A0A077ZLG2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZLG2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 192 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45	Very low	48.3	Very low	192 Å²	192	103.6 Å²	103.6	95%	0.946	54%	0.537	S	S	*	.				0	-60.5	0	-73.8	-65.1	-113.2	0	0	114.2	E3 R5	M1-E3 VanDerWaalsContact C-N 3.27Å; M1-E3 PolarHBondContact O-N 3.23Å; M1-R5 PolarHBondContact O-N 2.98Å
2	A	43	Very low	48.4	Very low	68 Å²	68	103.1 Å²	103.1	56%	0.562	54%	0.535	S	S	*	.	H	α-helix	trans	-65.8	-26.1	-179	0	0	0	0	0	114.5
3	E	52.4	Low	48.7	Very low	86 Å²	86	107.6 Å²	107.6	40%	0.402	55%	0.552	S	S	.	*	H	α-helix	trans	-81.8	-36.6	-175.8	-143.4	148.4	-160.5	0	0	112.8	M1 R5 R6 S7 R179	M1-E3 VanDerWaalsContact C-N 3.27Å; M1-E3 PolarHBondContact O-N 3.23Å; E3-R5 VanDerWaalsContact C-N 3.25Å; E3-R5 PolarHBondContact O-N 3.07Å; E3-R6 PolarHBondContact O-N 2.82Å; E3-R6 VanDerWaalsContact O-N 3.11Å; E3-S7 PolarHBondContact O-N 3.07Å; E3-R179 WeakPolarHBondContact OE1-CD 3.48Å; E3-R179 WeakPolarHBondContact OE1-CG 3.48Å; E3-R179 IonicContact OE1-CZ 3.85Å; E3-R179 IonicContact OE1-NE 2.89Å; E3-R179 PolarHBondContact OE1-NE 2.85Å; E3-R179 IonicContact OE1-NH1 2.84Å; E3-R179 PolarHBondContact OE1-NH1 2.87Å; E3-R179 IonicContact OE2-CZ 3.35Å; E3-R179 IonicContact OE2-NH1 3.21Å; E3-R179 PolarHBondContact OE2-NH1 3.22Å
4	V	51.9	Low	48.9	Very low	75 Å²	75	113.1 Å²	113.1	46%	0.455	57%	0.57	S	S	.	*	H	α-helix	trans	-61.8	-36.5	169.9	179	0	0	0	0	110.6	R6 S7 A8 M25	V4-R6 VanDerWaalsContact C-N 3.26Å; V4-R6 PolarHBondContact O-N 2.88Å; V4-S7 PolarHBondContact O-N 3.26Å; V4-A8 PolarHBondContact O-N 3.43Å; V4-M25 HydrophobicContact CG1-CE 3.6Å; V4-M25 HydrophobicContact CG1-SD 4.11Å; V4-M25 HydrophobicContact CG2-CE 4.19Å; V4-M25 HydrophobicContact CG2-SD 4.41Å
5	R	49.9	Very low	49.2	Very low	199 Å²	199	115.1 Å²	115.1	75%	0.751	58%	0.584	S	S	*	*	H	α-helix	trans	-64.2	-27.9	176.2	-168.5	177.1	-86.6	-157	-3.6	112.6	M1 E3 V9	M1-R5 PolarHBondContact O-N 2.98Å; E3-R5 VanDerWaalsContact C-N 3.25Å; E3-R5 PolarHBondContact O-N 3.07Å; R5-V9 VanDerWaalsContact O-CG2 3.26Å; R5-V9 WeakPolarHBondContact O-CG2 3.44Å; R5-V9 PolarHBondContact O-N 2.76Å
6	R	45.6	Very low	49.3	Very low	170 Å²	170	118.1 Å²	118.1	64%	0.642	59%	0.587	S	S	*	*	H	α-helix	trans	-81	-31.6	179	-67.6	-164.1	-163.5	98.9	-1.4	113.6	E3 V4 A8 V9	E3-R6 PolarHBondContact O-N 2.82Å; E3-R6 VanDerWaalsContact O-N 3.11Å; V4-R6 VanDerWaalsContact C-N 3.26Å; V4-R6 PolarHBondContact O-N 2.88Å; R6-A8 VanDerWaalsContact C-N 3.29Å; R6-A8 PolarHBondContact O-N 2.8Å; R6-V9 WeakPolarHBondContact O-CB 3.46Å; R6-V9 PolarHBondContact O-N 3.5Å; R6-V9 VanDerWaalsContact O-N 3.1Å
7	S	47.7	Very low	49.5	Very low	74 Å²	74	116.2 Å²	116.2	52%	0.517	59%	0.585	S	S	.	*	H	α-helix	trans	-65.2	-36.3	172.9	-61.6	0	0	0	0	111.5	E3 V4 V9 Q10	E3-S7 PolarHBondContact O-N 3.07Å; V4-S7 PolarHBondContact O-N 3.26Å; S7-V9 VanDerWaalsContact C-N 3.28Å; S7-V9 PolarHBondContact O-N 3.44Å; S7-Q10 PolarHBondContact O-N 3.18Å
8	A	45.5	Very low	49.9	Very low	44 Å²	44	112.9 Å²	112.9	36%	0.364	57%	0.574	S	S	.	*	H	α-helix	trans	-67.4	-24.4	171.3	0	0	0	0	0	113.4	V4 R6 Q10 T11 N12	V4-A8 PolarHBondContact O-N 3.43Å; R6-A8 VanDerWaalsContact C-N 3.29Å; R6-A8 PolarHBondContact O-N 2.8Å; A8-Q10 VanDerWaalsContact C-N 3.26Å; A8-Q10 PolarHBondContact O-N 3.35Å; A8-T11 PolarHBondContact O-N 3.01Å; A8-T11 PolarHBondContact O-OG1 3.31Å; A8-T11 VanDerWaalsContact O-OG1 3.04Å; A8-N12 PolarHBondContact O-N 3.32Å; A8-N12 PolarHBondContact O-ND2 3.46Å; A8-N12 PolarHBondContact O-OD1 2.82Å
9	V	49.7	Very low	50.3	Low	81 Å²	81	112.5 Å²	112.5	49%	0.491	57%	0.574	S	S	.	*	H	α-helix	trans	-66.7	-27.8	178.1	168.7	0	0	0	0	111.9	R5 R6 S7 Q13	R5-V9 VanDerWaalsContact O-CG2 3.26Å; R5-V9 WeakPolarHBondContact O-CG2 3.44Å; R5-V9 PolarHBondContact O-N 2.76Å; R6-V9 WeakPolarHBondContact O-CB 3.46Å; R6-V9 PolarHBondContact O-N 3.5Å; R6-V9 VanDerWaalsContact O-N 3.1Å; S7-V9 VanDerWaalsContact C-N 3.28Å; S7-V9 PolarHBondContact O-N 3.44Å; V9-Q13 PolarHBondContact O-N 3.4Å
10	Q	47.4	Very low	50.8	Low	105 Å²	105	109.3 Å²	109.3	49%	0.491	56%	0.559	S	S	.	*	H	α-helix	trans	-75.1	-31.5	178	-73.7	-159.6	-15.7	0	0	113.5	S7 A8	S7-Q10 PolarHBondContact O-N 3.18Å; A8-Q10 VanDerWaalsContact C-N 3.26Å; A8-Q10 PolarHBondContact O-N 3.35Å
11	T	53	Low	51.3	Low	46 Å²	46	110.7 Å²	110.7	28%	0.282	56%	0.564	S	S	.	*	H	α-helix	trans	-79.1	-30.5	173.2	51.6	0	0	0	0	112.2	A8 Q13 F14 D15 Y16 C18	A8-T11 PolarHBondContact O-N 3.01Å; A8-T11 PolarHBondContact O-OG1 3.31Å; A8-T11 VanDerWaalsContact O-OG1 3.04Å; T11-Q13 PolarHBondContact O-N 3.29Å; T11-Q13 VanDerWaalsContact O-N 3.15Å; T11-F14 PolarHBondContact O-N 3.38Å; T11-D15 PolarHBondContact O-N 2.9Å; T11-Y16 PolarHBondContact O-N 3.45Å; T11-C18 WeakPolarHBondContact CB-SG 3.45Å; T11-C18 PolarHBondContact OG1-SG 2.94Å
12	N	50.3	Low	52.2	Low	97 Å²	97	106.6 Å²	106.6	52%	0.519	54%	0.542	S	S	.	.	H	α-helix	trans	-59.5	-23.5	171.3	-73.3	-12.1	0	0	0	113.2	A8 F14 D15	A8-N12 PolarHBondContact O-N 3.32Å; A8-N12 PolarHBondContact O-ND2 3.46Å; A8-N12 PolarHBondContact O-OD1 2.82Å; N12-F14 PolarHBondContact O-N 2.86Å; N12-D15 PolarHBondContact O-N 3.16Å; N12-D15 VanDerWaalsContact O-N 3.14Å
13	Q	51.5	Low	53.3	Low	162 Å²	162	105.5 Å²	105.5	76%	0.757	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-18.6	178.1	-158	164.7	-7.7	0	0	112.6	V9 T11	V9-Q13 PolarHBondContact O-N 3.4Å; T11-Q13 PolarHBondContact O-N 3.29Å; T11-Q13 VanDerWaalsContact O-N 3.15Å
14	F	51.4	Low	54.4	Low	184 Å²	184	101.8 Å²	101.8	81%	0.807	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.9	11.2	171.3	-69.6	-74.4	0	0	0	113.5	T11 N12 Y16	T11-F14 PolarHBondContact O-N 3.38Å; N12-F14 PolarHBondContact O-N 2.86Å; F14-Y16 PolarHBondContact O-N 3.32Å
15	D	54.4	Low	55.2	Low	144 Å²	144	100.6 Å²	100.6	77%	0.77	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	33	-176.9	-110.5	-8.5	0	0	0	113	T11 N12 P17	T11-D15 PolarHBondContact O-N 2.9Å; N12-D15 PolarHBondContact O-N 3.16Å; N12-D15 VanDerWaalsContact O-N 3.14Å; D15-P17 WeakPolarHBondContact O-CD 3.45Å
16	Y	50	Low	56.2	Low	163 Å²	163	94 Å²	94	64%	0.639	48%	0.476	S	S	*	.			trans	-75.9	121.3	-178.3	-169.2	-97.5	0	0	0	108.7	T11 F14 C18	T11-Y16 PolarHBondContact O-N 3.45Å; F14-Y16 PolarHBondContact O-N 3.32Å; Y16-C18 PolarHBondContact O-N 3.02Å; Y16-C18 PolarHBondContact O-SG 3.07Å; Y16-C18 VanDerWaalsContact O-SG 3.36Å
17	P	53.2	Low	57.6	Low	85 Å²	85	88.1 Å²	88.1	55%	0.552	45%	0.454	S	S	*	.			trans	-60.3	115.5	177.2	24.7	-31.4	0	0	0	108.1	D15	D15-P17 WeakPolarHBondContact O-CD 3.45Å
18	C	55.6	Low	58.9	Low	58 Å²	58	87.9 Å²	87.9	39%	0.392	45%	0.447	S	S	.	.			trans	-97	97.2	172.9	-63	0	0	0	0	106.2	T11 Y16 V20	T11-C18 WeakPolarHBondContact CB-SG 3.45Å; T11-C18 PolarHBondContact OG1-SG 2.94Å; Y16-C18 PolarHBondContact O-N 3.02Å; Y16-C18 PolarHBondContact O-SG 3.07Å; Y16-C18 VanDerWaalsContact O-SG 3.36Å; C18-V20 HydrophobicContact CB-CG2 4.11Å; C18-V20 WeakPolarHBondContact O-CG2 3.38Å; C18-V20 PolarHBondContact O-N 3.5Å
19	D	57.3	Low	60.5	Low	105 Å²	105	89.8 Å²	89.8	56%	0.561	45%	0.447	S	S	*	.			trans	-79.4	71.9	177.8	-60.7	-42.6	0	0	0	109.3	E21 E22	D19-E21 PolarHBondContact O-N 3.17Å; D19-E21 VanDerWaalsContact O-N 3.11Å; D19-E22 HydrophobicContact CB-CB 4.22Å; D19-E22 PolarHBondContact O-N 2.82Å; D19-E22 VanDerWaalsContact O-N 3.14Å
20	V	60.7	Low	62	Low	47 Å²	47	89.4 Å²	89.4	29%	0.285	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-11.5	179	-167.3	0	0	0	0	111.5	C18 M25 R84	C18-V20 HydrophobicContact CB-CG2 4.11Å; C18-V20 WeakPolarHBondContact O-CG2 3.38Å; C18-V20 PolarHBondContact O-N 3.5Å; V20-M25 HydrophobicContact CG1-CB 4.06Å; V20-M25 HydrophobicContact CG1-CG 4.46Å; V20-R84 PolarHBondContact O-NH2 3.45Å; V20-R84 VanDerWaalsContact O-NH2 3.07Å
21	E	60.9	Low	63.7	Low	140 Å²	140	86.5 Å²	86.5	65%	0.654	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-9.5	178.3	-63.6	178	-158.5	0	0	113.5	D19 E80	D19-E21 PolarHBondContact O-N 3.17Å; D19-E21 VanDerWaalsContact O-N 3.11Å; E21-E80 WeakPolarHBondContact CG-OE1 3.4Å
22	E	63.9	Low	65.3	Low	105 Å²	105	84.3 Å²	84.3	49%	0.491	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-43.5	-177.4	-160	-177.7	169.1	0	0	112.5	D19	D19-E22 HydrophobicContact CB-CB 4.22Å; D19-E22 PolarHBondContact O-N 2.82Å; D19-E22 VanDerWaalsContact O-N 3.14Å
23	Y	67.9	Low	66.9	Low	46 Å²	46	80.2 Å²	80.2	18%	0.18	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	-24.9	-176.6	-60.5	-76.9	0	0	0	113.5	W27 F29 G95	Y23-W27 VanDerWaalsContact CB-O 3.31Å; Y23-W27 WeakPolarHBondContact CB-O 3.41Å; Y23-W27 WeakPolarHBondContact O-CB 3.46Å; Y23-F29 HydrophobicContact CD2-CB 4.4Å; Y23-F29 HydrophobicContact CE1-CB 4.27Å; Y23-F29 AromaticContact CE1-CD2 3.89Å; Y23-F29 HydrophobicContact CE1-CD2 3.89Å; Y23-F29 HydrophobicContact CE2-CB 3.91Å; Y23-F29 AromaticContact CZ-CD2 3.71Å; Y23-F29 WeakPolarHBondContact OH-CD2 3.38Å; Y23-G95 WeakPolarHBondContact O-CA 3.28Å; Y23-G95 PolarHBondContact O-N 3.25Å
24	G	74.1	Confident	68.6	Low	7 Å²	7	73 Å²	73	7%	0.072	36%	0.356	C	S	.	.			trans	127.7	-177.1	-177.3	0	0	0	0	0	114.3	L91	G24-L91 CarbonylContact C-O 3.49Å; G24-L91 WeakPolarHBondContact CA-O 2.94Å
25	M	69.4	Low	70.4	Confident	50 Å²	50	67.4 Å²	67.4	25%	0.246	34%	0.335	C	S	.	.	S	Bend	trans	-72.9	-33.3	-172.4	-173.6	-179.3	-69.1	0	0	114.2	V4 V20 L91 N92	V4-M25 HydrophobicContact CG1-CE 3.6Å; V4-M25 HydrophobicContact CG1-SD 4.11Å; V4-M25 HydrophobicContact CG2-CE 4.19Å; V4-M25 HydrophobicContact CG2-SD 4.41Å; V20-M25 HydrophobicContact CG1-CB 4.06Å; V20-M25 HydrophobicContact CG1-CG 4.46Å; M25-L91 HydrophobicContact CB-CB 4.22Å; M25-L91 HydrophobicContact CE-CD1 4.45Å; M25-L91 HydrophobicContact CE-CD2 3.81Å; M25-L91 PolarHBondContact N-O 2.95Å; M25-L91 HydrophobicContact SD-CD1 4.1Å; M25-L91 HydrophobicContact SD-CD2 4.48Å; M25-N92 PolarHBondContact N-OD1 3.36Å; M25-N92 VanDerWaalsContact N-OD1 3.16Å
26	H	71.8	Confident	72	Confident	62 Å²	62	60.7 Å²	60.7	29%	0.287	30%	0.299	S	S	.	.	S	Bend	trans	-123.5	-5.4	-177.7	-58.3	-48.3	0	0	0	112.5	N92	H26-N92 PolarHBondContact N-OD1 3.2Å
27	W	73.6	Confident	73.7	Confident	45 Å²	45	53.9 Å²	53.9	17%	0.17	27%	0.272	C	S	.	.			trans	-92.9	126.3	-176.5	-157.1	-81.9	0	0	0	109.8	Y23 T32 L35 N92 I96 V99	Y23-W27 VanDerWaalsContact CB-O 3.31Å; Y23-W27 WeakPolarHBondContact CB-O 3.41Å; Y23-W27 WeakPolarHBondContact O-CB 3.46Å; W27-T32 PolarHBondContact NE1-OG1 3.34Å; W27-L35 HydrophobicContact CH2-CD1 3.43Å; W27-L35 VanDerWaalsContact CH2-CD1 3.43Å; W27-L35 HydrophobicContact CZ2-CD1 3.45Å; W27-L35 VanDerWaalsContact CZ2-CD1 3.45Å; W27-N92 HydrophobicContact CB-CB 3.91Å; W27-N92 HydrophobicContact CD2-CB 4.4Å; W27-N92 HydrophobicContact CE3-CB 3.95Å; W27-N92 HydrophobicContact CG-CB 4.46Å; W27-N92 PolarHBondContact N-OD1 3.29Å; W27-I96 HydrophobicContact CE3-CG1 4.35Å; W27-I96 HydrophobicContact CH2-CG1 3.88Å; W27-I96 HydrophobicContact CZ2-CG1 4.32Å; W27-I96 HydrophobicContact CZ3-CD1 4.49Å; W27-I96 HydrophobicContact CZ3-CG1 3.91Å; W27-V99 HydrophobicContact CZ2-CG2 3.82Å
