.766	S	S	*	*			trans	-143.9	150.9	137.1	-105.5	172.2	0	0	0	108.9
332	A	34.8	Very low	34.5	Very low	79 Å²	79	127 Å²	127	65%	0.653	77%	0.773	S	S	*	*			trans	-155.5	174	-172.8	0	0	0	0	0	112.1
333	Q	38	Very low	35.3	Very low	171 Å²	171	125.4 Å²	125.4	80%	0.799	77%	0.772	S	S	*	*			trans	69.1	149.6	172.8	-70.9	167.3	-109	0	0	115.3
334	E	36.1	Very low	35.4	Very low	143 Å²	143	129.9 Å²	129.9	67%	0.668	78%	0.783	S	S	*	*			cis	-157	157.9	0.1	-139.5	171.5	100.5	0	0	111.5
335	L	29	Very low	35.6	Very low	167 Å²	167	129.6 Å²	129.6	87%	0.874	79%	0.788	S	S	*	*				-166.4	152.8	115.4	-153.3	57.3	0	0	0	113
336	S	36.2	Very low	35.8	Very low	76 Å²	76	132 Å²	132	53%	0.531	79%	0.793	S	S	.	*			trans	-88.9	179.9	173.6	-106.9	0	0	0	0	111.7
337	Q	37	Very low	36.3	Very low	167 Å²	167	131.6 Å²	131.6	78%	0.78	80%	0.796	S	S	*	*			cis	-166.9	152.8	11.3	-130.2	146.7	55.5	0	0	110.4
338	Q	33.7	Very low	36.3	Very low	197 Å²	197	132.1 Å²	132.1	92%	0.921	79%	0.791	S	S	*	*			trans	164.2	159.8	130.8	-91.2	173.9	9.6	0	0	112.1
339	A	37.3	Very low	36.6	Very low	102 Å²	102	132.8 Å²	132.8	84%	0.843	80%	0.796	S	S	*	*			trans	-149.8	149.8	-173.8	0	0	0	0	0	112.8
340	A	32.3	Very low	36.6	Very low	94 Å²	94	133.9 Å²	133.9	78%	0.777	79%	0.789	S	S	*	*			trans	-156.3	116.4	170	0	0	0	0	0	113.7
341	V	35.4	Very low	37.2	Very low	147 Å²	147	134.9 Å²	134.9	89%	0.891	79%	0.785	S	S	*	*			trans	39.6	128.1	138	-160.3	0	0	0	0	121
342	L	35.4	Very low	37.5	Very low	146 Å²	146	131.3 Å²	131.3	76%	0.764	77%	0.767	S	S	*	*			trans	-80.5	165	170.4	-57	171.6	0	0	0	112.7
343	P	47.8	Very low	37.7	Very low	128 Å²	128	138.5 Å²	138.5	83%	0.831	78%	0.777	S	S	*	*				-139.2	169.2	88.4	38.8	-25.6	0	0	0	114.9
344	E	39.8	Very low	38.3	Very low	181 Å²	181	135.4 Å²	135.4	85%	0.846	77%	0.77	S	S	*	*			trans	-87	157.3	-176.9	-60.8	144.6	107.4	0	0	113.9
345	A	36.4	Very low	39.1	Very low	101 Å²	101	135.4 Å²	135.4	84%	0.835	77%	0.765	S	S	*	*			trans	-158	126.8	151.9	0	0	0	0	0	110.3
346	D	32.4	Very low	40.6	Very low	168 Å²	168	132.2 Å²	132.2	90%	0.898	75%	0.749	S	S	*	*			trans	-44.1	129.4	-171.9	-96.9	-87.7	0	0	0	118.2
347	A	43.3	Very low	42.2	Very low	102 Å²	102	134.9 Å²	134.9	84%	0.843	76%	0.764	S	S	*	*			trans	-160.1	86.1	148.9	0	0	0	0	0	111.4
348	N	35.4	Very low	43.7	Very low	113 Å²	113	133.4 Å²	133.4	60%	0.604	76%	0.762	S	S	*	*			trans	-169.2	88.4	145.9	-164.2	20.4	0	0	0	112.8	Q350	N348-Q350 WeakPolarHBondContact ND2-CB 3.24Å; N348-Q350 PolarHBondContact ND2-OE1 3.06Å; N348-Q350 PolarHBondContact O-N 3.4Å; N348-Q350 VanDerWaalsContact OD1-CB 3.29Å; N348-Q350 WeakPolarHBondContact OD1-CB 3.34Å; N348-Q350 PolarHBondContact OD1-N 3.25Å
349	S	44.5	Very low	45.7	Very low	125 Å²	125	127.4 Å²	127.4	87%	0.874	73%	0.734	S	S	*	*			trans	-79.8	47.7	169.3	64.7	0	0	0	0	112.2
350	Q	38.1	Very low	47.6	Very low	129 Å²	129	126 Å²	126	60%	0.603	72%	0.716	S	S	*	*			trans	-80	114.4	168.9	175.8	177.6	-2.9	0	0	107.6	N348 D352	N348-Q350 WeakPolarHBondContact ND2-CB 3.24Å; N348-Q350 PolarHBondContact ND2-OE1 3.06Å; N348-Q350 PolarHBondContact O-N 3.4Å; N348-Q350 VanDerWaalsContact OD1-CB 3.29Å; N348-Q350 WeakPolarHBondContact OD1-CB 3.34Å; N348-Q350 PolarHBondContact OD1-N 3.25Å; Q350-D352 PolarHBondContact O-N 3.03Å
351	V	46.6	Very low	50.1	Low	116 Å²	116	127.6 Å²	127.6	70%	0.703	70%	0.702	S	S	*	*			trans	-74.4	79.6	171.3	-176.3	0	0	0	0	108	W353	V351-W353 PolarHBondContact O-N 3.48Å
352	D	38.7	Very low	52.5	Low	105 Å²	105	123.7 Å²	123.7	56%	0.561	67%	0.672	S	S	*	*			trans	-67.8	113.3	169.2	-173.2	19.6	0	0	0	108.2	Q350 T354	Q350-D352 PolarHBondContact O-N 3.03Å; D352-T354 HydrophobicContact CB-CG2 4.25Å; D352-T354 PolarHBondContact O-N 2.71Å; D352-T354 WeakPolarHBondContact OD2-CG2 3.17Å
353	W	37.7	Very low	55	Low	231 Å²	231	117 Å²	117	88%	0.875	64%	0.636	S	S	*	*			trans	-75	67	173.6	-75.1	97.5	0	0	0	109.1	V351 Y355	V351-W353 PolarHBondContact O-N 3.48Å; W353-Y355 PolarHBondContact O-N 2.69Å
354	T	50.7	Low	56.9	Low	105 Å²	105	115.3 Å²	115.3	64%	0.644	62%	0.62	S	S	*	*			trans	-57	106.8	174.2	49.1	0	0	0	0	108.4	D352 D356	D352-T354 HydrophobicContact CB-CG2 4.25Å; D352-T354 PolarHBondContact O-N 2.71Å; D352-T354 WeakPolarHBondContact OD2-CG2 3.17Å; T354-D356 PolarHBondContact O-N 3.5Å
355	Y	52.8	Low	59.3	Low	143 Å²	143	108.9 Å²	108.9	56%	0.561	59%	0.594	S	S	*	*			trans	-68	93.2	-177.6	-168.1	-84.5	0	0	0	108.4	W353 P357 V368	W353-Y355 PolarHBondContact O-N 2.69Å; Y355-P357 WeakPolarHBondContact O-CD 3.45Å; Y355-V368 HydrophobicContact CE1-CG1 4.42Å; Y355-V368 WeakPolarHBondContact OH-CG1 3.39Å
356	D	61.5	Low	61.5	Low	100 Å²	100	108.7 Å²	108.7	54%	0.535	58%	0.579	S	S	.	*			trans	-54.7	113.1	-172.7	-172.7	-20.8	0	0	0	109.6	T354 N358 E359	T354-D356 PolarHBondContact O-N 3.5Å; D356-N358 PolarHBondContact O-N 2.96Å; D356-N358 VanDerWaalsContact OD1-CB 3.3Å; D356-N358 WeakPolarHBondContact OD1-CB 3.21Å; D356-N358 PolarHBondContact OD1-N 3.01Å; D356-E359 PolarHBondContact O-N 3.27Å