28	N	76	Confident	75.3	Confident	70 Å²	70	55.2 Å²	55.2	37%	0.374	27%	0.274	S	S	.	.			trans	-107	154.2	173.7	-65.5	-23	0	0	0	109.2	F30 Y31	N28-F30 PolarHBondContact O-N 2.85Å; N28-F30 VanDerWaalsContact O-N 3.09Å; N28-Y31 HydrophobicContact CB-CD2 4.21Å; N28-Y31 HydrophobicContact CB-CE2 4.46Å; N28-Y31 WeakPolarHBondContact O-CB 3.17Å; N28-Y31 PolarHBondContact O-N 2.87Å
29	F	78.5	Confident	77	Confident	84 Å²	84	55.3 Å²	55.3	37%	0.368	27%	0.27	S	S	.	.	H	α-helix	trans	-48.7	-37.4	172.9	175.8	-111.4	0	0	0	113.3	Y23 Y31 T32 L33	Y23-F29 HydrophobicContact CD2-CB 4.4Å; Y23-F29 HydrophobicContact CE1-CB 4.27Å; Y23-F29 AromaticContact CE1-CD2 3.89Å; Y23-F29 HydrophobicContact CE1-CD2 3.89Å; Y23-F29 HydrophobicContact CE2-CB 3.91Å; Y23-F29 AromaticContact CZ-CD2 3.71Å; Y23-F29 WeakPolarHBondContact OH-CD2 3.38Å; F29-Y31 VanDerWaalsContact C-N 3.28Å; F29-Y31 PolarHBondContact O-N 2.91Å; F29-T32 WeakPolarHBondContact O-CB 3.21Å; F29-T32 PolarHBondContact O-N 3.32Å; F29-L33 HydrophobicContact CD1-CD1 4.11Å; F29-L33 HydrophobicContact CD1-CG 4.47Å; F29-L33 HydrophobicContact CE1-CD1 3.38Å; F29-L33 HydrophobicContact CE1-CG 3.9Å; F29-L33 HydrophobicContact CE2-CD2 4.36Å; F29-L33 HydrophobicContact CE2-CG 4.27Å; F29-L33 HydrophobicContact CZ-CD1 3.66Å; F29-L33 HydrophobicContact CZ-CD2 3.94Å; F29-L33 HydrophobicContact CZ-CG 3.78Å; F29-L33 PolarHBondContact O-N 2.92Å; F29-L33 VanDerWaalsContact O-N 3.16Å
30	F	81.8	Confident	78.3	Confident	72 Å²	72	50.3 Å²	50.3	32%	0.316	24%	0.243	S	C	.	.	H	α-helix	trans	-61.8	-31.7	177.7	-58.1	-56.1	0	0	0	113.8	N28 T32 L33 A34 Q160 A161	N28-F30 PolarHBondContact O-N 2.85Å; N28-F30 VanDerWaalsContact O-N 3.09Å; F30-T32 VanDerWaalsContact C-N 3.33Å; F30-L33 PolarHBondContact O-N 3.24Å; F30-A34 VanDerWaalsContact O-CB 3.23Å; F30-A34 WeakPolarHBondContact O-CB 3.4Å; F30-A34 PolarHBondContact O-N 2.89Å; F30-Q160 HydrophobicContact CB-CB 4.44Å; F30-Q160 HydrophobicContact CD1-CB 4.3Å; F30-Q160 HydrophobicContact CD2-CB 4.09Å; F30-Q160 HydrophobicContact CE2-CB 4.45Å; F30-Q160 HydrophobicContact CG-CB 4.01Å; F30-A161 HydrophobicContact CB-CB 4.16Å
31	Y	82.7	Confident	79.5	Confident	45 Å²	45	53.2 Å²	53.2	18%	0.176	25%	0.254	C	S	.	.	H	α-helix	trans	-68.2	-36.8	173.6	-68.6	-49.1	0	0	0	111.7	N28 F29 A34 L35 A161 S165	N28-Y31 HydrophobicContact CB-CD2 4.21Å; N28-Y31 HydrophobicContact CB-CE2 4.46Å; N28-Y31 WeakPolarHBondContact O-CB 3.17Å; N28-Y31 PolarHBondContact O-N 2.87Å; F29-Y31 VanDerWaalsContact C-N 3.28Å; F29-Y31 PolarHBondContact O-N 2.91Å; Y31-A34 PolarHBondContact O-N 3.38Å; Y31-L35 WeakPolarHBondContact O-CB 3.22Å; Y31-L35 WeakPolarHBondContact O-CG 3.23Å; Y31-L35 PolarHBondContact O-N 3.34Å; Y31-A161 HydrophobicContact CD1-CB 3.62Å; Y31-A161 HydrophobicContact CE1-CB 3.85Å; Y31-A161 VanDerWaalsContact CE1-O 3.26Å; Y31-A161 WeakPolarHBondContact CE1-O 3.41Å; Y31-S165 WeakPolarHBondContact OH-CA 3.43Å; Y31-S165 VanDerWaalsContact OH-CB 3.29Å; Y31-S165 WeakPolarHBondContact OH-CB 3.41Å; Y31-S165 PolarHBondContact OH-N 3.22Å
32	T	86.3	Confident	80.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.7	-50.1	175.3	-60.6	0	0	0	0	110.5	W27 F29 F30 L35 E36 S98 V99 C102	W27-T32 PolarHBondContact NE1-OG1 3.34Å; F29-T32 WeakPolarHBondContact O-CB 3.21Å; F29-T32 PolarHBondContact O-N 3.32Å; F30-T32 VanDerWaalsContact C-N 3.33Å; T32-L35 PolarHBondContact O-N 2.83Å; T32-E36 VanDerWaalsContact O-CB 3.23Å; T32-E36 WeakPolarHBondContact O-CB 3.36Å; T32-E36 PolarHBondContact O-N 3.5Å; T32-S98 WeakPolarHBondContact CG2-OG 3.25Å; T32-S98 PolarHBondContact OG1-OG 3.03Å; T32-V99 HydrophobicContact CG2-CB 4.48Å; T32-V99 HydrophobicContact CG2-CG2 3.95Å; T32-C102 HydrophobicContact CG2-CB 4.34Å
33	L	84.8	Confident	81.7	Confident	10 Å²	10	48.3 Å²	48.3	5%	0.052	23%	0.231	C	C	.	.	H	α-helix	trans	-64.6	-39.9	177	-66.5	-176	0	0	0	113	F29 F30 L35 E36 K37 L153 S157	F29-L33 HydrophobicContact CD1-CD1 4.11Å; F29-L33 HydrophobicContact CD1-CG 4.47Å; F29-L33 HydrophobicContact CE1-CD1 3.38Å; F29-L33 HydrophobicContact CE1-CG 3.9Å; F29-L33 HydrophobicContact CE2-CD2 4.36Å; F29-L33 HydrophobicContact CE2-CG 4.27Å; F29-L33 HydrophobicContact CZ-CD1 3.66Å; F29-L33 HydrophobicContact CZ-CD2 3.94Å; F29-L33 HydrophobicContact CZ-CG 3.78Å; F29-L33 PolarHBondContact O-N 2.92Å; F29-L33 VanDerWaalsContact O-N 3.16Å; F30-L33 PolarHBondContact O-N 3.24Å; L33-L35 PolarHBondContact O-N 3.17Å; L33-E36 PolarHBondContact O-N 3.13Å; L33-K37 VanDerWaalsContact O-CB 3.29Å; L33-K37 WeakPolarHBondContact O-CB 3.39Å; L33-K37 PolarHBondContact O-N 3.05Å; L33-L153 HydrophobicContact CD1-CG 4.35Å; L33-S157 VanDerWaalsContact CB-OG 3.27Å; L33-S157 WeakPolarHBondContact CB-OG 3.26Å
34	A	86.4	Confident	82.3	Confident	11 Å²	11	48.2 Å²	48.2	9%	0.091	24%	0.24	C	C	.	.	H	α-helix	trans	-61.1	-45.1	177.9	0	0	0	0	0	112.2	F30 Y31 L38 L158 A161	F30-A34 VanDerWaalsContact O-CB 3.23Å; F30-A34 WeakPolarHBondContact O-CB 3.4Å; F30-A34 PolarHBondContact O-N 2.89Å; Y31-A34 PolarHBondContact O-N 3.38Å; A34-L38 WeakPolarHBondContact O-CB 3.2Å; A34-L38 PolarHBondContact O-N 3.32Å; A34-L158 HydrophobicContact CB-CD2 3.49Å; A34-L158 VanDerWaalsContact CB-CD2 3.49Å; A34-L158 HydrophobicContact CB-CG 4.09Å; A34-A161 HydrophobicContact CB-CB 3.95Å
35	L	88.7	Confident	82.7	Confident	67 Å²	67	51.6 Å²	51.6	35%	0.351	26%	0.263	S	S	.	.	H	α-helix	trans	-70.7	-41.2	177.9	-73.4	172	0	0	0	111.8	W27 Y31 T32 L33 K37 L38 I39 V99	W27-L35 HydrophobicContact CH2-CD1 3.43Å; W27-L35 VanDerWaalsContact CH2-CD1 3.43Å; W27-L35 HydrophobicContact CZ2-CD1 3.45Å; W27-L35 VanDerWaalsContact CZ2-CD1 3.45Å; Y31-L35 WeakPolarHBondContact O-CB 3.22Å; Y31-L35 WeakPolarHBondContact O-CG 3.23Å; Y31-L35 PolarHBondContact O-N 3.34Å; T32-L35 PolarHBondContact O-N 2.83Å; L33-L35 PolarHBondContact O-N 3.17Å; L35-K37 VanDerWaalsContact C-N 3.33Å; L35-K37 PolarHBondContact O-N 3.33Å; L35-L38 PolarHBondContact O-N 3.08Å; L35-I39 WeakPolarHBondContact O-CB 3.44Å; L35-I39 VanDerWaalsContact O-CG1 3.22Å; L35-I39 WeakPolarHBondContact O-CG1 3.4Å; L35-I39 PolarHBondContact O-N 2.9Å; L35-V99 HydrophobicContact CB-CG1 4.14Å; L35-V99 HydrophobicContact CB-CG2 4.42Å; L35-V99 HydrophobicContact CD1-CG2 4.18Å
36	E	88.6	Confident	83.4	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.009	28%	0.283	C	S	.	.	H	α-helix	trans	-59.2	-44.9	175.1	174	-94.5	147.1	0	0	111.1	T32 L33 I39 G40 C102 F106 F150	T32-E36 VanDerWaalsContact O-CB 3.23Å; T32-E36 WeakPolarHBondContact O-CB 3.36Å; T32-E36 PolarHBondContact O-N 3.5Å; L33-E36 PolarHBondContact O-N 3.13Å; E36-I39 PolarHBondContact O-N 3.33Å; E36-G40 WeakPolarHBondContact O-CA 3.44Å; E36-G40 PolarHBondContact O-N 3.16Å; E36-C102 HydrophobicContact CG-CB 4.15Å; E36-F106 HydrophobicContact CG-CB 4.32Å; E36-F106 WeakPolarHBondContact OE1-CB 3.37Å; E36-F106 WeakPolarHBondContact OE1-CD2 3.45Å; E36-F106 WeakPolarHBondContact OE1-CG 3.41Å; E36-F150 WeakPolarHBondContact OE1-CZ 3.4Å
37	K	85.7	Confident	83.8	Confident	21 Å²	21	57 Å²	57	9%	0.091	28%	0.281	C	S	.	.	H	α-helix	trans	-58.7	-48.4	172.7	-178.2	58	162.1	174.3	0	112.8	L33 L35 G40 E41 N151 C154 L158	L33-K37 VanDerWaalsContact O-CB 3.29Å; L33-K37 WeakPolarHBondContact O-CB 3.39Å; L33-K37 PolarHBondContact O-N 3.05Å; L35-K37 VanDerWaalsContact C-N 3.33Å; L35-K37 PolarHBondContact O-N 3.33Å; K37-G40 PolarHBondContact O-N 3.13Å; K37-E41 HydrophobicContact CD-CG 4.27Å; K37-E41 WeakPolarHBondContact CE-OE1 3.46Å; K37-E41 IonicContact NZ-OE1 3.81Å; K37-E41 PolarHBondContact NZ-OE1 3.42Å; K37-E41 WeakPolarHBondContact O-CG 3.31Å; K37-E41 PolarHBondContact O-N 3Å; K37-N151 WeakPolarHBondContact CE-OD1 3.4Å; K37-N151 PolarHBondContact NZ-OD1 3.06Å; K37-C154 HydrophobicContact CB-CB 4.1Å; K37-C154 HydrophobicContact CD-CB 3.83Å; K37-C154 HydrophobicContact CG-CB 3.96Å; K37-L158 HydrophobicContact CB-CD1 4.35Å; K37-L158 HydrophobicContact CG-CD1 3.78Å
38	L	87.6	Confident	83.9	Confident	112 Å²	112	62.4 Å²	62.4	59%	0.586	31%	0.308	S	S	*	.	H	α-helix	trans	-62.5	-46.1	-179.5	-175.3	121.2	0	0	0	111.8	A34 L35 G40 F42	A34-L38 WeakPolarHBondContact O-CB 3.2Å; A34-L38 PolarHBondContact O-N 3.32Å; L35-L38 PolarHBondContact O-N 3.08Å; L38-G40 VanDerWaalsContact C-N 3.33Å; L38-F42 WeakPolarHBondContact O-CB 3.38Å; L38-F42 PolarHBondContact O-N 3.33Å; L38-F42 VanDerWaalsContact O-N 3.07Å
39	I	89.6	Confident	84.2	Confident	60 Å²	60	63.9 Å²	63.9	31%	0.308	32%	0.319	S	S	.	.	H	α-helix	trans	-68.7	-37.3	177.1	-61.6	164.8	0	0	0	110.1	L35 E36 F42 S43 V99 L103	L35-I39 WeakPolarHBondContact O-CB 3.44Å; L35-I39 VanDerWaalsContact O-CG1 3.22Å; L35-I39 WeakPolarHBondContact O-CG1 3.4Å; L35-I39 PolarHBondContact O-N 2.9Å; E36-I39 PolarHBondContact O-N 3.33Å; I39-F42 PolarHBondContact O-N 3.04Å; I39-S43 WeakPolarHBondContact O-CB 3.5Å; I39-S43 PolarHBondContact O-N 3.29Å; I39-V99 HydrophobicContact CD1-CG1 4.14Å; I39-L103 HydrophobicContact CB-CD1 4.1Å; I39-L103 HydrophobicContact CG2-CD1 3.69Å; I39-L103 HydrophobicContact CG2-CD2 3.66Å; I39-L103 HydrophobicContact CG2-CG 4.34Å
40	G	86.4	Confident	84.2	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.7	-50.3	176.9	0	0	0	0	0	112.2	E36 K37 L38 F42 S43 A44	E36-G40 WeakPolarHBondContact O-CA 3.44Å; E36-G40 PolarHBondContact O-N 3.16Å; K37-G40 PolarHBondContact O-N 3.13Å; L38-G40 VanDerWaalsContact C-N 3.33Å; G40-F42 VanDerWaalsContact C-N 3.33Å; G40-F42 PolarHBondContact O-N 3.2Å; G40-S43 PolarHBondContact O-N 2.72Å; G40-S43 PolarHBondContact O-OG 3.33Å; G40-A44 PolarHBondContact O-N 2.93Å
41	E	84.6	Confident	84.2	Confident	108 Å²	108	66.1 Å²	66.1	51%	0.505	33%	0.334	S	S	.	.	H	α-helix	trans	-62	-41.3	175	-73.7	-177.1	179.1	0	0	112.1	K37 A44 S45	K37-E41 HydrophobicContact CD-CG 4.27Å; K37-E41 WeakPolarHBondContact CE-OE1 3.46Å; K37-E41 IonicContact NZ-OE1 3.81Å; K37-E41 PolarHBondContact NZ-OE1 3.42Å; K37-E41 WeakPolarHBondContact O-CG 3.31Å; K37-E41 PolarHBondContact O-N 3Å; E41-A44 PolarHBondContact O-N 3.12Å; E41-S45 PolarHBondContact O-N 3.45Å
42	F	87	Confident	84.5	Confident	125 Å²	125	64.8 Å²	64.8	55%	0.548	33%	0.332	S	S	.	.	H	α-helix	trans	-60.8	-47.8	173.7	-170.2	-97	0	0	0	110.7	L38 I39 G40 A44 S45 W46	L38-F42 WeakPolarHBondContact O-CB 3.38Å; L38-F42 PolarHBondContact O-N 3.33Å; L38-F42 VanDerWaalsContact O-N 3.07Å; I39-F42 PolarHBondContact O-N 3.04Å; G40-F42 VanDerWaalsContact C-N 3.33Å; G40-F42 PolarHBondContact O-N 3.2Å; F42-A44 VanDerWaalsContact C-N 3.29Å; F42-A44 PolarHBondContact O-N 3.28Å; F42-S45 PolarHBondContact O-N 3.05Å; F42-S45 VanDerWaalsContact O-N 3.13Å; F42-W46 AromaticContact CD1-CD1 3.79Å; F42-W46 AromaticContact CD2-CD1 3.99Å; F42-W46 AromaticContact CD2-NE1 3.76Å; F42-W46 AromaticContact CE1-CD1 3.56Å; F42-W46 HydrophobicContact CE1-CG 4.19Å; F42-W46 AromaticContact CE1-NE1 3.5Å; F42-W46 AromaticContact CE2-CD1 3.79Å; F42-W46 AromaticContact CE2-NE1 3.14Å; F42-W46 AromaticContact CZ-CD1 3.58Å; F42-W46 HydrophobicContact CZ-CD2 4.42Å; F42-W46 AromaticContact CZ-CE2 3.6Å; F42-W46 HydrophobicContact CZ-CG 4.4Å; F42-W46 HydrophobicContact CZ-CZ2 4.09Å; F42-W46 AromaticContact CZ-NE1 3Å; F42-W46 PolarHBondContact O-N 3.42Å; F42-W46 VanDerWaalsContact O-N 3.08Å
43	S	84.6	Confident	84.5	Confident	17 Å²	17	66.8 Å²	66.8	12%	0.119	34%	0.341	C	S	.	.	H	α-helix	trans	-60.9	-37.9	178.6	78.4	0	0	0	0	112.2	I39 G40 S45 W46 L47	I39-S43 WeakPolarHBondContact O-CB 3.5Å; I39-S43 PolarHBondContact O-N 3.29Å; G40-S43 PolarHBondContact O-N 2.72Å; G40-S43 PolarHBondContact O-OG 3.33Å; S43-S45 VanDerWaalsContact C-N 3.35Å; S43-S45 PolarHBondContact O-N 3.49Å; S43-W46 PolarHBondContact O-N 2.98Å; S43-L47 VanDerWaalsContact O-CB 3.23Å; S43-L47 WeakPolarHBondContact O-CB 3.03Å; S43-L47 WeakPolarHBondContact O-CG 3.46Å; S43-L47 PolarHBondContact O-N 3.4Å
44	A	80.1	Confident	84.6	Confident	45 Å²	45	67.7 Å²	67.7	37%	0.372	35%	0.348	S	S	.	.	H	α-helix	trans	-66.2	-36.9	176.8	0	0	0	0	0	112.3	G40 E41 F42	G40-A44 PolarHBondContact O-N 2.93Å; E41-A44 PolarHBondContact O-N 3.12Å; F42-A44 VanDerWaalsContact C-N 3.29Å; F42-A44 PolarHBondContact O-N 3.28Å
45	S	82.7	Confident	84.9	Confident	78 Å²	78	72.7 Å²	72.7	55%	0.545	37%	0.372	S	S	.	.	H	α-helix	trans	-72.6	-26.6	176.8	-172.6	0	0	0	0	113.3	E41 F42 S43 H48	E41-S45 PolarHBondContact O-N 3.45Å; F42-S45 PolarHBondContact O-N 3.05Å; F42-S45 VanDerWaalsContact O-N 3.13Å; S43-S45 VanDerWaalsContact C-N 3.35Å; S43-S45 PolarHBondContact O-N 3.49Å; S45-H48 PolarHBondContact O-CE1 3.31Å; S45-H48 PolarHBondContact O-ND1 3.19Å
46	W	83.4	Confident	85	Confident	178 Å²	178	72 Å²	72	67%	0.674	37%	0.37	S	S	*	.	H	α-helix	trans	-95.4	-36.7	-179.6	-77.3	80	0	0	0	113.4	F42 S43 H48	F42-W46 AromaticContact CD1-CD1 3.79Å; F42-W46 AromaticContact CD2-CD1 3.99Å; F42-W46 AromaticContact CD2-NE1 3.76Å; F42-W46 AromaticContact CE1-CD1 3.56Å; F42-W46 HydrophobicContact CE1-CG 4.19Å; F42-W46 AromaticContact CE1-NE1 3.5Å; F42-W46 AromaticContact CE2-CD1 3.79Å; F42-W46 AromaticContact CE2-NE1 3.14Å; F42-W46 AromaticContact CZ-CD1 3.58Å; F42-W46 HydrophobicContact CZ-CD2 4.42Å; F42-W46 AromaticContact CZ-CE2 3.6Å; F42-W46 HydrophobicContact CZ-CG 4.4Å; F42-W46 HydrophobicContact CZ-CZ2 4.09Å; F42-W46 AromaticContact CZ-NE1 3Å; F42-W46 PolarHBondContact O-N 3.42Å; F42-W46 VanDerWaalsContact O-N 3.08Å; S43-W46 PolarHBondContact O-N 2.98Å; W46-H48 PolarHBondContact O-N 3.13Å
47	L	79.7	Confident	85.2	Confident	46 Å²	46	71.9 Å²	71.9	24%	0.241	37%	0.37	C	S	.	.			trans	-96.7	73.8	-173.4	-58.3	174.2	0	0	0	111.2	S43 V49 A52 K53 V56	S43-L47 VanDerWaalsContact O-CB 3.23Å; S43-L47 WeakPolarHBondContact O-CB 3.03Å; S43-L47 WeakPolarHBondContact O-CG 3.46Å; S43-L47 PolarHBondContact O-N 3.4Å; L47-V49 VanDerWaalsContact C-N 3.3Å; L47-A52 HydrophobicContact CB-CB 4.22Å; L47-A52 HydrophobicContact CD2-CB 4.09Å; L47-K53 HydrophobicContact CB-CG 4.09Å; L47-K53 HydrophobicContact CD1-CG 4.1Å; L47-V56 HydrophobicContact CD1-CB 4.37Å; L47-V56 HydrophobicContact CD1-CG2 4Å; L47-V56 HydrophobicContact CD2-CG2 4.45Å
48	H	77.1	Confident	85.5	Confident	160 Å²	160	74 Å²	74	74%	0.741	39%	0.385	S	S	*	.			trans	-79.7	-12.3	173.7	-64.7	104.8	0	0	0	113.7	S45 W46	S45-H48 PolarHBondContact O-CE1 3.31Å; S45-H48 PolarHBondContact O-ND1 3.19Å; W46-H48 PolarHBondContact O-N 3.13Å
49	V	82.1	Confident	85.8	Confident	101 Å²	101	71.3 Å²	71.3	61%	0.612	38%	0.378	S	S	*	.	S	Bend	trans	-79.1	134	-176.2	180	0	0	0	0	109.5	L47 Y51 A52	L47-V49 VanDerWaalsContact C-N 3.3Å; V49-Y51 PolarHBondContact O-N 3.15Å; V49-A52 HydrophobicContact CB-CB 4.01Å; V49-A52 WeakPolarHBondContact O-CB 3.38Å; V49-A52 PolarHBondContact O-N 3.37Å; V49-A52 VanDerWaalsContact O-N 3.17Å
50	P	78.8	Confident	86	Confident	77 Å²	77	70.2 Å²	70.2	50%	0.5	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	142.1	178.5	25.9	-35.8	0	0	0	110.8	A52	P50-A52 PolarHBondContact O-N 3.35Å; P50-A52 VanDerWaalsContact O-N 3.07Å
51	Y	82.4	Confident	86.4	Confident	126 Å²	126	72.8 Å²	72.8	49%	0.494	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	-1.8	-178.2	-45.8	-82.6	0	0	0	115.3	V49 K53 S54 I55 R114 L115	V49-Y51 PolarHBondContact O-N 3.15Å; Y51-K53 VanDerWaalsContact C-N 3.3Å; Y51-K53 PolarHBondContact O-N 2.72Å; Y51-S54 PolarHBondContact O-N 3.4Å; Y51-S54 PolarHBondContact O-OG 2.87Å; Y51-I55 WeakPolarHBondContact O-CG1 3.4Å; Y51-I55 PolarHBondContact O-N 3.34Å; Y51-R114 VanDerWaalsContact CE1-NH2 3.33Å; Y51-L115 HydrophobicContact CE1-CD2 3.95Å
52	A	87.5	Confident	86.8	Confident	16 Å²	16	72.7 Å²	72.7	13%	0.132	39%	0.391	C	S	.	.	H	α-helix	trans	-63.8	-38.7	-179.9	0	0	0	0	0	111.6	L47 V49 P50 S54 I55 V56	L47-A52 HydrophobicContact CB-CB 4.22Å; L47-A52 HydrophobicContact CD2-CB 4.09Å; V49-A52 HydrophobicContact CB-CB 4.01Å; V49-A52 WeakPolarHBondContact O-CB 3.38Å; V49-A52 PolarHBondContact O-N 3.37Å; V49-A52 VanDerWaalsContact O-N 3.17Å; P50-A52 PolarHBondContact O-N 3.35Å; P50-A52 VanDerWaalsContact O-N 3.07Å; A52-S54 VanDerWaalsContact C-N 3.34Å; A52-S54 PolarHBondContact O-N 3.2Å; A52-I55 PolarHBondContact O-N 3.42Å; A52-V56 WeakPolarHBondContact O-CB 3.44Å; A52-V56 VanDerWaalsContact O-CG2 3.25Å; A52-V56 WeakPolarHBondContact O-CG2 3.19Å; A52-V56 PolarHBondContact O-N 2.95Å
53	K	86.2	Confident	87.1	Confident	42 Å²	42	69.7 Å²	69.7	18%	0.183	39%	0.389	C	S	.	.	H	α-helix	trans	-66	-35.8	177.7	-52.3	177.1	-172.4	176.6	0	112.2	L47 Y51 V56 G57 L107 E111	L47-K53 HydrophobicContact CB-CG 4.09Å; L47-K53 HydrophobicContact CD1-CG 4.1Å; Y51-K53 VanDerWaalsContact C-N 3.3Å; Y51-K53 PolarHBondContact O-N 2.72Å; K53-V56 PolarHBondContact O-N 3.46Å; K53-G57 PolarHBondContact O-N 3.26Å; K53-L107 HydrophobicContact CB-CD2 4.17Å; K53-E111 HydrophobicContact CB-CG 3.67Å; K53-E111 WeakPolarHBondContact CB-OE1 3.35Å; K53-E111 HydrophobicContact CD-CG 4.45Å; K53-E111 WeakPolarHBondContact CD-OE1 3.27Å; K53-E111 WeakPolarHBondContact CG-OE1 3.4Å
54	S	88.1	Confident	87.5	Confident	29 Å²	29	70.4 Å²	70.4	20%	0.203	39%	0.392	C	S	.	.	H	α-helix	trans	-71.9	-39.5	177.6	61.1	0	0	0	0	111.4	Y51 A52 G57 V58	Y51-S54 PolarHBondContact O-N 3.4Å; Y51-S54 PolarHBondContact O-OG 2.87Å; A52-S54 VanDerWaalsContact C-N 3.34Å; A52-S54 PolarHBondContact O-N 3.2Å; S54-G57 PolarHBondContact O-N 3.08Å; S54-V58 WeakPolarHBondContact O-CB 3.16Å; S54-V58 VanDerWaalsContact O-CG2 3.29Å; S54-V58 WeakPolarHBondContact O-CG2 3.19Å; S54-V58 PolarHBondContact O-N 3Å
55	I	91.7	Very high	88.1	Confident	117 Å²	117	73.2 Å²	73.2	60%	0.6	40%	0.397	S	S	*	.	H	α-helix	trans	-61.8	-45.9	174	-65.8	166.9	0	0	0	110.2	Y51 A52 V58 A59	Y51-I55 WeakPolarHBondContact O-CG1 3.4Å; Y51-I55 PolarHBondContact O-N 3.34Å; A52-I55 PolarHBondContact O-N 3.42Å; I55-V58 PolarHBondContact O-N 2.93Å; I55-A59 VanDerWaalsContact O-CB 3.31Å; I55-A59 WeakPolarHBondContact O-CB 3.44Å; I55-A59 PolarHBondContact O-N 3.39Å
56	V	91.7	Very high	88.5	Confident	52 Å²	52	74.1 Å²	74.1	32%	0.315	40%	0.399	S	S	.	.	H	α-helix	trans	-63.3	-44	176.4	171.5	0	0	0	0	110.9	L47 A52 K53 A59 I60 L107	L47-V56 HydrophobicContact CD1-CB 4.37Å; L47-V56 HydrophobicContact CD1-CG2 4Å; L47-V56 HydrophobicContact CD2-CG2 4.45Å; A52-V56 WeakPolarHBondContact O-CB 3.44Å; A52-V56 VanDerWaalsContact O-CG2 3.25Å; A52-V56 WeakPolarHBondContact O-CG2 3.19Å; A52-V56 PolarHBondContact O-N 2.95Å; K53-V56 PolarHBondContact O-N 3.46Å; V56-A59 PolarHBondContact O-N 3.27Å; V56-I60 HydrophobicContact CG1-CD1 3.72Å; V56-I60 HydrophobicContact CG1-CG1 4.31Å; V56-I60 VanDerWaalsContact O-CG1 3.28Å; V56-I60 WeakPolarHBondContact O-CG1 3.25Å; V56-I60 PolarHBondContact O-N 3.04Å; V56-L107 HydrophobicContact CG1-CD1 4.05Å
57	G	91.7	Very high	88.8	Confident	0 Å²	0	71 Å²	71	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-57.8	-50.8	176	0	0	0	0	0	112.2	K53 S54 A59 I60 T61	K53-G57 PolarHBondContact O-N 3.26Å; S54-G57 PolarHBondContact O-N 3.08Å; G57-A59 VanDerWaalsContact C-N 3.32Å; G57-A59 PolarHBondContact O-N 2.89Å; G57-I60 PolarHBondContact O-N 2.68Å; G57-T61 PolarHBondContact O-N 2.75Å; G57-T61 PolarHBondContact O-OG1 3.21Å
58	V	93.2	Very high	89.2	Confident	66 Å²	66	71.1 Å²	71.1	40%	0.4	39%	0.391	S	S	.	.	H	α-helix	trans	-59	-43.4	175	172	0	0	0	0	111.2	S54 I55 T61 L62 F108	S54-V58 WeakPolarHBondContact O-CB 3.16Å; S54-V58 VanDerWaalsContact O-CG2 3.29Å; S54-V58 WeakPolarHBondContact O-CG2 3.19Å; S54-V58 PolarHBondContact O-N 3Å; I55-V58 PolarHBondContact O-N 2.93Å; V58-T61 PolarHBondContact O-N 3.39Å; V58-L62 HydrophobicContact CG1-CD1 3.86Å; V58-L62 HydrophobicContact CG1-CG 4.26Å; V58-L62 WeakPolarHBondContact O-CB 3.34Å; V58-L62 VanDerWaalsContact O-CG 3.3Å; V58-L62 WeakPolarHBondContact O-CG 3.41Å; V58-L62 PolarHBondContact O-N 2.87Å; V58-F108 HydrophobicContact CG2-CE1 3.85Å; V58-F108 HydrophobicContact CG2-CZ 3.66Å
59	A	94	Very high	89.8	Confident	55 Å²	55	69 Å²	69	46%	0.455	38%	0.381	S	S	.	.	H	α-helix	trans	-62.2	-44	178.7	0	0	0	0	0	111.9	I55 V56 G57 L62 A63	I55-A59 VanDerWaalsContact O-CB 3.31Å; I55-A59 WeakPolarHBondContact O-CB 3.44Å; I55-A59 PolarHBondContact O-N 3.39Å; V56-A59 PolarHBondContact O-N 3.27Å; G57-A59 VanDerWaalsContact C-N 3.32Å; G57-A59 PolarHBondContact O-N 2.89Å; A59-L62 PolarHBondContact O-N 3.49Å; A59-A63 VanDerWaalsContact O-CB 3.29Å; A59-A63 WeakPolarHBondContact O-CB 3.46Å; A59-A63 PolarHBondContact O-N 3.35Å
60	I	93.8	Very high	90.1	Very high	37 Å²	37	65.5 Å²	65.5	19%	0.19	37%	0.366	C	S	.	.	H	α-helix	trans	-64.6	-45.5	175.9	-64.2	165	0	0	0	110.1	V56 G57 L62 A63 L64 F100 L103 T104 L107	V56-I60 HydrophobicContact CG1-CD1 3.72Å; V56-I60 HydrophobicContact CG1-CG1 4.31Å; V56-I60 VanDerWaalsContact O-CG1 3.28Å; V56-I60 WeakPolarHBondContact O-CG1 3.25Å; V56-I60 PolarHBondContact O-N 3.04Å; G57-I60 PolarHBondContact O-N 2.68Å; I60-L62 VanDerWaalsContact C-N 3.34Å; I60-L62 PolarHBondContact O-N 3.2Å; I60-A63 PolarHBondContact O-N 3.45Å; I60-L64 VanDerWaalsContact O-CB 3.23Å; I60-L64 WeakPolarHBondContact O-CB 3.42Å; I60-L64 PolarHBondContact O-N 2.93Å; I60-F100 HydrophobicContact CG2-CB 4.44Å; I60-L103 HydrophobicContact CD1-CD2 4.16Å; I60-T104 HydrophobicContact CB-CG2 3.63Å; I60-T104 HydrophobicContact CG2-CG2 3.33Å; I60-L107 HydrophobicContact CD1-CD1 3.96Å
61	T	93.3	Very high	90.2	Very high	53 Å²	53	67.9 Å²	67.9	33%	0.325	38%	0.375	S	S	.	.	H	α-helix	trans	-59.7	-44.6	178.2	-58.9	0	0	0	0	111.3	G57 V58 L64 Q65	G57-T61 PolarHBondContact O-N 2.75Å; G57-T61 PolarHBondContact O-OG1 3.21Å; V58-T61 PolarHBondContact O-N 3.39Å; T61-L64 PolarHBondContact O-N 3.46Å; T61-Q65 VanDerWaalsContact O-CB 3.26Å; T61-Q65 WeakPolarHBondContact O-CB 3.32Å; T61-Q65 PolarHBondContact O-N 3.36Å