357	P	68.9	Low	63.9	Low	133 Å²	133	104.3 Å²	104.3	86%	0.864	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-10.5	-177.7	-23.2	35.2	0	0	0	113.8	Y355	Y355-P357 WeakPolarHBondContact O-CD 3.45Å
358	N	70	Confident	66	Low	136 Å²	136	100.4 Å²	100.4	73%	0.727	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	5.1	-176.9	-163.3	69	0	0	0	113.9	D356	D356-N358 PolarHBondContact O-N 2.96Å; D356-N358 VanDerWaalsContact OD1-CB 3.3Å; D356-N358 WeakPolarHBondContact OD1-CB 3.21Å; D356-N358 PolarHBondContact OD1-N 3.01Å
359	E	75.2	Confident	68.3	Low	71 Å²	71	97.8 Å²	97.8	33%	0.332	51%	0.51	S	S	.	.	S	Bend	trans	-63.9	127.1	172.9	-166	-170.1	154.5	0	0	110.6	D356 R361 V368 S369	D356-E359 PolarHBondContact O-N 3.27Å; E359-R361 PolarHBondContact O-N 3Å; E359-V368 HydrophobicContact CB-CG1 3.99Å; E359-V368 HydrophobicContact CG-CB 4.48Å; E359-V368 HydrophobicContact CG-CG1 4.15Å; E359-V368 WeakPolarHBondContact OE1-CB 3.3Å; E359-V368 WeakPolarHBondContact OE2-CB 3.39Å; E359-V368 WeakPolarHBondContact OE2-CG1 3.28Å; E359-S369 VanDerWaalsContact OE1-CB 3.32Å; E359-S369 WeakPolarHBondContact OE1-CB 3.38Å; E359-S369 PolarHBondContact OE1-N 3.23Å; E359-S369 PolarHBondContact OE1-OG 3.04Å
360	P	77	Confident	70.2	Confident	71 Å²	71	97.5 Å²	97.5	46%	0.461	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-60.4	134.8	178.5	23.5	-34.5	0	0	0	112.3	Y362	P360-Y362 HydrophobicContact CB-CE2 4.27Å; P360-Y362 HydrophobicContact CG-CE2 3.94Å; P360-Y362 VanDerWaalsContact CG-OH 3.28Å; P360-Y362 WeakPolarHBondContact CG-OH 3.26Å; P360-Y362 WeakPolarHBondContact O-CD2 3.35Å; P360-Y362 VanDerWaalsContact O-CE2 3.32Å; P360-Y362 WeakPolarHBondContact O-CE2 3.46Å
361	R	83.6	Confident	72.4	Confident	128 Å²	128	95.1 Å²	95.1	48%	0.483	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-88.2	128.1	178.9	-71.1	172.4	176.9	-91.9	-6.1	110.8	E359 N366	E359-R361 PolarHBondContact O-N 3Å; R361-N366 WeakPolarHBondContact CD-O 3.38Å; R361-N366 PolarHBondContact NH1-O 3Å
362	Y	86.3	Confident	74.4	Confident	66 Å²	66	95.2 Å²	95.2	26%	0.259	49%	0.493	S	S	.	.	B	Isolated β-bridge	trans	-113.8	176	179.8	-57.7	-72	0	0	0	111.4	P360 N366 Q367 S369 M373 W385	P360-Y362 HydrophobicContact CB-CE2 4.27Å; P360-Y362 HydrophobicContact CG-CE2 3.94Å; P360-Y362 VanDerWaalsContact CG-OH 3.28Å; P360-Y362 WeakPolarHBondContact CG-OH 3.26Å; P360-Y362 WeakPolarHBondContact O-CD2 3.35Å; P360-Y362 VanDerWaalsContact O-CE2 3.32Å; P360-Y362 WeakPolarHBondContact O-CE2 3.46Å; Y362-N366 WeakPolarHBondContact O-CA 3.28Å; Y362-N366 PolarHBondContact O-N 3.43Å; Y362-Q367 PolarHBondContact N-O 2.74Å; Y362-Q367 PolarHBondContact O-N 2.9Å; Y362-Q367 VanDerWaalsContact O-N 3.13Å; Y362-S369 WeakPolarHBondContact CE2-OG 3.49Å; Y362-M373 HydrophobicContact CD2-CE 4.23Å; Y362-M373 HydrophobicContact CG-CE 4.15Å; Y362-W385 HydrophobicContact CD1-CB 4.04Å; Y362-W385 HydrophobicContact CD1-CG 4.43Å; Y362-W385 HydrophobicContact CG-CB 4.3Å
363	C	89.3	Confident	76.8	Confident	4 Å²	4	92.2 Å²	92.2	3%	0.027	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	170.7	176	-165	0	0	0	0	115.3	C365 N366 I383 W385 F386 H387 C390	C363-C365 PolarHBondContact O-N 2.98Å; C363-N366 PolarHBondContact O-N 3.38Å; C363-N366 VanDerWaalsContact O-N 3.14Å; C363-I383 VanDerWaalsContact N-CG2 3.27Å; C363-W385 VanDerWaalsContact CA-O 3.24Å; C363-W385 WeakPolarHBondContact CA-O 3.45Å; C363-W385 PolarHBondContact N-O 3.17Å; C363-F386 HydrophobicContact CB-CD1 4.44Å; C363-H387 VanDerWaalsContact CB-CE1 3.43Å; C363-H387 WeakPolarHBondContact CB-CE1 3.25Å; C363-H387 WeakPolarHBondContact CB-ND1 3.48Å; C363-H387 PolarHBondContact SG-N 2.93Å; C363-H387 VanDerWaalsContact SG-N 3.39Å; C363-H387 PolarHBondContact SG-ND1 3.19Å; C363-C390 WeakPolarHBondContact SG-CB 3.5Å
364	I	86.9	Confident	79.4	Confident	94 Å²	94	81.8 Å²	81.8	48%	0.482	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-15.5	174.2	61.5	173.6	0	0	0	113.6	N366 F386 C390	I364-N366 VanDerWaalsContact C-N 3.31Å; I364-F386 HydrophobicContact CG2-CD1 4.13Å; I364-F386 HydrophobicContact CG2-CE1 3.81Å; I364-C390 HydrophobicContact CG1-CB 4.35Å
365	C	89.1	Confident	81.3	Confident	45 Å²	45	78 Å²	78	30%	0.304	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-10.3	172.8	63.1	0	0	0	0	113	C363 Q367 H387	C363-C365 PolarHBondContact O-N 2.98Å; C365-Q367 HydrophobicContact CB-CG 4.23Å; C365-Q367 PolarHBondContact O-N 3.3Å; C365-H387 PolarHBondContact SG-CE1 2.93Å; C365-H387 PolarHBondContact SG-ND1 2.8Å
366	N	84	Confident	83.1	Confident	97 Å²	97	72 Å²	72	52%	0.519	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	48.3	-179.7	-165.2	57	0	0	0	112.4	R361 Y362 C363 I364	R361-N366 WeakPolarHBondContact CD-O 3.38Å; R361-N366 PolarHBondContact NH1-O 3Å; Y362-N366 WeakPolarHBondContact O-CA 3.28Å; Y362-N366 PolarHBondContact O-N 3.43Å; C363-N366 PolarHBondContact O-N 3.38Å; C363-N366 VanDerWaalsContact O-N 3.14Å; I364-N366 VanDerWaalsContact C-N 3.31Å