62	L	94.5	Very high	90.3	Very high	107 Å²	107	68.3 Å²	68.3	56%	0.56	38%	0.381	S	S	*	.	H	α-helix	trans	-66.1	-44.6	177.8	-71.8	175.2	0	0	0	111.7	V58 A59 I60 L64 Q65 V66	V58-L62 HydrophobicContact CG1-CD1 3.86Å; V58-L62 HydrophobicContact CG1-CG 4.26Å; V58-L62 WeakPolarHBondContact O-CB 3.34Å; V58-L62 VanDerWaalsContact O-CG 3.3Å; V58-L62 WeakPolarHBondContact O-CG 3.41Å; V58-L62 PolarHBondContact O-N 2.87Å; A59-L62 PolarHBondContact O-N 3.49Å; I60-L62 VanDerWaalsContact C-N 3.34Å; I60-L62 PolarHBondContact O-N 3.2Å; L62-L64 VanDerWaalsContact C-N 3.31Å; L62-L64 PolarHBondContact O-N 3.24Å; L62-Q65 PolarHBondContact O-N 3.33Å; L62-V66 VanDerWaalsContact O-CG2 3.31Å; L62-V66 WeakPolarHBondContact O-CG2 3.45Å; L62-V66 PolarHBondContact O-N 3.01Å
63	A	93.6	Very high	90.1	Very high	62 Å²	62	68.8 Å²	68.8	51%	0.512	38%	0.382	S	S	.	.	H	α-helix	trans	-60.7	-43.3	176.6	0	0	0	0	0	111.4	A59 I60 V66 F67	A59-A63 VanDerWaalsContact O-CB 3.29Å; A59-A63 WeakPolarHBondContact O-CB 3.46Å; A59-A63 PolarHBondContact O-N 3.35Å; I60-A63 PolarHBondContact O-N 3.45Å; A63-V66 PolarHBondContact O-N 3.45Å; A63-F67 VanDerWaalsContact O-CB 3.26Å; A63-F67 WeakPolarHBondContact O-CB 3.32Å; A63-F67 PolarHBondContact O-N 3Å
64	L	92	Very high	89.9	Confident	32 Å²	32	70.9 Å²	70.9	17%	0.168	39%	0.393	C	S	.	.	H	α-helix	trans	-65.7	-43.2	177.4	-173.6	63.1	0	0	0	111.4	I60 T61 L62 V66 F67 L68 V97 F100	I60-L64 VanDerWaalsContact O-CB 3.23Å; I60-L64 WeakPolarHBondContact O-CB 3.42Å; I60-L64 PolarHBondContact O-N 2.93Å; T61-L64 PolarHBondContact O-N 3.46Å; L62-L64 VanDerWaalsContact C-N 3.31Å; L62-L64 PolarHBondContact O-N 3.24Å; L64-V66 PolarHBondContact O-N 2.88Å; L64-F67 PolarHBondContact O-N 2.74Å; L64-L68 HydrophobicContact CD1-CD1 4.16Å; L64-L68 HydrophobicContact CD1-CG 4.26Å; L64-L68 HydrophobicContact CG-CD1 3.92Å; L64-L68 HydrophobicContact CG-CG 4.4Å; L64-L68 WeakPolarHBondContact O-CB 3.29Å; L64-L68 VanDerWaalsContact O-CG 3.26Å; L64-L68 WeakPolarHBondContact O-CG 3.33Å; L64-L68 PolarHBondContact O-N 2.88Å; L64-V97 HydrophobicContact CD1-CG1 4.17Å; L64-F100 HydrophobicContact CD2-CB 4.33Å
65	Q	92.9	Very high	89.5	Confident	103 Å²	103	71.6 Å²	71.6	48%	0.481	39%	0.393	S	S	.	.	H	α-helix	trans	-60.6	-46.1	176.4	-178.6	62.5	33.2	0	0	111.5	T61 L62 F67 L68 Q69	T61-Q65 VanDerWaalsContact O-CB 3.26Å; T61-Q65 WeakPolarHBondContact O-CB 3.32Å; T61-Q65 PolarHBondContact O-N 3.36Å; L62-Q65 PolarHBondContact O-N 3.33Å; Q65-F67 VanDerWaalsContact C-N 3.35Å; Q65-L68 PolarHBondContact O-N 2.99Å; Q65-Q69 VanDerWaalsContact O-CG 3.23Å; Q65-Q69 WeakPolarHBondContact O-CG 3.41Å; Q65-Q69 PolarHBondContact O-N 3.07Å; Q65-Q69 VanDerWaalsContact O-N 3.07Å
66	V	92	Very high	88.8	Confident	98 Å²	98	69.4 Å²	69.4	59%	0.594	38%	0.378	S	S	*	.	H	α-helix	trans	-64.9	-41.1	177.5	171.2	0	0	0	0	110.9	L62 A63 L64 Q69	L62-V66 VanDerWaalsContact O-CG2 3.31Å; L62-V66 WeakPolarHBondContact O-CG2 3.45Å; L62-V66 PolarHBondContact O-N 3.01Å; A63-V66 PolarHBondContact O-N 3.45Å; L64-V66 PolarHBondContact O-N 2.88Å; V66-Q69 PolarHBondContact O-N 3.28Å
67	F	88.9	Confident	88	Confident	112 Å²	112	67.7 Å²	67.7	49%	0.491	37%	0.367	S	S	.	.	H	α-helix	trans	-62.2	-45.3	177.2	-178.9	-105.2	0	0	0	111.9	A63 L64 Q65 Q69 G70 V73	A63-F67 VanDerWaalsContact O-CB 3.26Å; A63-F67 WeakPolarHBondContact O-CB 3.32Å; A63-F67 PolarHBondContact O-N 3Å; L64-F67 PolarHBondContact O-N 2.74Å; Q65-F67 VanDerWaalsContact C-N 3.35Å; F67-Q69 PolarHBondContact O-N 3.46Å; F67-G70 PolarHBondContact O-N 2.87Å; F67-V73 HydrophobicContact CD1-CG1 3.85Å; F67-V73 HydrophobicContact CD2-CG2 4.37Å; F67-V73 HydrophobicContact CE1-CG1 3.47Å; F67-V73 VanDerWaalsContact CE1-CG1 3.47Å; F67-V73 HydrophobicContact CE2-CG1 4.43Å; F67-V73 HydrophobicContact CE2-CG2 4Å; F67-V73 HydrophobicContact CG-CG1 4.48Å; F67-V73 HydrophobicContact CZ-CG1 3.8Å; F67-V73 HydrophobicContact CZ-CG2 4.07Å; F67-V73 WeakPolarHBondContact O-CB 3.42Å; F67-V73 WeakPolarHBondContact O-CG2 3.47Å
68	L	87.8	Confident	87.1	Confident	48 Å²	48	75.4 Å²	75.4	25%	0.251	40%	0.401	S	S	.	.	H	α-helix	trans	-73.3	-12.5	178.7	-68.5	174.8	0	0	0	113.8	L64 Q65 G70 V73 Q74 L77 V97	L64-L68 HydrophobicContact CD1-CD1 4.16Å; L64-L68 HydrophobicContact CD1-CG 4.26Å; L64-L68 HydrophobicContact CG-CD1 3.92Å; L64-L68 HydrophobicContact CG-CG 4.4Å; L64-L68 WeakPolarHBondContact O-CB 3.29Å; L64-L68 VanDerWaalsContact O-CG 3.26Å; L64-L68 WeakPolarHBondContact O-CG 3.33Å; L64-L68 PolarHBondContact O-N 2.88Å; Q65-L68 PolarHBondContact O-N 2.99Å; L68-G70 VanDerWaalsContact C-N 3.32Å; L68-V73 HydrophobicContact CD2-CG1 4.43Å; L68-Q74 WeakPolarHBondContact O-CG 3.37Å; L68-Q74 PolarHBondContact O-NE2 2.81Å; L68-L77 HydrophobicContact CD2-CD2 3.72Å; L68-V97 HydrophobicContact CD2-CG1 4.34Å
69	Q	89.8	Confident	86	Confident	115 Å²	115	76 Å²	76	54%	0.537	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-12.2	174.3	-82.8	175.3	-26.6	0	0	113.4	Q65 V66 F67 D71	Q65-Q69 VanDerWaalsContact O-CG 3.23Å; Q65-Q69 WeakPolarHBondContact O-CG 3.41Å; Q65-Q69 PolarHBondContact O-N 3.07Å; Q65-Q69 VanDerWaalsContact O-N 3.07Å; V66-Q69 PolarHBondContact O-N 3.28Å; F67-Q69 PolarHBondContact O-N 3.46Å; Q69-D71 PolarHBondContact O-N 3.35Å
70	G	87.5	Confident	84.6	Confident	29 Å²	29	78 Å²	78	30%	0.299	40%	0.399	S	S	.	.			trans	-71.1	123.1	175.3	0	0	0	0	0	111	F67 L68 E72 V73 Q74	F67-G70 PolarHBondContact O-N 2.87Å; L68-G70 VanDerWaalsContact C-N 3.32Å; G70-E72 PolarHBondContact O-N 3.05Å; G70-V73 WeakPolarHBondContact O-CA 3.46Å; G70-V73 WeakPolarHBondContact O-CB 3.29Å; G70-V73 PolarHBondContact O-N 2.97Å; G70-Q74 PolarHBondContact O-N 3.49Å
71	D	82.8	Confident	82.7	Confident	127 Å²	127	81.1 Å²	81.1	68%	0.679	42%	0.422	S	S	*	.	H	α-helix	trans	-52.7	-43.3	179.1	-64.7	-29.5	0	0	0	111.8	Q69 V73 Q74 E75	Q69-D71 PolarHBondContact O-N 3.35Å; D71-V73 VanDerWaalsContact C-N 3.29Å; D71-V73 PolarHBondContact O-N 3.38Å; D71-Q74 PolarHBondContact O-N 3.4Å; D71-E75 PolarHBondContact O-N 3Å
72	E	83.7	Confident	81	Confident	134 Å²	134	86.7 Å²	86.7	63%	0.626	44%	0.437	S	S	*	.	H	α-helix	trans	-61.5	-35.4	176.5	-58.2	-65.8	153.4	0	0	112.8	G70 Y76	G70-E72 PolarHBondContact O-N 3.05Å; E72-Y76 WeakPolarHBondContact O-CB 3.27Å; E72-Y76 PolarHBondContact O-N 3.08Å
73	V	82.9	Confident	79.1	Confident	26 Å²	26	85.3 Å²	85.3	16%	0.158	42%	0.424	C	S	.	.	H	α-helix	trans	-74.6	-37.7	178.5	178.6	0	0	0	0	110.2	F67 L68 G70 D71 Y76 L77	F67-V73 HydrophobicContact CD1-CG1 3.85Å; F67-V73 HydrophobicContact CD2-CG2 4.37Å; F67-V73 HydrophobicContact CE1-CG1 3.47Å; F67-V73 VanDerWaalsContact CE1-CG1 3.47Å; F67-V73 HydrophobicContact CE2-CG1 4.43Å; F67-V73 HydrophobicContact CE2-CG2 4Å; F67-V73 HydrophobicContact CG-CG1 4.48Å; F67-V73 HydrophobicContact CZ-CG1 3.8Å; F67-V73 HydrophobicContact CZ-CG2 4.07Å; F67-V73 WeakPolarHBondContact O-CB 3.42Å; F67-V73 WeakPolarHBondContact O-CG2 3.47Å; L68-V73 HydrophobicContact CD2-CG1 4.43Å; G70-V73 WeakPolarHBondContact O-CA 3.46Å; G70-V73 WeakPolarHBondContact O-CB 3.29Å; G70-V73 PolarHBondContact O-N 2.97Å; D71-V73 VanDerWaalsContact C-N 3.29Å; D71-V73 PolarHBondContact O-N 3.38Å; V73-Y76 PolarHBondContact O-N 3.2Å; V73-L77 WeakPolarHBondContact O-CB 3.4Å; V73-L77 PolarHBondContact O-N 2.92Å
74	Q	82	Confident	77.3	Confident	87 Å²	87	86.2 Å²	86.2	41%	0.407	42%	0.415	S	S	.	.	H	α-helix	trans	-65.6	-45.6	173.8	-65.9	-172.3	-6.2	0	0	111.2	L68 G70 D71 Y76 L77 F78	L68-Q74 WeakPolarHBondContact O-CG 3.37Å; L68-Q74 PolarHBondContact O-NE2 2.81Å; G70-Q74 PolarHBondContact O-N 3.49Å; D71-Q74 PolarHBondContact O-N 3.4Å; Q74-Y76 VanDerWaalsContact C-N 3.28Å; Q74-Y76 PolarHBondContact O-N 2.94Å; Q74-L77 PolarHBondContact O-N 2.94Å; Q74-F78 HydrophobicContact CB-CD2 4.31Å; Q74-F78 WeakPolarHBondContact O-CB 3.49Å; Q74-F78 WeakPolarHBondContact O-CD2 3.28Å; Q74-F78 PolarHBondContact O-N 3.41Å
75	E	79.4	Confident	75.7	Confident	43 Å²	43	91.6 Å²	91.6	20%	0.201	44%	0.439	C	S	.	.	H	α-helix	trans	-58.8	-44.5	173	-162.8	-177.7	149.6	0	0	109.9	D71 L77 E79 R82 Y83	D71-E75 PolarHBondContact O-N 3Å; E75-L77 PolarHBondContact O-N 2.89Å; E75-E79 HydrophobicContact CG-CB 4.11Å; E75-E79 HydrophobicContact CG-CG 3.67Å; E75-E79 WeakPolarHBondContact CG-OE2 3.26Å; E75-E79 WeakPolarHBondContact O-CA 3.28Å; E75-E79 WeakPolarHBondContact O-CB 3.35Å; E75-E79 PolarHBondContact O-N 2.87Å; E75-R82 IonicContact OE1-CZ 3.75Å; E75-R82 VanDerWaalsContact OE1-CZ 3.29Å; E75-R82 IonicContact OE1-NE 3.32Å; E75-R82 IonicContact OE1-NH1 3.27Å; E75-R82 PolarHBondContact OE1-NH1 2.87Å; E75-R82 IonicContact OE1-NH2 3.78Å; E75-Y83 HydrophobicContact CG-CE2 4.25Å
76	Y	76.6	Confident	74.1	Confident	71 Å²	71	94.1 Å²	94.1	28%	0.278	46%	0.456	S	S	.	.	H	α-helix	trans	-63.1	-36.2	177.5	179	-106	0	0	0	113.4	E72 V73 Q74 Y83 S90 R93	E72-Y76 WeakPolarHBondContact O-CB 3.27Å; E72-Y76 PolarHBondContact O-N 3.08Å; V73-Y76 PolarHBondContact O-N 3.2Å; Q74-Y76 VanDerWaalsContact C-N 3.28Å; Q74-Y76 PolarHBondContact O-N 2.94Å; Y76-Y83 AromaticContact CD2-CD1 3.96Å; Y76-Y83 HydrophobicContact CD2-CD1 3.96Å; Y76-Y83 HydrophobicContact CD2-CD2 4.16Å; Y76-Y83 AromaticContact CD2-CG 3.73Å; Y76-Y83 HydrophobicContact CD2-CG 3.73Å; Y76-Y83 HydrophobicContact CE2-CD1 4.42Å; Y76-Y83 HydrophobicContact CE2-CG 4.25Å; Y76-S90 WeakPolarHBondContact CE2-OG 3.32Å; Y76-S90 WeakPolarHBondContact OH-CA 3.38Å; Y76-S90 WeakPolarHBondContact OH-CB 3.44Å; Y76-S90 PolarHBondContact OH-OG 3.49Å; Y76-S90 VanDerWaalsContact OH-OG 3.1Å; Y76-R93 HydrophobicContact CE1-CB 3.91Å; Y76-R93 HydrophobicContact CE1-CG 4.35Å; Y76-R93 WeakPolarHBondContact O-CD 3.48Å; Y76-R93 PolarHBondContact O-NE 3.24Å; Y76-R93 PolarHBondContact O-NH1 3.38Å; Y76-R93 PolarHBondContact O-NH2 2.83Å
77	L	76	Confident	73	Confident	17 Å²	17	91 Å²	91	9%	0.089	44%	0.444	C	S	.	.	H	α-helix	trans	-80.2	-49.2	179.5	-113.3	63.4	0	0	0	111.9	L68 V73 Q74 E75 R93 V97	L68-L77 HydrophobicContact CD2-CD2 3.72Å; V73-L77 WeakPolarHBondContact O-CB 3.4Å; V73-L77 PolarHBondContact O-N 2.92Å; Q74-L77 PolarHBondContact O-N 2.94Å; E75-L77 PolarHBondContact O-N 2.89Å; L77-R93 HydrophobicContact CD1-CG 4.41Å; L77-R93 PolarHBondContact O-NH2 3.42Å; L77-V97 HydrophobicContact CD1-CG2 4.2Å; L77-V97 HydrophobicContact CD2-CB 4.46Å; L77-V97 HydrophobicContact CD2-CG1 4.2Å; L77-V97 HydrophobicContact CD2-CG2 4.25Å
78	F	73.4	Confident	72.1	Confident	162 Å²	162	91.9 Å²	91.9	71%	0.711	45%	0.453	S	S	*	.	H	α-helix	trans	-92.4	-24.6	-169.3	-64.7	-69.7	0	0	0	114.5	Q74 E80	Q74-F78 HydrophobicContact CB-CD2 4.31Å; Q74-F78 WeakPolarHBondContact O-CB 3.49Å; Q74-F78 WeakPolarHBondContact O-CD2 3.28Å; Q74-F78 PolarHBondContact O-N 3.41Å; F78-E80 PolarHBondContact O-N 3.42Å