367	Q	82.2	Confident	84.5	Confident	76 Å²	76	70.6 Å²	70.6	36%	0.355	39%	0.391	S	S	.	.	B	Isolated β-bridge	trans	-120.9	168	-179.9	-62.5	-66.5	15.9	0	0	111.3	Y362 C365 Y370	Y362-Q367 PolarHBondContact N-O 2.74Å; Y362-Q367 PolarHBondContact O-N 2.9Å; Y362-Q367 VanDerWaalsContact O-N 3.13Å; C365-Q367 HydrophobicContact CB-CG 4.23Å; C365-Q367 PolarHBondContact O-N 3.3Å; Q367-Y370 HydrophobicContact CB-CE1 4.08Å
368	V	87.8	Confident	85.3	Confident	20 Å²	20	65.9 Å²	65.9	12%	0.121	36%	0.358	C	S	.	.			trans	-59.2	173.2	175.6	-65.9	0	0	0	0	114.1	Y355 E359 Y370 H387	Y355-V368 HydrophobicContact CE1-CG1 4.42Å; Y355-V368 WeakPolarHBondContact OH-CG1 3.39Å; E359-V368 HydrophobicContact CB-CG1 3.99Å; E359-V368 HydrophobicContact CG-CB 4.48Å; E359-V368 HydrophobicContact CG-CG1 4.15Å; E359-V368 WeakPolarHBondContact OE1-CB 3.3Å; E359-V368 WeakPolarHBondContact OE2-CB 3.39Å; E359-V368 WeakPolarHBondContact OE2-CG1 3.28Å; V368-Y370 WeakPolarHBondContact O-CD1 3.27Å; V368-Y370 PolarHBondContact O-N 3.16Å; V368-H387 PolarHBondContact O-NE2 2.93Å
369	S	83.8	Confident	85.9	Confident	59 Å²	59	65.5 Å²	65.5	41%	0.413	36%	0.361	S	S	.	.			trans	-65.2	119.4	174.3	-35.4	0	0	0	0	110.2	E359 Y362	E359-S369 VanDerWaalsContact OE1-CB 3.32Å; E359-S369 WeakPolarHBondContact OE1-CB 3.38Å; E359-S369 PolarHBondContact OE1-N 3.23Å; E359-S369 PolarHBondContact OE1-OG 3.04Å; Y362-S369 WeakPolarHBondContact CE2-OG 3.49Å
370	Y	83.3	Confident	86.3	Confident	119 Å²	119	67.7 Å²	67.7	47%	0.467	38%	0.375	S	S	.	.			trans	-151.6	138	173.7	71.3	-97.7	0	0	0	113.7	Q367 V368 H387	Q367-Y370 HydrophobicContact CB-CE1 4.08Å; V368-Y370 WeakPolarHBondContact O-CD1 3.27Å; V368-Y370 PolarHBondContact O-N 3.16Å; Y370-H387 AromaticContact CD1-CD2 3.67Å; Y370-H387 AromaticContact CD1-CE1 3.96Å; Y370-H387 AromaticContact CD1-NE2 3.32Å; Y370-H387 VanDerWaalsContact CD1-NE2 3.32Å; Y370-H387 WeakPolarHBondContact CD1-NE2 3.46Å; Y370-H387 AromaticContact CE1-CD2 3.65Å; Y370-H387 AromaticContact CE1-CE1 3.52Å; Y370-H387 AromaticContact CE1-CG 3.96Å; Y370-H387 AromaticContact CE1-ND1 3.92Å; Y370-H387 AromaticContact CE1-NE2 3.34Å; Y370-H387 VanDerWaalsContact CE1-NE2 3.34Å; Y370-H387 WeakPolarHBondContact CE1-NE2 3.49Å; Y370-H387 AromaticContact CG-CD2 3.91Å; Y370-H387 AromaticContact CG-NE2 3.99Å; Y370-H387 AromaticContact CZ-CD2 3.89Å; Y370-H387 AromaticContact CZ-CG 3.88Å; Y370-H387 PolarHBondContact O-CD2 3.08Å; Y370-H387 VanDerWaalsContact O-CD2 3.3Å
371	G	85.3	Confident	86.7	Confident	78 Å²	78	64.6 Å²	64.6	80%	0.804	36%	0.355	S	S	*	.	S	Bend	trans	59.2	-148.4	179.2	0	0	0	0	0	113.6
372	E	87.4	Confident	86.7	Confident	118 Å²	118	63.9 Å²	63.9	55%	0.551	37%	0.367	S	S	*	.	S	Bend	trans	-79.6	130.1	179.5	-62.1	-171.5	108.7	0	0	112.5	Y388	E372-Y388 HydrophobicContact CB-CD1 4.01Å; E372-Y388 HydrophobicContact CB-CD2 3.51Å; E372-Y388 HydrophobicContact CB-CE1 4.03Å; E372-Y388 HydrophobicContact CB-CE2 3.53Å; E372-Y388 HydrophobicContact CB-CG 3.74Å; E372-Y388 HydrophobicContact CG-CD2 4.28Å; E372-Y388 HydrophobicContact CG-CE2 4.08Å; E372-Y388 PolarHBondContact O-N 2.88Å; E372-Y388 VanDerWaalsContact OE2-CD2 3.26Å; E372-Y388 WeakPolarHBondContact OE2-CD2 3.33Å; E372-Y388 WeakPolarHBondContact OE2-CE2 3.49Å
373	M	90.8	Very high	86.6	Confident	43 Å²	43	62.8 Å²	62.8	21%	0.212	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	140.5	-178.1	-60.9	-178.2	75.2	0	0	111.4	Y362 W385 F386	Y362-M373 HydrophobicContact CD2-CE 4.23Å; Y362-M373 HydrophobicContact CG-CE 4.15Å; M373-W385 HydrophobicContact CE-CB 3.96Å; M373-F386 CarbonylContact C-O 3.53Å; M373-F386 VanDerWaalsContact CA-O 3.3Å; M373-F386 WeakPolarHBondContact CA-O 3.45Å
374	V	91.1	Very high	86.6	Confident	11 Å²	11	67.5 Å²	67.5	7%	0.067	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.9	176.1	63.1	0	0	0	0	110.6	W385 F386 Y388 V391 L393 P397 W401	V374-W385 WeakPolarHBondContact O-CA 3.48Å; V374-F386 HydrophobicContact CG1-CB 4.12Å; V374-F386 WeakPolarHBondContact CG1-O 3.48Å; V374-F386 PolarHBondContact N-O 2.87Å; V374-F386 PolarHBondContact O-N 3.46Å; V374-Y388 HydrophobicContact CB-CD1 4.22Å; V374-Y388 HydrophobicContact CB-CE1 3.94Å; V374-Y388 HydrophobicContact CG1-CD1 4.48Å; V374-V391 HydrophobicContact CG1-CG2 4.02Å; V374-L393 HydrophobicContact CB-CD1 4.07Å; V374-L393 HydrophobicContact CG1-CD1 3.72Å; V374-L393 HydrophobicContact CG2-CD1 4.29Å; V374-P397 HydrophobicContact CG2-CG 3.84Å; V374-W401 HydrophobicContact CB-CE3 4.36Å; V374-W401 HydrophobicContact CB-CZ3 4.46Å; V374-W401 HydrophobicContact CG1-CD2 4.16Å; V374-W401 HydrophobicContact CG1-CE3 3.88Å; V374-W401 HydrophobicContact CG1-CH2 3.58Å; V374-W401 HydrophobicContact CG1-CZ2 3.9Å; V374-W401 HydrophobicContact CG1-CZ3 3.57Å; V374-W401 HydrophobicContact CG2-CB 4.27Å; V374-W401 HydrophobicContact CG2-CD2 3.72Å; V374-W401 HydrophobicContact CG2-CE3 3.57Å; V374-W401 HydrophobicContact CG2-CG 4.04Å; V374-W401 HydrophobicContact CG2-CZ3 4.12Å
375	G	90.8	Very high	86.8	Confident	26 Å²	26	68.6 Å²	68.6	27%	0.268	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	142.8	169.9	0	0	0	0	0	111.9	E384	G375-E384 CarbonylContact C-O 3.57Å; G375-E384 WeakPolarHBondContact CA-O 3.4Å
376	C	91.8	Very high	87	Confident	16 Å²	16	66.5 Å²	66.5	11%	0.108	37%	0.371	C	S	.	.			trans	-89.9	118.7	177.3	-175.9	0	0	0	0	111.2	N378 C381 E384 F386 W401 C403 C406	C376-N378 PolarHBondContact O-N 2.95Å; C376-C381 HydrophobicContact CB-CB 4.3Å; C376-E384 WeakPolarHBondContact CB-O 3.45Å; C376-E384 PolarHBondContact N-O 3.01Å; C376-F386 HydrophobicContact CB-CE2 3.98Å; C376-W401 HydrophobicContact CB-CE3 4.42Å; C376-W401 HydrophobicContact CB-CZ3 4.11Å; C376-C403 HydrophobicContact CB-CB 4.37Å; C376-C403 PolarHBondContact SG-N 2.97Å; C376-C406 VanDerWaalsContact SG-SG 3.7Å
377	D	90.3	Very high	87.4	Confident	71 Å²	71	62 Å²	62	38%	0.38	35%	0.347	S	S	.	.	S	Bend	trans	-62.4	2.2	-179.4	-88.8	-86.5	0	0	0	115.6	K400 W401 F402	D377-K400 HydrophobicContact CB-CB 4.32Å; D377-K400 HydrophobicContact CB-CD 4.39Å; D377-K400 IonicContact OD1-NZ 3.17Å; D377-K400 WeakPolarHBondContact OD2-CA 3.5Å; D377-K400 WeakPolarHBondContact OD2-CB 3.4Å; D377-W401 WeakPolarHBondContact CB-O 3.45Å; D377-W401 PolarHBondContact N-O 3.46Å; D377-W401 PolarHBondContact OD2-N 3.45Å; D377-F402 HydrophobicContact CB-CD1 3.9Å; D377-F402 HydrophobicContact CB-CE1 3.4Å; D377-F402 HydrophobicContact CB-CZ 3.89Å
378	N	85.8	Confident	87.8	Confident	34 Å²	34	59.8 Å²	59.8	18%	0.182	34%	0.335	C	S	.	.			trans	-98	109	179.3	-178.7	84.9	0	0	0	110.2	C376 D380 C381 F402 C406 M410	C376-N378 PolarHBondContact O-N 2.95Å; N378-D380 VanDerWaalsContact ND2-C 3.28Å; N378-D380 WeakPolarHBondContact ND2-CA 3.24Å; N378-D380 PolarHBondContact ND2-N 3.36Å; N378-D380 PolarHBondContact O-N 3.49Å; N378-C381 PolarHBondContact ND2-N 3.27Å; N378-C381 WeakPolarHBondContact O-CB 3.44Å; N378-C381 PolarHBondContact O-N 3.35Å; N378-F402 HydrophobicContact CB-CD1 3.91Å; N378-F402 HydrophobicContact CB-CE1 4.18Å; N378-C406 HydrophobicContact CB-CB 4.09Å; N378-M410 HydrophobicContact CB-CE 4.17Å; N378-M410 WeakPolarHBondContact OD1-CE 3.21Å
379	T	82.9	Confident	87.8	Confident	129 Å²	129	62.2 Å²	62.2	79%	0.791	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-21.9	179.7	52.9	0	0	0	0	114.8	C381	T379-C381 VanDerWaalsContact C-N 3.3Å; T379-C381 PolarHBondContact O-N 3Å
380	D	82.8	Confident	88	Confident	116 Å²	116	61.3 Å²	61.3	62%	0.62	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	21.4	178.4	-48.7	-7.2	0	0	0	111.8	N378	N378-D380 VanDerWaalsContact ND2-C 3.28Å; N378-D380 WeakPolarHBondContact ND2-CA 3.24Å; N378-D380 PolarHBondContact ND2-N 3.36Å; N378-D380 PolarHBondContact O-N 3.49Å
381	C	85.9	Confident	88.2	Confident	7 Å²	7	57.1 Å²	57.1	5%	0.047	34%	0.344	C	S	.	.			trans	-90.5	119.3	-177	-167.9	0	0	0	0	111.4	C376 N378 T379 I383 E384 C406	C376-C381 HydrophobicContact CB-CB 4.3Å; N378-C381 PolarHBondContact ND2-N 3.27Å; N378-C381 WeakPolarHBondContact O-CB 3.44Å; N378-C381 PolarHBondContact O-N 3.35Å; T379-C381 VanDerWaalsContact C-N 3.3Å; T379-C381 PolarHBondContact O-N 3Å; C381-I383 PolarHBondContact O-N 3.25Å; C381-I383 VanDerWaalsContact O-N 3.17Å; C381-E384 WeakPolarHBondContact O-CG 3.47Å; C381-C406 VanDerWaalsContact SG-SG 3.64Å
382	P	83.6	Confident	88.3	Confident	112 Å²	112	56.6 Å²	56.6	73%	0.727	34%	0.339	S	S	*	.	S	Bend	trans	-77.6	-0.7	-172.4	32.1	-37.8	0	0	0	115.4
383	I	84.4	Confident	88.2	Confident	44 Å²	44	52.8 Å²	52.8	23%	0.226	32%	0.322	C	S	.	.	S	Bend	trans	-121.2	-27.9	-177.6	-64.1	172.1	0	0	0	111.2	C363 C381 W385 F386	C363-I383 VanDerWaalsContact N-CG2 3.27Å; C381-I383 PolarHBondContact O-N 3.25Å; C381-I383 VanDerWaalsContact O-N 3.17Å; I383-W385 WeakPolarHBondContact CG2-O 2.98Å; I383-W385 PolarHBondContact O-N 3.06Å; I383-F386 HydrophobicContact CB-CE1 4.16Å; I383-F386 HydrophobicContact CB-CE2 4.45Å; I383-F386 HydrophobicContact CB-CZ 3.74Å; I383-F386 HydrophobicContact CD1-CE1 4.27Å; I383-F386 HydrophobicContact CD1-CZ 4.46Å; I383-F386 HydrophobicContact CG2-CD1 4.36Å; I383-F386 HydrophobicContact CG2-CE1 3.73Å; I383-F386 HydrophobicContact CG2-CE2 4.27Å; I383-F386 HydrophobicContact CG2-CZ 3.68Å
384	E	89.3	Confident	87.9	Confident	103 Å²	103	56.7 Å²	56.7	48%	0.481	35%	0.349	S	S	.	.			trans	57.1	-51.8	-177	-58.1	-171.8	162.3	0	0	116.5	G375 C376 C381	G375-E384 CarbonylContact C-O 3.57Å; G375-E384 WeakPolarHBondContact CA-O 3.4Å; C376-E384 WeakPolarHBondContact CB-O 3.45Å; C376-E384 PolarHBondContact N-O 3.01Å; C381-E384 WeakPolarHBondContact O-CG 3.47Å