79	E	69.6	Low	71.5	Confident	77 Å²	77	97.4 Å²	97.4	36%	0.36	48%	0.475	S	S	.	.			trans	-84.5	117.6	177.9	-63	-162.4	179.6	0	0	111.6	E75 R82 R93	E75-E79 HydrophobicContact CG-CB 4.11Å; E75-E79 HydrophobicContact CG-CG 3.67Å; E75-E79 WeakPolarHBondContact CG-OE2 3.26Å; E75-E79 WeakPolarHBondContact O-CA 3.28Å; E75-E79 WeakPolarHBondContact O-CB 3.35Å; E75-E79 PolarHBondContact O-N 2.87Å; E79-R82 IonicContact OE2-CZ 3.18Å; E79-R82 IonicContact OE2-NE 3.53Å; E79-R82 IonicContact OE2-NH2 3.29Å; E79-R82 PolarHBondContact OE2-NH2 3.36Å; E79-R93 PolarHBondContact O-NH2 3.33Å
80	E	63.6	Low	70.7	Confident	97 Å²	97	92.6 Å²	92.6	45%	0.453	45%	0.454	S	S	.	.			trans	-72	-39.5	-175.4	-69.9	-173.1	128.5	0	0	116.1	E21 F78	E21-E80 WeakPolarHBondContact CG-OE1 3.4Å; F78-E80 PolarHBondContact O-N 3.42Å
81	P	55.4	Low	70.1	Confident	104 Å²	104	92.6 Å²	92.6	68%	0.675	45%	0.447	S	S	*	.	S	Bend	trans	-86.3	-39.1	-165.2	-14.1	30.3	0	0	0	115.2	Y83	P81-Y83 PolarHBondContact O-N 2.82Å
82	R	56.1	Low	69.9	Low	170 Å²	170	87.2 Å²	87.2	64%	0.642	42%	0.418	S	S	*	.	S	Bend	trans	-74.6	-29.7	-163.6	-65.7	-170.9	-147.1	171.1	19.4	114.4	E75 E79	E75-R82 IonicContact OE1-CZ 3.75Å; E75-R82 VanDerWaalsContact OE1-CZ 3.29Å; E75-R82 IonicContact OE1-NE 3.32Å; E75-R82 IonicContact OE1-NH1 3.27Å; E75-R82 PolarHBondContact OE1-NH1 2.87Å; E75-R82 IonicContact OE1-NH2 3.78Å; E79-R82 IonicContact OE2-CZ 3.18Å; E79-R82 IonicContact OE2-NE 3.53Å; E79-R82 IonicContact OE2-NH2 3.29Å; E79-R82 PolarHBondContact OE2-NH2 3.36Å
83	Y	55.6	Low	69.8	Low	77 Å²	77	81.8 Å²	81.8	30%	0.302	39%	0.392	S	S	.	.	S	Bend	trans	-109.1	-2.8	-166.1	-64.6	-72.4	0	0	0	114.6	E75 Y76 P81 E85 S90	E75-Y83 HydrophobicContact CG-CE2 4.25Å; Y76-Y83 AromaticContact CD2-CD1 3.96Å; Y76-Y83 HydrophobicContact CD2-CD1 3.96Å; Y76-Y83 HydrophobicContact CD2-CD2 4.16Å; Y76-Y83 AromaticContact CD2-CG 3.73Å; Y76-Y83 HydrophobicContact CD2-CG 3.73Å; Y76-Y83 HydrophobicContact CE2-CD1 4.42Å; Y76-Y83 HydrophobicContact CE2-CG 4.25Å; P81-Y83 PolarHBondContact O-N 2.82Å; Y83-E85 PolarHBondContact O-N 3.23Å; Y83-S90 PolarHBondContact O-OG 2.87Å
84	R	55.2	Low	69.8	Low	82 Å²	82	82.8 Å²	82.8	31%	0.309	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-2.4	-173	-150.3	170.5	-157.5	159.1	16.8	114.5	V20 L91	V20-R84 PolarHBondContact O-NH2 3.45Å; V20-R84 VanDerWaalsContact O-NH2 3.07Å; R84-L91 HydrophobicContact CG-CD2 3.5Å; R84-L91 VanDerWaalsContact CG-CD2 3.5Å; R84-L91 WeakPolarHBondContact O-CD2 3.31Å
85	E	57.8	Low	69.8	Low	145 Å²	145	78.6 Å²	78.6	68%	0.678	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-19.9	-166.2	-64	-157	149.7	0	0	116.9	Y83	Y83-E85 PolarHBondContact O-N 3.23Å
86	N	60.1	Low	70.1	Confident	155 Å²	155	78.7 Å²	78.7	83%	0.829	38%	0.377	S	S	*	.	S	Bend	trans	-141.3	43.6	-163	-65.6	-52	0	0	0	118.7
87	G	68.1	Low	70.6	Confident	34 Å²	34	76.6 Å²	76.6	35%	0.351	37%	0.372	S	S	.	.			trans	173.3	150.5	164.1	0	0	0	0	0	116.6	F89 S90 L91	G87-F89 PolarHBondContact O-N 3.5Å; G87-S90 PolarHBondContact O-N 2.87Å; G87-L91 WeakPolarHBondContact O-CG 3.33Å; G87-L91 PolarHBondContact O-N 2.8Å
88	L	70.3	Confident	71.2	Confident	129 Å²	129	77.3 Å²	77.3	68%	0.675	38%	0.378	S	S	*	.	H	α-helix	trans	-56.6	-36.6	177.5	-68.2	175.3	0	0	0	112.7	N92	L88-N92 PolarHBondContact O-ND2 3.09Å
89	F	75	Confident	72	Confident	165 Å²	165	70 Å²	70	72%	0.724	35%	0.347	S	S	*	.	H	α-helix	trans	-69.5	-38.9	176.3	-66.8	-75.7	0	0	0	112.3	G87 L91 N92 R93 I96	G87-F89 PolarHBondContact O-N 3.5Å; F89-L91 VanDerWaalsContact C-N 3.3Å; F89-L91 PolarHBondContact O-N 3.31Å; F89-N92 CarbonylContact O-C 3.54Å; F89-N92 PolarHBondContact O-N 2.89Å; F89-R93 WeakPolarHBondContact O-CA 3.29Å; F89-R93 PolarHBondContact O-N 3.47Å; F89-R93 VanDerWaalsContact O-N 3.09Å; F89-I96 HydrophobicContact CD1-CD1 3.73Å; F89-I96 HydrophobicContact CE1-CD1 4.48Å
90	S	74.2	Confident	73	Confident	14 Å²	14	70.9 Å²	70.9	10%	0.098	35%	0.35	C	S	.	.	H	α-helix	trans	-67.2	-33	-179.9	-156.3	0	0	0	0	112.8	Y76 Y83 G87 N92 R93	Y76-S90 WeakPolarHBondContact CE2-OG 3.32Å; Y76-S90 WeakPolarHBondContact OH-CA 3.38Å; Y76-S90 WeakPolarHBondContact OH-CB 3.44Å; Y76-S90 PolarHBondContact OH-OG 3.49Å; Y76-S90 VanDerWaalsContact OH-OG 3.1Å; Y83-S90 PolarHBondContact O-OG 2.87Å; G87-S90 PolarHBondContact O-N 2.87Å; S90-N92 VanDerWaalsContact C-N 3.29Å; S90-N92 PolarHBondContact O-N 3.34Å; S90-R93 WeakPolarHBondContact O-CD 3.29Å
91	L	75.5	Confident	74.2	Confident	28 Å²	28	67.3 Å²	67.3	15%	0.147	34%	0.338	C	S	.	.	H	α-helix	trans	-73.6	-19.5	178.7	-66.2	176.1	0	0	0	114.1	G24 M25 R84 G87 F89	G24-L91 CarbonylContact C-O 3.49Å; G24-L91 WeakPolarHBondContact CA-O 2.94Å; M25-L91 HydrophobicContact CB-CB 4.22Å; M25-L91 HydrophobicContact CE-CD1 4.45Å; M25-L91 HydrophobicContact CE-CD2 3.81Å; M25-L91 PolarHBondContact N-O 2.95Å; M25-L91 HydrophobicContact SD-CD1 4.1Å; M25-L91 HydrophobicContact SD-CD2 4.48Å; R84-L91 HydrophobicContact CG-CD2 3.5Å; R84-L91 VanDerWaalsContact CG-CD2 3.5Å; R84-L91 WeakPolarHBondContact O-CD2 3.31Å; G87-L91 WeakPolarHBondContact O-CG 3.33Å; G87-L91 PolarHBondContact O-N 2.8Å; F89-L91 VanDerWaalsContact C-N 3.3Å; F89-L91 PolarHBondContact O-N 3.31Å
92	N	78.4	Confident	75.8	Confident	14 Å²	14	64.1 Å²	64.1	8%	0.075	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	23.9	-173.8	-61.2	-38.9	0	0	0	112.3	M25 H26 W27 L88 F89 S90 E94 G95 I96	M25-N92 PolarHBondContact N-OD1 3.36Å; M25-N92 VanDerWaalsContact N-OD1 3.16Å; H26-N92 PolarHBondContact N-OD1 3.2Å; W27-N92 HydrophobicContact CB-CB 3.91Å; W27-N92 HydrophobicContact CD2-CB 4.4Å; W27-N92 HydrophobicContact CE3-CB 3.95Å; W27-N92 HydrophobicContact CG-CB 4.46Å; W27-N92 PolarHBondContact N-OD1 3.29Å; L88-N92 PolarHBondContact O-ND2 3.09Å; F89-N92 CarbonylContact O-C 3.54Å; F89-N92 PolarHBondContact O-N 2.89Å; S90-N92 VanDerWaalsContact C-N 3.29Å; S90-N92 PolarHBondContact O-N 3.34Å; N92-E94 PolarHBondContact O-N 3.48Å; N92-G95 PolarHBondContact O-N 2.99Å; N92-I96 WeakPolarHBondContact O-CG1 3.3Å; N92-I96 PolarHBondContact O-N 3.48Å
93	R	81.6	Confident	77.5	Confident	20 Å²	20	56.5 Å²	56.5	8%	0.075	29%	0.29	C	S	.	.	H	α-helix	trans	-61.7	-41.7	-172.3	63.3	-168	176	-164.7	9.1	112.9	Y76 L77 E79 F89 S90 I96 V97	Y76-R93 HydrophobicContact CE1-CB 3.91Å; Y76-R93 HydrophobicContact CE1-CG 4.35Å; Y76-R93 WeakPolarHBondContact O-CD 3.48Å; Y76-R93 PolarHBondContact O-NE 3.24Å; Y76-R93 PolarHBondContact O-NH1 3.38Å; Y76-R93 PolarHBondContact O-NH2 2.83Å; L77-R93 HydrophobicContact CD1-CG 4.41Å; L77-R93 PolarHBondContact O-NH2 3.42Å; E79-R93 PolarHBondContact O-NH2 3.33Å; F89-R93 WeakPolarHBondContact O-CA 3.29Å; F89-R93 PolarHBondContact O-N 3.47Å; F89-R93 VanDerWaalsContact O-N 3.09Å; S90-R93 WeakPolarHBondContact O-CD 3.29Å; R93-I96 PolarHBondContact O-N 2.86Å; R93-V97 WeakPolarHBondContact O-CG2 3.16Å; R93-V97 PolarHBondContact O-N 2.92Å
94	E	81.4	Confident	79.1	Confident	47 Å²	47	53.5 Å²	53.5	22%	0.22	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-47.4	178.8	-71.2	140.2	-147.9	0	0	110.8	N92 I96 V97 S98	N92-E94 PolarHBondContact O-N 3.48Å; E94-I96 VanDerWaalsContact C-N 3.34Å; E94-I96 PolarHBondContact O-N 3.27Å; E94-V97 PolarHBondContact O-N 2.86Å; E94-S98 WeakPolarHBondContact O-CB 3.3Å; E94-S98 PolarHBondContact O-N 3.42Å
95	G	82.9	Confident	80.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-55.9	-46.6	174.7	0	0	0	0	0	112.3	Y23 N92 S98 V99	Y23-G95 WeakPolarHBondContact O-CA 3.28Å; Y23-G95 PolarHBondContact O-N 3.25Å; N92-G95 PolarHBondContact O-N 2.99Å; G95-S98 WeakPolarHBondContact O-CB 3.49Å; G95-S98 PolarHBondContact O-N 2.93Å; G95-S98 PolarHBondContact O-OG 3.44Å; G95-V99 WeakPolarHBondContact O-CG2 3.22Å; G95-V99 PolarHBondContact O-N 2.96Å
96	I	85.7	Confident	82.1	Confident	44 Å²	44	49.8 Å²	49.8	23%	0.226	27%	0.268	C	S	.	.	H	α-helix	trans	-65.1	-44.6	178.9	-66	166.3	0	0	0	111.7	W27 F89 N92 R93 E94 S98 V99 F100	W27-I96 HydrophobicContact CE3-CG1 4.35Å; W27-I96 HydrophobicContact CH2-CG1 3.88Å; W27-I96 HydrophobicContact CZ2-CG1 4.32Å; W27-I96 HydrophobicContact CZ3-CD1 4.49Å; W27-I96 HydrophobicContact CZ3-CG1 3.91Å; F89-I96 HydrophobicContact CD1-CD1 3.73Å; F89-I96 HydrophobicContact CE1-CD1 4.48Å; N92-I96 WeakPolarHBondContact O-CG1 3.3Å; N92-I96 PolarHBondContact O-N 3.48Å; R93-I96 PolarHBondContact O-N 2.86Å; E94-I96 VanDerWaalsContact C-N 3.34Å; E94-I96 PolarHBondContact O-N 3.27Å; I96-S98 VanDerWaalsContact C-N 3.26Å; I96-S98 PolarHBondContact O-N 3.48Å; I96-V99 WeakPolarHBondContact O-CB 3.37Å; I96-V99 PolarHBondContact O-N 3.38Å; I96-F100 HydrophobicContact CG2-CE2 4.23Å; I96-F100 WeakPolarHBondContact O-CD2 3.43Å
97	V	87.7	Confident	83.5	Confident	28 Å²	28	42.5 Å²	42.5	17%	0.17	23%	0.229	C	C	.	.	H	α-helix	trans	-62.4	-37.9	176.9	170.4	0	0	0	0	110.6	L64 L68 L77 R93 E94 V99 F100 G101	L64-V97 HydrophobicContact CD1-CG1 4.17Å; L68-V97 HydrophobicContact CD2-CG1 4.34Å; L77-V97 HydrophobicContact CD1-CG2 4.2Å; L77-V97 HydrophobicContact CD2-CB 4.46Å; L77-V97 HydrophobicContact CD2-CG1 4.2Å; L77-V97 HydrophobicContact CD2-CG2 4.25Å; R93-V97 WeakPolarHBondContact O-CG2 3.16Å; R93-V97 PolarHBondContact O-N 2.92Å; E94-V97 PolarHBondContact O-N 2.86Å; V97-V99 VanDerWaalsContact C-N 3.29Å; V97-V99 PolarHBondContact O-N 2.9Å; V97-F100 PolarHBondContact O-N 3.14Å; V97-G101 PolarHBondContact O-N 3.11Å
98	S	87.4	Confident	84.4	Confident	31 Å²	31	44.2 Å²	44.2	22%	0.217	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-33	177.6	80	0	0	0	0	113.2	T32 E94 G95 I96 F100 G101 C102	T32-S98 WeakPolarHBondContact CG2-OG 3.25Å; T32-S98 PolarHBondContact OG1-OG 3.03Å; E94-S98 WeakPolarHBondContact O-CB 3.3Å; E94-S98 PolarHBondContact O-N 3.42Å; G95-S98 WeakPolarHBondContact O-CB 3.49Å; G95-S98 PolarHBondContact O-N 2.93Å; G95-S98 PolarHBondContact O-OG 3.44Å; I96-S98 VanDerWaalsContact C-N 3.26Å; I96-S98 PolarHBondContact O-N 3.48Å; S98-F100 VanDerWaalsContact C-N 3.28Å; S98-F100 PolarHBondContact O-N 2.89Å; S98-G101 PolarHBondContact O-N 3.41Å; S98-G101 VanDerWaalsContact O-N 3.12Å; S98-C102 PolarHBondContact O-N 3.44Å; S98-C102 PolarHBondContact O-SG 2.95Å
99	V	90.6	Very high	85.2	Confident	9 Å²	9	40.5 Å²	40.5	6%	0.055	22%	0.215	C	C	.	.	H	α-helix	trans	-56	-44.7	175.8	175.4	0	0	0	0	110.8	W27 T32 L35 I39 G95 I96 V97 L103	W27-V99 HydrophobicContact CZ2-CG2 3.82Å; T32-V99 HydrophobicContact CG2-CB 4.48Å; T32-V99 HydrophobicContact CG2-CG2 3.95Å; L35-V99 HydrophobicContact CB-CG1 4.14Å; L35-V99 HydrophobicContact CB-CG2 4.42Å; L35-V99 HydrophobicContact CD1-CG2 4.18Å; I39-V99 HydrophobicContact CD1-CG1 4.14Å; G95-V99 WeakPolarHBondContact O-CG2 3.22Å; G95-V99 PolarHBondContact O-N 2.96Å; I96-V99 WeakPolarHBondContact O-CB 3.37Å; I96-V99 PolarHBondContact O-N 3.38Å; V97-V99 VanDerWaalsContact C-N 3.29Å; V97-V99 PolarHBondContact O-N 2.9Å; V99-L103 WeakPolarHBondContact O-CB 3.23Å; V99-L103 PolarHBondContact O-N 3.45Å