385	W	91.3	Very high	87.6	Confident	116 Å²	116	62.4 Å²	62.4	44%	0.439	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	140.1	-169.2	-61.4	91.2	0	0	0	113.4	Y362 C363 M373 V374 I383	Y362-W385 HydrophobicContact CD1-CB 4.04Å; Y362-W385 HydrophobicContact CD1-CG 4.43Å; Y362-W385 HydrophobicContact CG-CB 4.3Å; C363-W385 VanDerWaalsContact CA-O 3.24Å; C363-W385 WeakPolarHBondContact CA-O 3.45Å; C363-W385 PolarHBondContact N-O 3.17Å; M373-W385 HydrophobicContact CE-CB 3.96Å; V374-W385 WeakPolarHBondContact O-CA 3.48Å; I383-W385 WeakPolarHBondContact CG2-O 2.98Å; I383-W385 PolarHBondContact O-N 3.06Å
386	F	92.6	Very high	87.3	Confident	1 Å²	1	64 Å²	64	0%	0.004	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	132.2	-175.2	-57.8	-94.9	0	0	0	111.9	C363 I364 M373 V374 C376 I383 V391 W401 C403	C363-F386 HydrophobicContact CB-CD1 4.44Å; I364-F386 HydrophobicContact CG2-CD1 4.13Å; I364-F386 HydrophobicContact CG2-CE1 3.81Å; M373-F386 CarbonylContact C-O 3.53Å; M373-F386 VanDerWaalsContact CA-O 3.3Å; M373-F386 WeakPolarHBondContact CA-O 3.45Å; V374-F386 HydrophobicContact CG1-CB 4.12Å; V374-F386 WeakPolarHBondContact CG1-O 3.48Å; V374-F386 PolarHBondContact N-O 2.87Å; V374-F386 PolarHBondContact O-N 3.46Å; C376-F386 HydrophobicContact CB-CE2 3.98Å; I383-F386 HydrophobicContact CB-CE1 4.16Å; I383-F386 HydrophobicContact CB-CE2 4.45Å; I383-F386 HydrophobicContact CB-CZ 3.74Å; I383-F386 HydrophobicContact CD1-CE1 4.27Å; I383-F386 HydrophobicContact CD1-CZ 4.46Å; I383-F386 HydrophobicContact CG2-CD1 4.36Å; I383-F386 HydrophobicContact CG2-CE1 3.73Å; I383-F386 HydrophobicContact CG2-CE2 4.27Å; I383-F386 HydrophobicContact CG2-CZ 3.68Å; F386-V391 HydrophobicContact CB-CG1 3.71Å; F386-V391 HydrophobicContact CB-CG2 4.43Å; F386-V391 HydrophobicContact CD1-CG1 4.09Å; F386-V391 HydrophobicContact CG-CG1 4.1Å; F386-W401 HydrophobicContact CB-CH2 4.22Å; F386-W401 AromaticContact CD2-CH2 3.94Å; F386-W401 HydrophobicContact CD2-CH2 3.94Å; F386-W401 AromaticContact CD2-CZ3 3.83Å; F386-W401 HydrophobicContact CD2-CZ3 3.83Å; F386-W401 HydrophobicContact CE2-CZ3 4.43Å; F386-W401 HydrophobicContact CG-CH2 4.13Å; F386-W401 HydrophobicContact CG-CZ3 4.46Å; F386-C403 HydrophobicContact CD1-CB 4.48Å; F386-C403 HydrophobicContact CD2-CB 3.94Å; F386-C403 HydrophobicContact CE1-CB 4.04Å; F386-C403 HydrophobicContact CE2-CB 3.45Å; F386-C403 VanDerWaalsContact CE2-CB 3.45Å; F386-C403 HydrophobicContact CG-CB 4.45Å; F386-C403 HydrophobicContact CZ-CB 3.5Å
387	H	92.6	Very high	86.9	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.019	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	137.4	174	-42.1	96.3	0	0	0	111	C363 C365 V368 Y370 G389 C390 V391	C363-H387 VanDerWaalsContact CB-CE1 3.43Å; C363-H387 WeakPolarHBondContact CB-CE1 3.25Å; C363-H387 WeakPolarHBondContact CB-ND1 3.48Å; C363-H387 PolarHBondContact SG-N 2.93Å; C363-H387 VanDerWaalsContact SG-N 3.39Å; C363-H387 PolarHBondContact SG-ND1 3.19Å; C365-H387 PolarHBondContact SG-CE1 2.93Å; C365-H387 PolarHBondContact SG-ND1 2.8Å; V368-H387 PolarHBondContact O-NE2 2.93Å; Y370-H387 AromaticContact CD1-CD2 3.67Å; Y370-H387 AromaticContact CD1-CE1 3.96Å; Y370-H387 AromaticContact CD1-NE2 3.32Å; Y370-H387 VanDerWaalsContact CD1-NE2 3.32Å; Y370-H387 WeakPolarHBondContact CD1-NE2 3.46Å; Y370-H387 AromaticContact CE1-CD2 3.65Å; Y370-H387 AromaticContact CE1-CE1 3.52Å; Y370-H387 AromaticContact CE1-CG 3.96Å; Y370-H387 AromaticContact CE1-ND1 3.92Å; Y370-H387 AromaticContact CE1-NE2 3.34Å; Y370-H387 VanDerWaalsContact CE1-NE2 3.34Å; Y370-H387 WeakPolarHBondContact CE1-NE2 3.49Å; Y370-H387 AromaticContact CG-CD2 3.91Å; Y370-H387 AromaticContact CG-NE2 3.99Å; Y370-H387 AromaticContact CZ-CD2 3.89Å; Y370-H387 AromaticContact CZ-CG 3.88Å; Y370-H387 PolarHBondContact O-CD2 3.08Å; Y370-H387 VanDerWaalsContact O-CD2 3.3Å; H387-G389 PolarHBondContact O-N 2.62Å; H387-C390 HydrophobicContact CB-CB 4.39Å; H387-C390 WeakPolarHBondContact O-CB 3.4Å; H387-C390 PolarHBondContact O-N 2.79Å; H387-V391 PolarHBondContact O-N 3.05Å
388	Y	91.6	Very high	86.4	Confident	29 Å²	29	71.4 Å²	71.4	11%	0.114	42%	0.417	C	S	.	.	H	α-helix	trans	-50	-51.5	-176	-83.9	18.1	0	0	0	113.2	E372 V374 C390 V391 G392 L393 A396	E372-Y388 HydrophobicContact CB-CD1 4.01Å; E372-Y388 HydrophobicContact CB-CD2 3.51Å; E372-Y388 HydrophobicContact CB-CE1 4.03Å; E372-Y388 HydrophobicContact CB-CE2 3.53Å; E372-Y388 HydrophobicContact CB-CG 3.74Å; E372-Y388 HydrophobicContact CG-CD2 4.28Å; E372-Y388 HydrophobicContact CG-CE2 4.08Å; E372-Y388 PolarHBondContact O-N 2.88Å; E372-Y388 VanDerWaalsContact OE2-CD2 3.26Å; E372-Y388 WeakPolarHBondContact OE2-CD2 3.33Å; E372-Y388 WeakPolarHBondContact OE2-CE2 3.49Å; V374-Y388 HydrophobicContact CB-CD1 4.22Å; V374-Y388 HydrophobicContact CB-CE1 3.94Å; V374-Y388 HydrophobicContact CG1-CD1 4.48Å; Y388-C390 VanDerWaalsContact C-N 3.26Å; Y388-C390 PolarHBondContact O-N 3.04Å; Y388-V391 CarbonylContact O-C 3.56Å; Y388-V391 WeakPolarHBondContact O-CG2 3.13Å; Y388-V391 PolarHBondContact O-N 3.41Å; Y388-V391 VanDerWaalsContact O-N 3.08Å; Y388-G392 PolarHBondContact O-N 3.07Å; Y388-L393 CarbonylContact C-O 3.46Å; Y388-L393 HydrophobicContact CD1-CB 4.31Å; Y388-L393 HydrophobicContact CD1-CD1 4.3Å; Y388-L393 HydrophobicContact CD2-CB 4.42Å; Y388-L393 HydrophobicContact CG-CB 4.01Å; Y388-L393 PolarHBondContact O-N 3.16Å; Y388-A396 WeakPolarHBondContact OH-CA 3.39Å; Y388-A396 WeakPolarHBondContact OH-CB 3.26Å
389	G	86.6	Confident	86.3	Confident	71 Å²	71	72.6 Å²	72.6	73%	0.732	44%	0.438	S	S	*	.	H	α-helix	trans	-62.6	-27.6	179.9	0	0	0	0	0	114.5	H387 V391	H387-G389 PolarHBondContact O-N 2.62Å; G389-V391 VanDerWaalsContact C-N 3.34Å
390	C	88.5	Confident	86.5	Confident	40 Å²	40	74 Å²	74	27%	0.27	43%	0.433	S	S	.	.	H	α-helix	trans	-77.7	-18.1	176.8	-64.8	0	0	0	0	113.4	C363 I364 H387 Y388	C363-C390 WeakPolarHBondContact SG-CB 3.5Å; I364-C390 HydrophobicContact CG1-CB 4.35Å; H387-C390 HydrophobicContact CB-CB 4.39Å; H387-C390 WeakPolarHBondContact O-CB 3.4Å; H387-C390 PolarHBondContact O-N 2.79Å; Y388-C390 VanDerWaalsContact C-N 3.26Å; Y388-C390 PolarHBondContact O-N 3.04Å
391	V	87.9	Confident	86.9	Confident	30 Å²	30	70.3 Å²	70.3	18%	0.182	41%	0.41	C	S	.	.	H	α-helix	trans	-114.3	6.3	177.4	-64.7	0	0	0	0	113.7	V374 F386 H387 Y388 G389 L393 W401	V374-V391 HydrophobicContact CG1-CG2 4.02Å; F386-V391 HydrophobicContact CB-CG1 3.71Å; F386-V391 HydrophobicContact CB-CG2 4.43Å; F386-V391 HydrophobicContact CD1-CG1 4.09Å; F386-V391 HydrophobicContact CG-CG1 4.1Å; H387-V391 PolarHBondContact O-N 3.05Å; Y388-V391 CarbonylContact O-C 3.56Å; Y388-V391 WeakPolarHBondContact O-CG2 3.13Å; Y388-V391 PolarHBondContact O-N 3.41Å; Y388-V391 VanDerWaalsContact O-N 3.08Å; G389-V391 VanDerWaalsContact C-N 3.34Å; V391-L393 HydrophobicContact CG2-CB 4.4Å; V391-L393 HydrophobicContact CG2-CD1 3.86Å; V391-L393 HydrophobicContact CG2-CG 3.95Å; V391-W401 HydrophobicContact CB-CH2 4.32Å; V391-W401 HydrophobicContact CB-CZ2 3.94Å; V391-W401 HydrophobicContact CG1-CH2 4.06Å; V391-W401 HydrophobicContact CG1-CZ2 4.16Å; V391-W401 HydrophobicContact CG2-CH2 4.2Å; V391-W401 HydrophobicContact CG2-CZ2 3.84Å
392	G	87.2	Confident	87.1	Confident	68 Å²	68	72.9 Å²	72.9	70%	0.701	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	24.6	177.7	0	0	0	0	0	114.4	Y388	Y388-G392 PolarHBondContact O-N 3.07Å
393	L	85.5	Confident	87.4	Confident	37 Å²	37	67.6 Å²	67.6	19%	0.194	39%	0.386	C	S	.	.			trans	-91.3	150.5	170	-66.1	173.9	0	0	0	110.4	V374 Y388 V391 P397 W401	V374-L393 HydrophobicContact CB-CD1 4.07Å; V374-L393 HydrophobicContact CG1-CD1 3.72Å; V374-L393 HydrophobicContact CG2-CD1 4.29Å; Y388-L393 CarbonylContact C-O 3.46Å; Y388-L393 HydrophobicContact CD1-CB 4.31Å; Y388-L393 HydrophobicContact CD1-CD1 4.3Å; Y388-L393 HydrophobicContact CD2-CB 4.42Å; Y388-L393 HydrophobicContact CG-CB 4.01Å; Y388-L393 PolarHBondContact O-N 3.16Å; V391-L393 HydrophobicContact CG2-CB 4.4Å; V391-L393 HydrophobicContact CG2-CD1 3.86Å; V391-L393 HydrophobicContact CG2-CG 3.95Å; L393-P397 HydrophobicContact CD1-CG 4.28Å; L393-W401 HydrophobicContact CD1-CZ2 4.39Å
394	T	83.6	Confident	87.5	Confident	126 Å²	126	69.3 Å²	69.3	77%	0.773	40%	0.4	S	S	*	.	S	Bend	trans	-131.5	-2.9	172.4	61.3	0	0	0	0	112.7
395	E	84.4	Confident	87.4	Confident	130 Å²	130	69.3 Å²	69.3	61%	0.607	40%	0.4	S	S	*	.	S	Bend	trans	-149.1	158.4	177.8	-70.8	-174	-166.5	0	0	108.3
396	A	85.3	Confident	87.3	Confident	60 Å²	60	64.3 Å²	64.3	50%	0.496	38%	0.383	S	S	.	.			trans	-61.1	125.9	174.9	0	0	0	0	0	111.8	Y388 K398	Y388-A396 WeakPolarHBondContact OH-CA 3.39Å; Y388-A396 WeakPolarHBondContact OH-CB 3.26Å; A396-K398 PolarHBondContact O-N 2.85Å
397	P	83.1	Confident	87.1	Confident	45 Å²	45	67.6 Å²	67.6	29%	0.292	40%	0.403	S	S	.	.			trans	-68.2	133.9	-178.9	26.6	-32.5	0	0	0	111.3	V374 L393 G399 W401	V374-P397 HydrophobicContact CG2-CG 3.84Å; L393-P397 HydrophobicContact CD1-CG 4.28Å; P397-G399 PolarHBondContact O-N 3.17Å; P397-W401 HydrophobicContact CB-CB 4.12Å; P397-W401 HydrophobicContact CB-CG 4.25Å; P397-W401 HydrophobicContact CG-CB 3.75Å; P397-W401 HydrophobicContact CG-CG 3.88Å
398	K	78.8	Confident	86.8	Confident	197 Å²	197	69.7 Å²	69.7	86%	0.857	42%	0.421	S	S	*	.	S	Bend	trans	-85.2	95.6	-175.2	-70.6	168.6	-176	157.4	0	110.8	A396	A396-K398 PolarHBondContact O-N 2.85Å
399	G	84.9	Confident	86.4	Confident	60 Å²	60	70 Å²	70	62%	0.619	43%	0.429	S	S	*	.	S	Bend	trans	105.1	-158.3	-177.4	0	0	0	0	0	111.8	P397	P397-G399 PolarHBondContact O-N 3.17Å
400	K	86.5	Confident	86.2	Confident	159 Å²	159	70.2 Å²	70.2	69%	0.691	41%	0.412	S	S	*	.			trans	-69.2	134.3	-173.6	-65.5	-159.8	170.5	-143.3	0	112.8	D377 F402	D377-K400 HydrophobicContact CB-CB 4.32Å; D377-K400 HydrophobicContact CB-CD 4.39Å; D377-K400 IonicContact OD1-NZ 3.17Å; D377-K400 WeakPolarHBondContact OD2-CA 3.5Å; D377-K400 WeakPolarHBondContact OD2-CB 3.4Å; K400-F402 HydrophobicContact CB-CE2 4.29Å; K400-F402 HydrophobicContact CB-CZ 4.39Å