100	F	91.3	Very high	85.6	Confident	96 Å²	96	33.8 Å²	33.8	42%	0.421	19%	0.187	S	C	.	.	H	α-helix	trans	-67.3	-40.4	178.9	-65.2	-78	0	0	0	111.6	I60 L64 I96 V97 S98 L103 T104	I60-F100 HydrophobicContact CG2-CB 4.44Å; L64-F100 HydrophobicContact CD2-CB 4.33Å; I96-F100 HydrophobicContact CG2-CE2 4.23Å; I96-F100 WeakPolarHBondContact O-CD2 3.43Å; V97-F100 PolarHBondContact O-N 3.14Å; S98-F100 VanDerWaalsContact C-N 3.28Å; S98-F100 PolarHBondContact O-N 2.89Å; F100-L103 PolarHBondContact O-N 2.65Å; F100-T104 WeakPolarHBondContact O-CG2 3.04Å; F100-T104 PolarHBondContact O-N 3.35Å
101	G	89.1	Confident	86.1	Confident	21 Å²	21	33.5 Å²	33.5	22%	0.216	19%	0.185	C	C	.	.	H	α-helix	trans	-58.3	-55.1	174.6	0	0	0	0	0	112.2	V97 S98 L103 T104 I105	V97-G101 PolarHBondContact O-N 3.11Å; S98-G101 PolarHBondContact O-N 3.41Å; S98-G101 VanDerWaalsContact O-N 3.12Å; G101-L103 VanDerWaalsContact C-N 3.31Å; G101-L103 PolarHBondContact O-N 3.06Å; G101-T104 PolarHBondContact O-N 3.35Å; G101-T104 VanDerWaalsContact O-N 3.15Å; G101-T104 PolarHBondContact O-OG1 3.3Å; G101-I105 PolarHBondContact O-N 2.91Å
102	C	89	Confident	86.6	Confident	38 Å²	38	37 Å²	37	26%	0.257	20%	0.203	S	C	.	.	H	α-helix	trans	-58.4	-41.9	176.9	-68.2	0	0	0	0	112	T32 E36 S98 T104 I105 F106	T32-C102 HydrophobicContact CG2-CB 4.34Å; E36-C102 HydrophobicContact CG-CB 4.15Å; S98-C102 PolarHBondContact O-N 3.44Å; S98-C102 PolarHBondContact O-SG 2.95Å; C102-T104 VanDerWaalsContact C-N 3.33Å; C102-T104 PolarHBondContact O-N 2.74Å; C102-I105 PolarHBondContact O-N 3.17Å; C102-F106 PolarHBondContact O-N 3.07Å
103	L	90.4	Very high	86.8	Confident	10 Å²	10	38.4 Å²	38.4	5%	0.052	21%	0.209	C	C	.	.	H	α-helix	trans	-59.4	-41.6	176.5	179.8	65.6	0	0	0	112	I39 I60 V99 F100 G101 F106 L107	I39-L103 HydrophobicContact CB-CD1 4.1Å; I39-L103 HydrophobicContact CG2-CD1 3.69Å; I39-L103 HydrophobicContact CG2-CD2 3.66Å; I39-L103 HydrophobicContact CG2-CG 4.34Å; I60-L103 HydrophobicContact CD1-CD2 4.16Å; V99-L103 WeakPolarHBondContact O-CB 3.23Å; V99-L103 PolarHBondContact O-N 3.45Å; F100-L103 PolarHBondContact O-N 2.65Å; G101-L103 VanDerWaalsContact C-N 3.31Å; G101-L103 PolarHBondContact O-N 3.06Å; L103-F106 WeakPolarHBondContact O-CB 3.03Å; L103-F106 PolarHBondContact O-N 2.87Å; L103-L107 HydrophobicContact CD1-CG 4.44Å; L103-L107 HydrophobicContact CG-CD1 4.31Å; L103-L107 VanDerWaalsContact O-CG 3.3Å; L103-L107 WeakPolarHBondContact O-CG 3.39Å; L103-L107 PolarHBondContact O-N 3.35Å
104	T	90.6	Very high	87	Confident	13 Å²	13	41.1 Å²	41.1	8%	0.08	22%	0.219	C	C	.	.	H	α-helix	trans	-64.4	-41.8	177	61.7	0	0	0	0	112.4	I60 F100 G101 C102 F106 L107 F108	I60-T104 HydrophobicContact CB-CG2 3.63Å; I60-T104 HydrophobicContact CG2-CG2 3.33Å; F100-T104 WeakPolarHBondContact O-CG2 3.04Å; F100-T104 PolarHBondContact O-N 3.35Å; G101-T104 PolarHBondContact O-N 3.35Å; G101-T104 VanDerWaalsContact O-N 3.15Å; G101-T104 PolarHBondContact O-OG1 3.3Å; C102-T104 VanDerWaalsContact C-N 3.33Å; C102-T104 PolarHBondContact O-N 2.74Å; T104-F106 VanDerWaalsContact C-N 3.32Å; T104-F106 PolarHBondContact O-N 2.8Å; T104-L107 PolarHBondContact O-N 2.98Å; T104-F108 WeakPolarHBondContact O-CD2 3.18Å; T104-F108 PolarHBondContact O-N 3.4Å
105	I	88.2	Confident	87.2	Confident	118 Å²	118	42.1 Å²	42.1	61%	0.605	23%	0.226	S	C	*	.	H	α-helix	trans	-61.6	-44.7	176.8	-64.1	170.4	0	0	0	109.9	G101 C102 F108 A109	G101-I105 PolarHBondContact O-N 2.91Å; C102-I105 PolarHBondContact O-N 3.17Å; I105-F108 PolarHBondContact O-N 2.91Å; I105-A109 WeakPolarHBondContact O-CB 3.11Å; I105-A109 PolarHBondContact O-N 3.4Å
106	F	86.9	Confident	87.2	Confident	31 Å²	31	47.6 Å²	47.6	14%	0.136	25%	0.246	C	C	.	.	H	α-helix	trans	-58	-49.2	175.3	174.4	-99.5	0	0	0	112.4	E36 C102 L103 T104 F108 A109 T110 F150	E36-F106 HydrophobicContact CG-CB 4.32Å; E36-F106 WeakPolarHBondContact OE1-CB 3.37Å; E36-F106 WeakPolarHBondContact OE1-CD2 3.45Å; E36-F106 WeakPolarHBondContact OE1-CG 3.41Å; C102-F106 PolarHBondContact O-N 3.07Å; L103-F106 WeakPolarHBondContact O-CB 3.03Å; L103-F106 PolarHBondContact O-N 2.87Å; T104-F106 VanDerWaalsContact C-N 3.32Å; T104-F106 PolarHBondContact O-N 2.8Å; F106-F108 VanDerWaalsContact C-N 3.32Å; F106-F108 PolarHBondContact O-N 3.48Å; F106-A109 PolarHBondContact O-N 3.22Å; F106-T110 HydrophobicContact CD2-CG2 4.35Å; F106-T110 HydrophobicContact CE1-CG2 4.06Å; F106-T110 HydrophobicContact CE2-CG2 3.92Å; F106-T110 HydrophobicContact CZ-CG2 3.76Å; F106-T110 WeakPolarHBondContact O-CG2 3.23Å; F106-T110 PolarHBondContact O-N 2.88Å; F106-T110 PolarHBondContact O-OG1 3.26Å; F106-F150 HydrophobicContact CD2-CD1 4.3Å; F106-F150 AromaticContact CD2-CE1 3.45Å; F106-F150 HydrophobicContact CD2-CE1 3.45Å; F106-F150 VanDerWaalsContact CD2-CE1 3.45Å; F106-F150 AromaticContact CD2-CZ 3.92Å; F106-F150 HydrophobicContact CD2-CZ 3.92Å; F106-F150 HydrophobicContact CE2-CD1 4.29Å; F106-F150 AromaticContact CE2-CE1 3.72Å; F106-F150 HydrophobicContact CE2-CE1 3.72Å
107	L	88.6	Confident	87.1	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-60.5	-41.8	178.8	-69.4	174.2	0	0	0	111.8	K53 V56 I60 L103 T104 T110 E111	K53-L107 HydrophobicContact CB-CD2 4.17Å; V56-L107 HydrophobicContact CG1-CD1 4.05Å; I60-L107 HydrophobicContact CD1-CD1 3.96Å; L103-L107 HydrophobicContact CD1-CG 4.44Å; L103-L107 HydrophobicContact CG-CD1 4.31Å; L103-L107 VanDerWaalsContact O-CG 3.3Å; L103-L107 WeakPolarHBondContact O-CG 3.39Å; L103-L107 PolarHBondContact O-N 3.35Å; T104-L107 PolarHBondContact O-N 2.98Å; L107-T110 PolarHBondContact O-OG1 3.04Å; L107-E111 PolarHBondContact O-N 2.87Å
108	F	87.9	Confident	86.9	Confident	70 Å²	70	49.3 Å²	49.3	31%	0.307	26%	0.258	S	S	.	.	H	α-helix	trans	-66	-42.9	175	-76.5	-58.7	0	0	0	112.5	V58 T104 I105 F106 T110 E111 I112	V58-F108 HydrophobicContact CG2-CE1 3.85Å; V58-F108 HydrophobicContact CG2-CZ 3.66Å; T104-F108 WeakPolarHBondContact O-CD2 3.18Å; T104-F108 PolarHBondContact O-N 3.4Å; I105-F108 PolarHBondContact O-N 2.91Å; F106-F108 VanDerWaalsContact C-N 3.32Å; F106-F108 PolarHBondContact O-N 3.48Å; F108-T110 PolarHBondContact O-N 3.34Å; F108-E111 PolarHBondContact O-N 3.21Å; F108-I112 VanDerWaalsContact O-CG1 3.3Å; F108-I112 WeakPolarHBondContact O-CG1 3.41Å; F108-I112 PolarHBondContact O-N 3.02Å
109	A	86.1	Confident	86.7	Confident	52 Å²	52	51.5 Å²	51.5	43%	0.43	27%	0.272	S	S	.	.	H	α-helix	trans	-57.8	-48.1	178.3	0	0	0	0	0	111.2	I105 F106 E111 I112 E113	I105-A109 WeakPolarHBondContact O-CB 3.11Å; I105-A109 PolarHBondContact O-N 3.4Å; F106-A109 PolarHBondContact O-N 3.22Å; A109-E111 VanDerWaalsContact C-N 3.3Å; A109-E111 PolarHBondContact O-N 3.21Å; A109-I112 PolarHBondContact O-N 3.38Å; A109-E113 WeakPolarHBondContact O-CB 3.29Å; A109-E113 PolarHBondContact O-N 3.38Å
110	T	84	Confident	86	Confident	23 Å²	23	52.1 Å²	52.1	14%	0.141	28%	0.275	C	S	.	.	H	α-helix	trans	-65.8	-28.7	179	64	0	0	0	0	113.7	F106 L107 F108 R114	F106-T110 HydrophobicContact CD2-CG2 4.35Å; F106-T110 HydrophobicContact CE1-CG2 4.06Å; F106-T110 HydrophobicContact CE2-CG2 3.92Å; F106-T110 HydrophobicContact CZ-CG2 3.76Å; F106-T110 WeakPolarHBondContact O-CG2 3.23Å; F106-T110 PolarHBondContact O-N 2.88Å; F106-T110 PolarHBondContact O-OG1 3.26Å; L107-T110 PolarHBondContact O-OG1 3.04Å; F108-T110 PolarHBondContact O-N 3.34Å; T110-R114 PolarHBondContact O-N 3.22Å; T110-R114 VanDerWaalsContact O-N 3.13Å
111	E	85.8	Confident	85.5	Confident	8 Å²	8	54 Å²	54	4%	0.037	28%	0.283	C	S	.	.	H	α-helix	trans	-79.3	-36.9	174.6	-77.1	-67.8	148.7	0	0	112.8	K53 L107 F108 A109 E113 R114 L115	K53-E111 HydrophobicContact CB-CG 3.67Å; K53-E111 WeakPolarHBondContact CB-OE1 3.35Å; K53-E111 HydrophobicContact CD-CG 4.45Å; K53-E111 WeakPolarHBondContact CD-OE1 3.27Å; K53-E111 WeakPolarHBondContact CG-OE1 3.4Å; L107-E111 PolarHBondContact O-N 2.87Å; F108-E111 PolarHBondContact O-N 3.21Å; A109-E111 VanDerWaalsContact C-N 3.3Å; A109-E111 PolarHBondContact O-N 3.21Å; E111-E113 VanDerWaalsContact C-N 3.26Å; E111-E113 PolarHBondContact O-N 2.73Å; E111-R114 PolarHBondContact O-N 3.15Å; E111-R114 IonicContact OE1-NE 3.76Å; E111-R114 IonicContact OE2-CZ 3.29Å; E111-R114 VanDerWaalsContact OE2-CZ 3.29Å; E111-R114 IonicContact OE2-NE 2.87Å; E111-R114 PolarHBondContact OE2-NE 2.88Å; E111-R114 IonicContact OE2-NH2 2.82Å; E111-R114 PolarHBondContact OE2-NH2 3.47Å; E111-L115 WeakPolarHBondContact O-CB 3.5Å; E111-L115 VanDerWaalsContact O-CG 3.32Å; E111-L115 WeakPolarHBondContact O-CG 3.36Å; E111-L115 PolarHBondContact O-N 2.87Å
112	I	85.7	Confident	85.1	Confident	103 Å²	103	56.2 Å²	56.2	53%	0.528	29%	0.292	S	S	.	.	H	α-helix	trans	-60.4	-43.1	171.7	-70.3	167.4	0	0	0	109.2	F108 A109 L115 W116	F108-I112 VanDerWaalsContact O-CG1 3.3Å; F108-I112 WeakPolarHBondContact O-CG1 3.41Å; F108-I112 PolarHBondContact O-N 3.02Å; A109-I112 PolarHBondContact O-N 3.38Å; I112-L115 PolarHBondContact O-N 3.49Å; I112-W116 VanDerWaalsContact O-CB 3.29Å; I112-W116 WeakPolarHBondContact O-CB 3.3Å; I112-W116 PolarHBondContact O-N 3.23Å
113	E	83.1	Confident	84.5	Confident	43 Å²	43	58 Å²	58	20%	0.201	30%	0.298	C	S	.	.	H	α-helix	trans	-57.4	-52	174.5	-176.1	-169.2	170.8	0	0	111.9	A109 E111 L115 W116 H117 L143	A109-E113 WeakPolarHBondContact O-CB 3.29Å; A109-E113 PolarHBondContact O-N 3.38Å; E111-E113 VanDerWaalsContact C-N 3.26Å; E111-E113 PolarHBondContact O-N 2.73Å; E113-L115 VanDerWaalsContact C-N 3.32Å; E113-L115 PolarHBondContact O-N 3.16Å; E113-W116 WeakPolarHBondContact O-CB 3.21Å; E113-W116 PolarHBondContact O-N 2.95Å; E113-H117 PolarHBondContact O-CD2 3.29Å; E113-H117 PolarHBondContact O-N 3.39Å; E113-H117 IonicContact OE1-NE2 3.99Å; E113-L143 HydrophobicContact CB-CD2 4.33Å; E113-L143 HydrophobicContact CG-CD2 4.03Å; E113-L143 HydrophobicContact CG-CG 4.28Å
114	R	84.2	Confident	83.8	Confident	76 Å²	76	60.3 Å²	60.3	29%	0.287	31%	0.314	S	S	.	.	H	α-helix	trans	-57.9	-43.9	177.2	-172.9	-171.6	66.9	80	0.1	112.4	Y51 T110 E111 W116 C118	Y51-R114 VanDerWaalsContact CE1-NH2 3.33Å; T110-R114 PolarHBondContact O-N 3.22Å; T110-R114 VanDerWaalsContact O-N 3.13Å; E111-R114 PolarHBondContact O-N 3.15Å; E111-R114 IonicContact OE1-NE 3.76Å; E111-R114 IonicContact OE2-CZ 3.29Å; E111-R114 VanDerWaalsContact OE2-CZ 3.29Å; E111-R114 IonicContact OE2-NE 2.87Å; E111-R114 PolarHBondContact OE2-NE 2.88Å; E111-R114 IonicContact OE2-NH2 2.82Å; E111-R114 PolarHBondContact OE2-NH2 3.47Å; R114-W116 VanDerWaalsContact C-N 3.35Å; R114-C118 WeakPolarHBondContact O-CB 3.42Å; R114-C118 PolarHBondContact O-N 3.33Å