401	W	91.1	Very high	85.8	Confident	38 Å²	38	76.4 Å²	76.4	14%	0.144	44%	0.435	C	S	.	.			trans	-124.8	140	180	-176.7	91.5	0	0	0	112.1	V374 C376 D377 F386 V391 L393 P397 C403	V374-W401 HydrophobicContact CB-CE3 4.36Å; V374-W401 HydrophobicContact CB-CZ3 4.46Å; V374-W401 HydrophobicContact CG1-CD2 4.16Å; V374-W401 HydrophobicContact CG1-CE3 3.88Å; V374-W401 HydrophobicContact CG1-CH2 3.58Å; V374-W401 HydrophobicContact CG1-CZ2 3.9Å; V374-W401 HydrophobicContact CG1-CZ3 3.57Å; V374-W401 HydrophobicContact CG2-CB 4.27Å; V374-W401 HydrophobicContact CG2-CD2 3.72Å; V374-W401 HydrophobicContact CG2-CE3 3.57Å; V374-W401 HydrophobicContact CG2-CG 4.04Å; V374-W401 HydrophobicContact CG2-CZ3 4.12Å; C376-W401 HydrophobicContact CB-CE3 4.42Å; C376-W401 HydrophobicContact CB-CZ3 4.11Å; D377-W401 WeakPolarHBondContact CB-O 3.45Å; D377-W401 PolarHBondContact N-O 3.46Å; D377-W401 PolarHBondContact OD2-N 3.45Å; F386-W401 HydrophobicContact CB-CH2 4.22Å; F386-W401 AromaticContact CD2-CH2 3.94Å; F386-W401 HydrophobicContact CD2-CH2 3.94Å; F386-W401 AromaticContact CD2-CZ3 3.83Å; F386-W401 HydrophobicContact CD2-CZ3 3.83Å; F386-W401 HydrophobicContact CE2-CZ3 4.43Å; F386-W401 HydrophobicContact CG-CH2 4.13Å; F386-W401 HydrophobicContact CG-CZ3 4.46Å; V391-W401 HydrophobicContact CB-CH2 4.32Å; V391-W401 HydrophobicContact CB-CZ2 3.94Å; V391-W401 HydrophobicContact CG1-CH2 4.06Å; V391-W401 HydrophobicContact CG1-CZ2 4.16Å; V391-W401 HydrophobicContact CG2-CH2 4.2Å; V391-W401 HydrophobicContact CG2-CZ2 3.84Å; L393-W401 HydrophobicContact CD1-CZ2 4.39Å; P397-W401 HydrophobicContact CB-CB 4.12Å; P397-W401 HydrophobicContact CB-CG 4.25Å; P397-W401 HydrophobicContact CG-CB 3.75Å; P397-W401 HydrophobicContact CG-CG 3.88Å; W401-C403 VanDerWaalsContact CH2-CA 3.43Å; W401-C403 HydrophobicContact CH2-CB 3.62Å; W401-C403 HydrophobicContact CZ3-CB 3.79Å
402	F	89.6	Confident	85.3	Confident	61 Å²	61	83.7 Å²	83.7	27%	0.268	46%	0.459	S	S	.	.			trans	-130.6	128.1	-178	-59.3	-72.2	0	0	0	110.5	D377 N378 K400 C406 T407 M410	D377-F402 HydrophobicContact CB-CD1 3.9Å; D377-F402 HydrophobicContact CB-CE1 3.4Å; D377-F402 HydrophobicContact CB-CZ 3.89Å; N378-F402 HydrophobicContact CB-CD1 3.91Å; N378-F402 HydrophobicContact CB-CE1 4.18Å; K400-F402 HydrophobicContact CB-CE2 4.29Å; K400-F402 HydrophobicContact CB-CZ 4.39Å; F402-C406 HydrophobicContact CB-CB 4.34Å; F402-T407 WeakPolarHBondContact CB-OG1 3.32Å; F402-T407 PolarHBondContact O-OG1 2.86Å; F402-T407 VanDerWaalsContact O-OG1 3.06Å; F402-M410 HydrophobicContact CD1-CE 3.8Å; F402-M410 HydrophobicContact CD1-SD 4.49Å; F402-M410 HydrophobicContact CE1-CE 3.68Å; F402-M410 HydrophobicContact CG-CE 4.33Å; F402-M410 HydrophobicContact CG-SD 4.45Å; F402-M410 HydrophobicContact CZ-CE 4.14Å
403	C	90.4	Very high	84.4	Confident	1 Å²	1	89.5 Å²	89.5	1%	0.007	46%	0.46	C	S	.	.			trans	-60.7	160.1	-179.3	80.9	0	0	0	0	112.2	C376 F386 W401 Q405 C406 T407	C376-C403 HydrophobicContact CB-CB 4.37Å; C376-C403 PolarHBondContact SG-N 2.97Å; F386-C403 HydrophobicContact CD1-CB 4.48Å; F386-C403 HydrophobicContact CD2-CB 3.94Å; F386-C403 HydrophobicContact CE1-CB 4.04Å; F386-C403 HydrophobicContact CE2-CB 3.45Å; F386-C403 VanDerWaalsContact CE2-CB 3.45Å; F386-C403 HydrophobicContact CG-CB 4.45Å; F386-C403 HydrophobicContact CZ-CB 3.5Å; W401-C403 VanDerWaalsContact CH2-CA 3.43Å; W401-C403 HydrophobicContact CH2-CB 3.62Å; W401-C403 HydrophobicContact CZ3-CB 3.79Å; C403-Q405 PolarHBondContact O-N 3.25Å; C403-Q405 VanDerWaalsContact O-N 3.07Å; C403-C406 PolarHBondContact O-N 2.96Å; C403-T407 PolarHBondContact O-N 3.38Å; C403-T407 PolarHBondContact O-OG1 2.87Å
404	P	87.5	Confident	83.4	Confident	79 Å²	79	90.4 Å²	90.4	51%	0.513	48%	0.478	S	S	.	.	H	α-helix	trans	-53.7	-35.7	-175.4	-29	36.1	0	0	0	114.1	A408	P404-A408 VanDerWaalsContact O-CB 3.27Å; P404-A408 WeakPolarHBondContact O-CB 3.47Å; P404-A408 PolarHBondContact O-N 3.35Å
405	Q	87.2	Confident	82.2	Confident	103 Å²	103	89.1 Å²	89.1	48%	0.481	47%	0.474	S	S	.	.	H	α-helix	trans	-68.4	-45.9	177.5	-58.8	-173.5	11.2	0	0	112.4	C403 A408 A409	C403-Q405 PolarHBondContact O-N 3.25Å; C403-Q405 VanDerWaalsContact O-N 3.07Å; Q405-A408 PolarHBondContact O-N 2.59Å; Q405-A409 WeakPolarHBondContact O-CB 3.37Å; Q405-A409 PolarHBondContact O-N 3.41Å
406	C	89.1	Confident	80.9	Confident	11 Å²	11	93.6 Å²	93.6	7%	0.074	49%	0.485	C	S	.	.	H	α-helix	trans	-66.2	-44.4	178.6	-66.5	0	0	0	0	111	C376 N378 C381 F402 C403 A408 A409 M410	C376-C406 VanDerWaalsContact SG-SG 3.7Å; N378-C406 HydrophobicContact CB-CB 4.09Å; C381-C406 VanDerWaalsContact SG-SG 3.64Å; F402-C406 HydrophobicContact CB-CB 4.34Å; C403-C406 PolarHBondContact O-N 2.96Å; C406-A408 VanDerWaalsContact C-N 3.33Å; C406-A408 PolarHBondContact O-N 3.16Å; C406-A409 WeakPolarHBondContact O-CB 3.38Å; C406-A409 PolarHBondContact O-N 3.35Å; C406-A409 VanDerWaalsContact O-N 3.08Å; C406-M410 WeakPolarHBondContact O-CG 3.26Å; C406-M410 PolarHBondContact O-N 3.24Å
407	T	87.5	Confident	79.4	Confident	70 Å²	70	99.5 Å²	99.5	43%	0.429	50%	0.502	S	S	.	.	H	α-helix	trans	-57.5	-43.7	174.2	-65.8	0	0	0	0	111.8	F402 C403 K411	F402-T407 WeakPolarHBondContact CB-OG1 3.32Å; F402-T407 PolarHBondContact O-OG1 2.86Å; F402-T407 VanDerWaalsContact O-OG1 3.06Å; C403-T407 PolarHBondContact O-N 3.38Å; C403-T407 PolarHBondContact O-OG1 2.87Å; T407-K411 WeakPolarHBondContact O-CB 3.17Å; T407-K411 PolarHBondContact O-N 3.36Å
408	A	85.9	Confident	77.6	Confident	48 Å²	48	109.7 Å²	109.7	40%	0.397	54%	0.542	S	S	.	.	H	α-helix	trans	-69.9	-27.9	175.4	0	0	0	0	0	113.8	P404 Q405 C406 R412	P404-A408 VanDerWaalsContact O-CB 3.27Å; P404-A408 WeakPolarHBondContact O-CB 3.47Å; P404-A408 PolarHBondContact O-N 3.35Å; Q405-A408 PolarHBondContact O-N 2.59Å; C406-A408 VanDerWaalsContact C-N 3.33Å; C406-A408 PolarHBondContact O-N 3.16Å; A408-R412 WeakPolarHBondContact O-CG 3.15Å; A408-R412 PolarHBondContact O-N 3.44Å; A408-R412 PolarHBondContact O-NE 3Å; A408-R412 VanDerWaalsContact O-NE 3.17Å
409	A	83.8	Confident	77.5	Confident	35 Å²	35	105.4 Å²	105.4	29%	0.289	53%	0.526	S	S	.	.	H	α-helix	trans	-72.3	-47.2	173	0	0	0	0	0	111.6	Q405 C406 K411 R412 R413	Q405-A409 WeakPolarHBondContact O-CB 3.37Å; Q405-A409 PolarHBondContact O-N 3.41Å; C406-A409 WeakPolarHBondContact O-CB 3.38Å; C406-A409 PolarHBondContact O-N 3.35Å; C406-A409 VanDerWaalsContact O-N 3.08Å; A409-K411 PolarHBondContact O-N 3.35Å; A409-R412 PolarHBondContact O-N 3.37Å; A409-R413 PolarHBondContact O-N 3.43Å; A409-R413 VanDerWaalsContact O-N 3.08Å
410	M	82.4	Confident	77.1	Confident	76 Å²	76	107.7 Å²	107.7	37%	0.374	52%	0.521	S	S	.	.	H	α-helix	trans	-60	-46.5	176.9	-68.5	-177.7	-178.3	0	0	111.6	N378 F402 C406 R412 R413 G414	N378-M410 HydrophobicContact CB-CE 4.17Å; N378-M410 WeakPolarHBondContact OD1-CE 3.21Å; F402-M410 HydrophobicContact CD1-CE 3.8Å; F402-M410 HydrophobicContact CD1-SD 4.49Å; F402-M410 HydrophobicContact CE1-CE 3.68Å; F402-M410 HydrophobicContact CG-CE 4.33Å; F402-M410 HydrophobicContact CG-SD 4.45Å; F402-M410 HydrophobicContact CZ-CE 4.14Å; C406-M410 WeakPolarHBondContact O-CG 3.26Å; C406-M410 PolarHBondContact O-N 3.24Å; M410-R412 VanDerWaalsContact C-N 3.29Å; M410-R412 PolarHBondContact O-N 2.88Å; M410-R413 PolarHBondContact O-N 3.11Å; M410-R413 VanDerWaalsContact O-N 3.1Å; M410-G414 PolarHBondContact O-N 3.33Å
411	K	80.8	Confident	76.6	Confident	170 Å²	170	104.9 Å²	104.9	74%	0.739	51%	0.512	S	S	*	.	H	α-helix	trans	-59.2	-36.9	177.8	-168.6	171.7	-176.9	176.2	0	112.9	T407 A409 S415	T407-K411 WeakPolarHBondContact O-CB 3.17Å; T407-K411 PolarHBondContact O-N 3.36Å; A409-K411 PolarHBondContact O-N 3.35Å; K411-S415 PolarHBondContact O-N 3.48Å
412	R	76.1	Confident	75.7	Confident	183 Å²	183	108.8 Å²	108.8	69%	0.691	53%	0.534	S	S	*	.	H	α-helix	trans	-71.3	-34.9	174.9	-75.9	-176.5	-66.5	157.8	-1.9	113.3	A408 A409 M410	A408-R412 WeakPolarHBondContact O-CG 3.15Å; A408-R412 PolarHBondContact O-N 3.44Å; A408-R412 PolarHBondContact O-NE 3Å; A408-R412 VanDerWaalsContact O-NE 3.17Å; A409-R412 PolarHBondContact O-N 3.37Å; M410-R412 VanDerWaalsContact C-N 3.29Å; M410-R412 PolarHBondContact O-N 2.88Å
413	R	70.1	Confident	74.9	Confident	191 Å²	191	111.8 Å²	111.8	72%	0.721	55%	0.55	S	S	*	*	H	α-helix	trans	-66.9	-45.9	174.4	-71.1	-175.1	179	-179.7	3	111.2	A409 M410 S415 R416	A409-R413 PolarHBondContact O-N 3.43Å; A409-R413 VanDerWaalsContact O-N 3.08Å; M410-R413 PolarHBondContact O-N 3.11Å; M410-R413 VanDerWaalsContact O-N 3.1Å; R413-S415 VanDerWaalsContact C-N 3.29Å; R413-S415 PolarHBondContact O-N 2.79Å; R413-R416 PolarHBondContact O-N 3.41Å; R413-R416 VanDerWaalsContact O-N 3.13Å
414	G	64.1	Low	73.8	Confident	55 Å²	55	119.2 Å²	119.2	57%	0.567	59%	0.587	S	S	*	*	H	α-helix	trans	-61.1	-31.6	178.8	0	0	0	0	0	114.6	M410 R416	M410-G414 PolarHBondContact O-N 3.33Å; G414-R416 PolarHBondContact O-N 3.39Å
415	S	58.2	Low	72.8	Confident	100 Å²	100	122.1 Å²	122.1	70%	0.699	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-3.9	177.6	-167	0	0	0	0	114.8	K411 R413	K411-S415 PolarHBondContact O-N 3.48Å; R413-S415 VanDerWaalsContact C-N 3.29Å; R413-S415 PolarHBondContact O-N 2.79Å
416	R	56.5	Low	71.7	Confident	224 Å²	224	123.5 Å²	123.5	85%	0.845	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	19	-175.8	-154.9	176.8	179.1	175	-0.4	113.1	R413 G414	R413-R416 PolarHBondContact O-N 3.41Å; R413-R416 VanDerWaalsContact O-N 3.13Å; G414-R416 PolarHBondContact O-N 3.39Å
417	H	54.4	Low	70.3	Confident	184 Å²	184	132.9 Å²	132.9	85%	0.852	64%	0.644	S	S	*	*			trans	-137.2	30.6	-178.7	-95.7	33.4	0	0	0	111.9
418	K	43.9	Very low	68.7	Low	259 Å²	259	138.6 Å²	138.6	100%	1.126	66%	0.664	S	S	*	*			trans	-143.1	0	175.9	-172.2	174.2	-178.1	-179.9	0	109.8

Retrieved 418 of 418 residues in 336.4 ms (Link to these results)

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