115	L	86	Confident	83	Confident	69 Å²	69	64.4 Å²	64.4	36%	0.361	34%	0.335	S	S	.	.	H	α-helix	trans	-66.8	-39.1	178.9	-74.3	172.7	0	0	0	111.5	Y51 E111 I112 E113 C118 C119	Y51-L115 HydrophobicContact CE1-CD2 3.95Å; E111-L115 WeakPolarHBondContact O-CB 3.5Å; E111-L115 VanDerWaalsContact O-CG 3.32Å; E111-L115 WeakPolarHBondContact O-CG 3.36Å; E111-L115 PolarHBondContact O-N 2.87Å; I112-L115 PolarHBondContact O-N 3.49Å; E113-L115 VanDerWaalsContact C-N 3.32Å; E113-L115 PolarHBondContact O-N 3.16Å; L115-C118 PolarHBondContact O-N 2.82Å; L115-C119 WeakPolarHBondContact O-CB 3.09Å; L115-C119 PolarHBondContact O-N 3Å; L115-C119 PolarHBondContact O-SG 2.83Å
116	W	84.1	Confident	82.4	Confident	115 Å²	115	64.4 Å²	64.4	44%	0.436	34%	0.335	S	S	.	.	H	α-helix	trans	-60.6	-51.4	177	-168.6	-90	0	0	0	111.2	I112 E113 R114 C118 C119 Q120 T139 L143	I112-W116 VanDerWaalsContact O-CB 3.29Å; I112-W116 WeakPolarHBondContact O-CB 3.3Å; I112-W116 PolarHBondContact O-N 3.23Å; E113-W116 WeakPolarHBondContact O-CB 3.21Å; E113-W116 PolarHBondContact O-N 2.95Å; R114-W116 VanDerWaalsContact C-N 3.35Å; W116-C118 VanDerWaalsContact C-N 3.32Å; W116-C118 PolarHBondContact O-N 3.34Å; W116-C119 PolarHBondContact O-N 3.43Å; W116-Q120 VanDerWaalsContact CD1-CD 3.46Å; W116-Q120 WeakPolarHBondContact O-CG 3.29Å; W116-Q120 PolarHBondContact O-N 3.35Å; W116-T139 HydrophobicContact CZ2-CG2 4.06Å; W116-L143 HydrophobicContact CB-CD2 3.84Å; W116-L143 HydrophobicContact CG-CD2 3.78Å
117	H	82.9	Confident	81.6	Confident	42 Å²	42	64.6 Å²	64.6	19%	0.194	34%	0.337	C	S	.	.	H	α-helix	trans	-62.2	-37.9	176.6	-69.8	-59.2	0	0	0	112.7	E113 Q120 F121 D140 Y144	E113-H117 PolarHBondContact O-CD2 3.29Å; E113-H117 PolarHBondContact O-N 3.39Å; E113-H117 IonicContact OE1-NE2 3.99Å; H117-Q120 PolarHBondContact ND1-OE1 3.12Å; H117-Q120 PolarHBondContact O-N 3.04Å; H117-F121 WeakPolarHBondContact O-CB 3.37Å; H117-F121 PolarHBondContact O-N 3.36Å; H117-D140 IonicContact CE1-OD1 3.04Å; H117-D140 PolarHBondContact CE1-OD1 3.09Å; H117-D140 IonicContact ND1-OD1 3.2Å; H117-D140 PolarHBondContact ND1-OD1 2.91Å; H117-Y144 AromaticContact CE1-CE2 3.4Å; H117-Y144 VanDerWaalsContact CE1-CE2 3.4Å; H117-Y144 WeakPolarHBondContact CE1-CE2 3.3Å; H117-Y144 AromaticContact CE1-CZ 3.59Å; H117-Y144 AromaticContact NE2-CZ 3.96Å
118	C	82.9	Confident	80.4	Confident	65 Å²	65	71 Å²	71	44%	0.439	37%	0.371	S	S	.	.	H	α-helix	trans	-63.3	-46.7	175.6	-172.7	0	0	0	0	111.6	R114 L115 W116 Q120 F121 V122	R114-C118 WeakPolarHBondContact O-CB 3.42Å; R114-C118 PolarHBondContact O-N 3.33Å; L115-C118 PolarHBondContact O-N 2.82Å; W116-C118 VanDerWaalsContact C-N 3.32Å; W116-C118 PolarHBondContact O-N 3.34Å; C118-Q120 VanDerWaalsContact C-N 3.34Å; C118-Q120 PolarHBondContact O-N 2.64Å; C118-F121 PolarHBondContact O-N 2.85Å; C118-V122 WeakPolarHBondContact O-CG2 3.4Å; C118-V122 PolarHBondContact O-N 2.84Å
119	C	82.9	Confident	79.2	Confident	77 Å²	77	70.7 Å²	70.7	52%	0.52	39%	0.387	S	S	.	.	H	α-helix	trans	-59.9	-44.1	175.9	-73.6	0	0	0	0	111.3	L115 W116 V122 M123	L115-C119 WeakPolarHBondContact O-CB 3.09Å; L115-C119 PolarHBondContact O-N 3Å; L115-C119 PolarHBondContact O-SG 2.83Å; W116-C119 PolarHBondContact O-N 3.43Å; C119-V122 PolarHBondContact O-N 2.84Å; C119-M123 WeakPolarHBondContact O-CB 3.49Å; C119-M123 WeakPolarHBondContact O-CG 3.36Å; C119-M123 PolarHBondContact O-N 3.31Å
120	Q	76	Confident	78	Confident	23 Å²	23	75.5 Å²	75.5	11%	0.107	40%	0.401	C	S	.	.	H	α-helix	trans	-60.8	-45.9	176.5	-75.1	175.9	-31.9	0	0	112.2	W116 H117 C118 V122 M123 S124 L136 T139 D140	W116-Q120 VanDerWaalsContact CD1-CD 3.46Å; W116-Q120 WeakPolarHBondContact O-CG 3.29Å; W116-Q120 PolarHBondContact O-N 3.35Å; H117-Q120 PolarHBondContact ND1-OE1 3.12Å; H117-Q120 PolarHBondContact O-N 3.04Å; C118-Q120 VanDerWaalsContact C-N 3.34Å; C118-Q120 PolarHBondContact O-N 2.64Å; Q120-V122 PolarHBondContact O-N 3.41Å; Q120-M123 PolarHBondContact O-N 2.93Å; Q120-S124 WeakPolarHBondContact O-CB 3.32Å; Q120-S124 PolarHBondContact O-N 3.46Å; Q120-L136 HydrophobicContact CG-CD2 4.43Å; Q120-L136 PolarHBondContact NE2-O 3.45Å; Q120-T139 PolarHBondContact NE2-OG1 2.6Å; Q120-D140 PolarHBondContact OE1-OD1 2.92Å
121	F	81.4	Confident	77.1	Confident	134 Å²	134	84.1 Å²	84.1	59%	0.588	44%	0.436	S	S	*	.	H	α-helix	trans	-59.9	-45.8	177.7	180	-105.3	0	0	0	111.6	H117 C118 M123 S124 L125	H117-F121 WeakPolarHBondContact O-CB 3.37Å; H117-F121 PolarHBondContact O-N 3.36Å; C118-F121 PolarHBondContact O-N 2.85Å; F121-M123 PolarHBondContact O-N 3.33Å; F121-S124 WeakPolarHBondContact O-CB 3.26Å; F121-S124 PolarHBondContact O-N 2.83Å; F121-L125 HydrophobicContact CD1-CD1 4.19Å; F121-L125 HydrophobicContact CE1-CD1 3.74Å; F121-L125 HydrophobicContact CE1-CG 4.37Å; F121-L125 HydrophobicContact CZ-CD1 4.17Å; F121-L125 HydrophobicContact CZ-CD2 4.44Å; F121-L125 HydrophobicContact CZ-CG 4.46Å; F121-L125 WeakPolarHBondContact O-CG 3.36Å; F121-L125 PolarHBondContact O-N 2.81Å; F121-L125 VanDerWaalsContact O-N 3.07Å
122	V	81.6	Confident	75.9	Confident	68 Å²	68	87.7 Å²	87.7	41%	0.412	46%	0.455	S	S	.	.	H	α-helix	trans	-62.7	-43.8	176.1	173.1	0	0	0	0	111.5	C118 C119 Q120 S124 L125 I126	C118-V122 WeakPolarHBondContact O-CG2 3.4Å; C118-V122 PolarHBondContact O-N 2.84Å; C119-V122 PolarHBondContact O-N 2.84Å; Q120-V122 PolarHBondContact O-N 3.41Å; V122-S124 VanDerWaalsContact C-N 3.32Å; V122-S124 PolarHBondContact O-N 3.23Å; V122-L125 WeakPolarHBondContact O-CB 3.44Å; V122-L125 PolarHBondContact O-N 2.89Å; V122-I126 HydrophobicContact CG1-CD1 3.94Å; V122-I126 WeakPolarHBondContact O-CG1 3.28Å; V122-I126 PolarHBondContact O-N 2.91Å
123	M	76.1	Confident	75	Confident	77 Å²	77	86.2 Å²	86.2	38%	0.379	45%	0.451	S	S	.	.	H	α-helix	trans	-61.3	-41.4	176.8	-72	-61	-70.2	0	0	111.6	C119 Q120 F121 L125 I126 Q127 L136	C119-M123 WeakPolarHBondContact O-CB 3.49Å; C119-M123 WeakPolarHBondContact O-CG 3.36Å; C119-M123 PolarHBondContact O-N 3.31Å; Q120-M123 PolarHBondContact O-N 2.93Å; F121-M123 PolarHBondContact O-N 3.33Å; M123-L125 VanDerWaalsContact C-N 3.32Å; M123-L125 PolarHBondContact O-N 3.44Å; M123-I126 PolarHBondContact O-N 3.46Å; M123-I126 HydrophobicContact SD-CD1 4.47Å; M123-Q127 WeakPolarHBondContact O-CB 3.06Å; M123-Q127 WeakPolarHBondContact O-CG 3.28Å; M123-Q127 PolarHBondContact O-N 3.42Å; M123-L136 HydrophobicContact CB-CD1 4.29Å
124	S	74.2	Confident	74.1	Confident	57 Å²	57	89.9 Å²	89.9	40%	0.399	47%	0.472	S	S	.	.	H	α-helix	trans	-60	-40.2	174.8	-174	0	0	0	0	112	Q120 F121 V122 Q127 N128	Q120-S124 WeakPolarHBondContact O-CB 3.32Å; Q120-S124 PolarHBondContact O-N 3.46Å; F121-S124 WeakPolarHBondContact O-CB 3.26Å; F121-S124 PolarHBondContact O-N 2.83Å; V122-S124 VanDerWaalsContact C-N 3.32Å; V122-S124 PolarHBondContact O-N 3.23Å; S124-Q127 CarbonylContact O-C 3.52Å; S124-Q127 PolarHBondContact O-N 3.12Å; S124-N128 PolarHBondContact O-N 3.35Å
125	L	75	Confident	73.3	Confident	99 Å²	99	90.7 Å²	90.7	52%	0.518	49%	0.485	S	S	.	.	H	α-helix	trans	-63.4	-43.4	174.9	-66	176.3	0	0	0	112.5	F121 V122 M123 Q127	F121-L125 HydrophobicContact CD1-CD1 4.19Å; F121-L125 HydrophobicContact CE1-CD1 3.74Å; F121-L125 HydrophobicContact CE1-CG 4.37Å; F121-L125 HydrophobicContact CZ-CD1 4.17Å; F121-L125 HydrophobicContact CZ-CD2 4.44Å; F121-L125 HydrophobicContact CZ-CG 4.46Å; F121-L125 WeakPolarHBondContact O-CG 3.36Å; F121-L125 PolarHBondContact O-N 2.81Å; F121-L125 VanDerWaalsContact O-N 3.07Å; V122-L125 WeakPolarHBondContact O-CB 3.44Å; V122-L125 PolarHBondContact O-N 2.89Å; M123-L125 VanDerWaalsContact C-N 3.32Å; M123-L125 PolarHBondContact O-N 3.44Å; L125-Q127 VanDerWaalsContact C-N 3.33Å
126	I	74.8	Confident	72.3	Confident	119 Å²	119	89.3 Å²	89.3	61%	0.61	48%	0.478	S	S	*	.	H	α-helix	trans	-67.3	-38	177.4	-63.6	166.6	0	0	0	110.5	V122 M123	V122-I126 HydrophobicContact CG1-CD1 3.94Å; V122-I126 WeakPolarHBondContact O-CG1 3.28Å; V122-I126 PolarHBondContact O-N 2.91Å; M123-I126 PolarHBondContact O-N 3.46Å; M123-I126 HydrophobicContact SD-CD1 4.47Å
127	Q	70.5	Confident	71.7	Confident	35 Å²	35	88.7 Å²	88.7	16%	0.164	48%	0.483	C	S	.	.	H	α-helix	trans	-89.7	7.1	-175.7	-75.5	-172.7	-19	0	0	115	M123 S124 L125 G129 H130 L132	M123-Q127 WeakPolarHBondContact O-CB 3.06Å; M123-Q127 WeakPolarHBondContact O-CG 3.28Å; M123-Q127 PolarHBondContact O-N 3.42Å; S124-Q127 CarbonylContact O-C 3.52Å; S124-Q127 PolarHBondContact O-N 3.12Å; L125-Q127 VanDerWaalsContact C-N 3.33Å; Q127-G129 CarbonylContact O-C 3.58Å; Q127-G129 PolarHBondContact O-N 3.24Å; Q127-H130 WeakPolarHBondContact CB-O 3.28Å; Q127-H130 PolarHBondContact O-N 3.37Å; Q127-H130 VanDerWaalsContact O-O 3.12Å; Q127-L132 VanDerWaalsContact NE2-CB 3.27Å; Q127-L132 VanDerWaalsContact NE2-CD2 3.31Å
128	N	64.2	Low	71.1	Confident	135 Å²	135	91.3 Å²	91.3	72%	0.722	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-11.4	162.1	-79.8	-43.4	0	0	0	112.5	S124	S124-N128 PolarHBondContact O-N 3.35Å
129	G	62.4	Low	70.5	Confident	64 Å²	64	90.1 Å²	90.1	66%	0.66	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-17.2	164.3	0	0	0	0	0	118.5	Q127	Q127-G129 CarbonylContact O-C 3.58Å; Q127-G129 PolarHBondContact O-N 3.24Å
130	H	60.9	Low	70	Confident	154 Å²	154	88.5 Å²	88.5	71%	0.713	48%	0.479	S	S	*	.	S	Bend	trans	-144.5	134.3	-173.1	-98.3	-96.1	0	0	0	114.8	Q127 L132	Q127-H130 WeakPolarHBondContact CB-O 3.28Å; Q127-H130 PolarHBondContact O-N 3.37Å; Q127-H130 VanDerWaalsContact O-O 3.12Å; H130-L132 PolarHBondContact O-N 3.2Å
131	K	63.7	Low	70	Confident	203 Å²	203	88.8 Å²	88.8	88%	0.883	49%	0.488	S	S	*	.			trans	-73.8	60	-165.5	-143	179.9	-165	-178.4	0	115.2
132	L	61.4	Low	69.8	Low	84 Å²	84	87.7 Å²	87.7	44%	0.44	49%	0.486	S	S	.	.			trans	-111.1	36.7	174.4	-160.7	79.1	0	0	0	112.5	Q127 H130	Q127-L132 VanDerWaalsContact NE2-CB 3.27Å; Q127-L132 VanDerWaalsContact NE2-CD2 3.31Å; H130-L132 PolarHBondContact O-N 3.2Å
133	T	66.2	Low	69.4	Low	71 Å²	71	86.1 Å²	86.1	44%	0.436	48%	0.475	S	S	.	.	H	α-helix	trans	-71.5	-35.7	176.3	51.8	0	0	0	0	112.3	V135 L136 D137	T133-V135 PolarHBondContact O-N 3.41Å; T133-L136 PolarHBondContact O-N 3.27Å; T133-L136 VanDerWaalsContact O-N 3.16Å; T133-D137 PolarHBondContact O-N 2.85Å
134	N	65.5	Low	69.3	Low	121 Å²	121	88.2 Å²	88.2	65%	0.647	48%	0.48	S	S	*	.	H	α-helix	trans	-66.1	-34.1	-169.6	-63.6	-11.3	0	0	0	115.1	V138	N134-V138 WeakPolarHBondContact O-CG2 3.35Å
135	V	67.2	Low	69.4	Low	93 Å²	93	90.7 Å²	90.7	56%	0.564	49%	0.486	S	S	*	.	H	α-helix	trans	-74.8	-35.6	177.8	178.8	0	0	0	0	110.2	T133 T139	T133-V135 PolarHBondContact O-N 3.41Å; V135-T139 WeakPolarHBondContact O-CG2 3.47Å; V135-T139 PolarHBondContact O-N 3.06Å
136	L	65	Low	69.4	Low	39 Å²	39	91.1 Å²	91.1	20%	0.204	49%	0.489	C	S	.	.	H	α-helix	trans	-69.9	-42.7	-178.8	-62.2	175.7	0	0	0	111.1	Q120 M123 T133 V138 T139 D140	Q120-L136 HydrophobicContact CG-CD2 4.43Å; Q120-L136 PolarHBondContact NE2-O 3.45Å; M123-L136 HydrophobicContact CB-CD1 4.29Å; T133-L136 PolarHBondContact O-N 3.27Å; T133-L136 VanDerWaalsContact O-N 3.16Å; L136-V138 VanDerWaalsContact C-N 3.32Å; L136-V138 PolarHBondContact O-N 3.27Å; L136-T139 PolarHBondContact O-N 3.39Å; L136-T139 PolarHBondContact O-OG1 3.24Å; L136-D140 PolarHBondContact O-N 3.31Å
137	D	70.2	Confident	69.4	Low	103 Å²	103	88 Å²	88	55%	0.551	48%	0.475	S	S	*	.	H	α-helix	trans	-61.8	-37.4	178.2	-67.9	-19	0	0	0	112.5	T133 D140 G141	T133-D137 PolarHBondContact O-N 2.85Å; D137-D140 PolarHBondContact O-N 2.84Å; D137-G141 PolarHBondContact O-N 2.82Å
138	V	71.5	Confident	69.8	Low	96 Å²	96	91.1 Å²	91.1	58%	0.582	49%	0.49	S	S	*	.	H	α-helix	trans	-66.4	-42.4	176.7	174	0	0	0	0	111	N134 L136 D140 G141 M142	N134-V138 WeakPolarHBondContact O-CG2 3.35Å; L136-V138 VanDerWaalsContact C-N 3.32Å; L136-V138 PolarHBondContact O-N 3.27Å; V138-D140 VanDerWaalsContact C-N 3.32Å; V138-D140 PolarHBondContact O-N 3.48Å; V138-G141 PolarHBondContact O-N 3.33Å; V138-M142 WeakPolarHBondContact O-CG 3.32Å; V138-M142 PolarHBondContact O-N 2.96Å; V138-M142 VanDerWaalsContact O-N 3.15Å
139	T	70.3	Confident	70.5	Confident	40 Å²	40	89.5 Å²	89.5	25%	0.245	48%	0.481	C	S	.	.	H	α-helix	trans	-67.4	-34.1	178	58.3	0	0	0	0	112.7	W116 Q120 V135 L136 M142 L143	W116-T139 HydrophobicContact CZ2-CG2 4.06Å; Q120-T139 PolarHBondContact NE2-OG1 2.6Å; V135-T139 WeakPolarHBondContact O-CG2 3.47Å; V135-T139 PolarHBondContact O-N 3.06Å; L136-T139 PolarHBondContact O-N 3.39Å; L136-T139 PolarHBondContact O-OG1 3.24Å; T139-M142 PolarHBondContact O-N 3.44Å; T139-L143 PolarHBondContact O-N 3.37Å; T139-L143 VanDerWaalsContact O-N 3.13Å
140	D	72.7	Confident	71	Confident	43 Å²	43	90 Å²	90	23%	0.23	47%	0.465	C	S	.	.	H	α-helix	trans	-63.8	-49.2	175.6	-167.9	61.2	0	0	0	110.9	H117 Q120 L136 D137 V138 M142 L143 Y144	H117-D140 IonicContact CE1-OD1 3.04Å; H117-D140 PolarHBondContact CE1-OD1 3.09Å; H117-D140 IonicContact ND1-OD1 3.2Å; H117-D140 PolarHBondContact ND1-OD1 2.91Å; Q120-D140 PolarHBondContact OE1-OD1 2.92Å; L136-D140 PolarHBondContact O-N 3.31Å; D137-D140 PolarHBondContact O-N 2.84Å; V138-D140 VanDerWaalsContact C-N 3.32Å; V138-D140 PolarHBondContact O-N 3.48Å; D140-M142 VanDerWaalsContact C-N 3.28Å; D140-M142 PolarHBondContact O-N 3.34Å; D140-L143 PolarHBondContact O-N 2.87Å; D140-L143 VanDerWaalsContact O-N 3.12Å; D140-Y144 VanDerWaalsContact CG-CE2 3.48Å; D140-Y144 VanDerWaalsContact O-CD2 3.31Å; D140-Y144 WeakPolarHBondContact O-CD2 3.26Å; D140-Y144 PolarHBondContact O-N 3Å; D140-Y144 VanDerWaalsContact OD1-CE2 3.25Å; D140-Y144 WeakPolarHBondContact OD1-CE2 3.35Å; D140-Y144 WeakPolarHBondContact OD2-CD2 3.31Å; D140-Y144 WeakPolarHBondContact OD2-CE2 3.5Å
141	G	75.7	Confident	71.9	Confident	30 Å²	30	85.6 Å²	85.6	31%	0.309	45%	0.447	S	S	.	.	H	α-helix	trans	-55.9	-41.5	175	0	0	0	0	0	112.7	D137 V138 M145	D137-G141 PolarHBondContact O-N 2.82Å; V138-G141 PolarHBondContact O-N 3.33Å; G141-M145 WeakPolarHBondContact O-CB 3.23Å; G141-M145 WeakPolarHBondContact O-CE 3.26Å; G141-M145 WeakPolarHBondContact O-CG 3.33Å; G141-M145 PolarHBondContact O-N 3.46Å
142	M	76.1	Confident	72.8	Confident	111 Å²	111	82.6 Å²	82.6	55%	0.547	43%	0.431	S	S	.	.	H	α-helix	trans	-65	-40	177.4	-70	-174.6	70.5	0	0	113	V138 T139 D140 M145 L146	V138-M142 WeakPolarHBondContact O-CG 3.32Å; V138-M142 PolarHBondContact O-N 2.96Å; V138-M142 VanDerWaalsContact O-N 3.15Å; T139-M142 PolarHBondContact O-N 3.44Å; D140-M142 VanDerWaalsContact C-N 3.28Å; D140-M142 PolarHBondContact O-N 3.34Å; M142-M145 HydrophobicContact CG-CE 4.18Å; M142-L146 VanDerWaalsContact O-CG 3.27Å; M142-L146 WeakPolarHBondContact O-CG 3.32Å; M142-L146 PolarHBondContact O-N 2.8Å
143	L	73.2	Confident	73.5	Confident	34 Å²	34	83.1 Å²	83.1	18%	0.178	43%	0.434	C	S	.	.	H	α-helix	trans	-74.6	-38.7	-178.2	-165	64.4	0	0	0	112.2	E113 W116 T139 D140 L146 T147	E113-L143 HydrophobicContact CB-CD2 4.33Å; E113-L143 HydrophobicContact CG-CD2 4.03Å; E113-L143 HydrophobicContact CG-CG 4.28Å; W116-L143 HydrophobicContact CB-CD2 3.84Å; W116-L143 HydrophobicContact CG-CD2 3.78Å; T139-L143 PolarHBondContact O-N 3.37Å; T139-L143 VanDerWaalsContact O-N 3.13Å; D140-L143 PolarHBondContact O-N 2.87Å; D140-L143 VanDerWaalsContact O-N 3.12Å; L143-L146 PolarHBondContact O-N 3.36Å; L143-T147 PolarHBondContact O-N 3.28Å; L143-T147 PolarHBondContact O-OG1 3.35Å
144	Y	74.6	Confident	74.1	Confident	122 Å²	122	79.7 Å²	79.7	48%	0.478	41%	0.413	S	S	.	.	H	α-helix	trans	-62.1	-45.4	170.8	-85.3	-68.3	0	0	0	111.4	H117 D140 L146 T147 E148	H117-Y144 AromaticContact CE1-CE2 3.4Å; H117-Y144 VanDerWaalsContact CE1-CE2 3.4Å; H117-Y144 WeakPolarHBondContact CE1-CE2 3.3Å; H117-Y144 AromaticContact CE1-CZ 3.59Å; H117-Y144 AromaticContact NE2-CZ 3.96Å; D140-Y144 VanDerWaalsContact CG-CE2 3.48Å; D140-Y144 VanDerWaalsContact O-CD2 3.31Å; D140-Y144 WeakPolarHBondContact O-CD2 3.26Å; D140-Y144 PolarHBondContact O-N 3Å; D140-Y144 VanDerWaalsContact OD1-CE2 3.25Å; D140-Y144 WeakPolarHBondContact OD1-CE2 3.35Å; D140-Y144 WeakPolarHBondContact OD2-CD2 3.31Å; D140-Y144 WeakPolarHBondContact OD2-CE2 3.5Å; Y144-L146 VanDerWaalsContact C-N 3.33Å; Y144-L146 PolarHBondContact O-N 3.03Å; Y144-T147 PolarHBondContact O-N 2.83Å; Y144-E148 WeakPolarHBondContact O-CB 3.31Å; Y144-E148 PolarHBondContact O-N 3.44Å
145	M	77.2	Confident	74.8	Confident	108 Å²	108	77.4 Å²	77.4	53%	0.532	40%	0.401	S	S	.	.	H	α-helix	trans	-58.5	-44.3	175.2	-75.6	-175.4	-60.5	0	0	111.5	G141 M142 T147 E148 D149	G141-M145 WeakPolarHBondContact O-CB 3.23Å; G141-M145 WeakPolarHBondContact O-CE 3.26Å; G141-M145 WeakPolarHBondContact O-CG 3.33Å; G141-M145 PolarHBondContact O-N 3.46Å; M142-M145 HydrophobicContact CG-CE 4.18Å; M145-T147 VanDerWaalsContact C-N 3.33Å; M145-T147 PolarHBondContact O-N 3.34Å; M145-E148 PolarHBondContact O-N 2.87Å; M145-D149 VanDerWaalsContact O-CB 3.26Å; M145-D149 WeakPolarHBondContact O-CB 3.4Å; M145-D149 PolarHBondContact O-N 3.41Å
146	L	74.8	Confident	75.5	Confident	109 Å²	109	75.2 Å²	75.2	57%	0.571	39%	0.393	S	S	*	.	H	α-helix	trans	-61.9	-40	176.9	-74.8	169.7	0	0	0	112.8	M142 L143 Y144 F150	M142-L146 VanDerWaalsContact O-CG 3.27Å; M142-L146 WeakPolarHBondContact O-CG 3.32Å; M142-L146 PolarHBondContact O-N 2.8Å; L143-L146 PolarHBondContact O-N 3.36Å; Y144-L146 VanDerWaalsContact C-N 3.33Å; Y144-L146 PolarHBondContact O-N 3.03Å; L146-F150 VanDerWaalsContact O-CB 3.28Å; L146-F150 WeakPolarHBondContact O-CB 3.35Å; L146-F150 PolarHBondContact O-N 3.28Å
147	T	73.5	Confident	76	Confident	53 Å²	53	73.4 Å²	73.4	33%	0.325	38%	0.383	S	S	.	.	H	α-helix	trans	-70.8	-38.8	179.5	-54	0	0	0	0	111.3	L143 Y144 M145 N151	L143-T147 PolarHBondContact O-N 3.28Å; L143-T147 PolarHBondContact O-OG1 3.35Å; Y144-T147 PolarHBondContact O-N 2.83Å; M145-T147 VanDerWaalsContact C-N 3.33Å; M145-T147 PolarHBondContact O-N 3.34Å; T147-N151 WeakPolarHBondContact O-CB 3.25Å; T147-N151 PolarHBondContact O-N 3.42Å
148	E	78.9	Confident	76.3	Confident	100 Å²	100	71 Å²	71	47%	0.467	37%	0.37	S	S	.	.	H	α-helix	trans	-68.1	-46	175.5	-154.2	-174	161.8	0	0	111.2	Y144 M145 F150 N151 Y152	Y144-E148 WeakPolarHBondContact O-CB 3.31Å; Y144-E148 PolarHBondContact O-N 3.44Å; M145-E148 PolarHBondContact O-N 2.87Å; E148-F150 VanDerWaalsContact C-N 3.3Å; E148-F150 PolarHBondContact O-N 3.49Å; E148-N151 CarbonylContact O-C 3.54Å; E148-N151 WeakPolarHBondContact O-CA 3.38Å; E148-N151 WeakPolarHBondContact O-CB 3.35Å; E148-N151 PolarHBondContact O-N 3.17Å; E148-N151 VanDerWaalsContact O-N 3.08Å; E148-Y152 HydrophobicContact CG-CD2 3.99Å; E148-Y152 HydrophobicContact CG-CE2 3.52Å; E148-Y152 WeakPolarHBondContact O-CD2 3.26Å; E148-Y152 PolarHBondContact O-N 3.28Å; E148-Y152 WeakPolarHBondContact OE1-CE2 3.29Å; E148-Y152 PolarHBondContact OE1-OH 3.3Å
149	D	79.9	Confident	76.5	Confident	102 Å²	102	75 Å²	75	55%	0.545	37%	0.374	S	S	.	.	H	α-helix	trans	-58	-43.5	175	-75.8	-18.8	0	0	0	111.1	M145 N151 Y152 L153	M145-D149 VanDerWaalsContact O-CB 3.26Å; M145-D149 WeakPolarHBondContact O-CB 3.4Å; M145-D149 PolarHBondContact O-N 3.41Å; D149-N151 VanDerWaalsContact C-N 3.34Å; D149-N151 PolarHBondContact O-N 3.45Å; D149-Y152 PolarHBondContact O-N 3.26Å; D149-L153 WeakPolarHBondContact O-CB 3.44Å; D149-L153 PolarHBondContact O-N 2.92Å
150	F	73.2	Confident	76.9	Confident	73 Å²	73	77.2 Å²	77.2	32%	0.32	38%	0.382	S	S	.	.	H	α-helix	trans	-62.8	-42	175.1	-170.1	-94.6	0	0	0	111.6	E36 F106 L146 E148 L153 C154	E36-F150 WeakPolarHBondContact OE1-CZ 3.4Å; F106-F150 HydrophobicContact CD2-CD1 4.3Å; F106-F150 AromaticContact CD2-CE1 3.45Å; F106-F150 HydrophobicContact CD2-CE1 3.45Å; F106-F150 VanDerWaalsContact CD2-CE1 3.45Å; F106-F150 AromaticContact CD2-CZ 3.92Å; F106-F150 HydrophobicContact CD2-CZ 3.92Å; F106-F150 HydrophobicContact CE2-CD1 4.29Å; F106-F150 AromaticContact CE2-CE1 3.72Å; F106-F150 HydrophobicContact CE2-CE1 3.72Å; L146-F150 VanDerWaalsContact O-CB 3.28Å; L146-F150 WeakPolarHBondContact O-CB 3.35Å; L146-F150 PolarHBondContact O-N 3.28Å; E148-F150 VanDerWaalsContact C-N 3.3Å; E148-F150 PolarHBondContact O-N 3.49Å; F150-L153 PolarHBondContact O-N 3.07Å; F150-C154 WeakPolarHBondContact CE1-SG 3.5Å; F150-C154 WeakPolarHBondContact O-CB 3.47Å; F150-C154 PolarHBondContact O-N 3.1Å; F150-C154 PolarHBondContact O-SG 3.36Å
151	N	78.2	Confident	77.2	Confident	62 Å²	62	75.4 Å²	75.4	33%	0.332	37%	0.373	S	S	.	.	H	α-helix	trans	-64.6	-42.2	176.5	-169.7	33.5	0	0	0	112	K37 T147 E148 D149 C154 N155	K37-N151 WeakPolarHBondContact CE-OD1 3.4Å; K37-N151 PolarHBondContact NZ-OD1 3.06Å; T147-N151 WeakPolarHBondContact O-CB 3.25Å; T147-N151 PolarHBondContact O-N 3.42Å; E148-N151 CarbonylContact O-C 3.54Å; E148-N151 WeakPolarHBondContact O-CA 3.38Å; E148-N151 WeakPolarHBondContact O-CB 3.35Å; E148-N151 PolarHBondContact O-N 3.17Å; E148-N151 VanDerWaalsContact O-N 3.08Å; D149-N151 VanDerWaalsContact C-N 3.34Å; D149-N151 PolarHBondContact O-N 3.45Å; N151-C154 PolarHBondContact O-N 3.16Å; N151-N155 WeakPolarHBondContact O-CB 3.44Å; N151-N155 VanDerWaalsContact O-CG 3.22Å; N151-N155 PolarHBondContact O-N 2.89Å; N151-N155 PolarHBondContact O-ND2 3.04Å; N151-N155 VanDerWaalsContact O-ND2 3.08Å; N151-N155 PolarHBondContact OD1-ND2 3.09Å
152	Y	83.3	Confident	77.3	Confident	141 Å²	141	78.5 Å²	78.5	55%	0.553	38%	0.382	S	S	*	.	H	α-helix	trans	-62.3	-45.8	173.7	-79.4	-64.6	0	0	0	111.8	E148 D149 C154 N155 A156	E148-Y152 HydrophobicContact CG-CD2 3.99Å; E148-Y152 HydrophobicContact CG-CE2 3.52Å; E148-Y152 WeakPolarHBondContact O-CD2 3.26Å; E148-Y152 PolarHBondContact O-N 3.28Å; E148-Y152 WeakPolarHBondContact OE1-CE2 3.29Å; E148-Y152 PolarHBondContact OE1-OH 3.3Å; D149-Y152 PolarHBondContact O-N 3.26Å; Y152-C154 VanDerWaalsContact C-N 3.3Å; Y152-C154 PolarHBondContact O-N 2.98Å; Y152-N155 PolarHBondContact O-N 3.27Å; Y152-A156 WeakPolarHBondContact O-CB 3.34Å; Y152-A156 PolarHBondContact O-N 3.31Å
153	L	77.4	Confident	77.4	Confident	94 Å²	94	76.8 Å²	76.8	49%	0.492	38%	0.375	S	S	.	.	H	α-helix	trans	-59.4	-43.7	178.1	-175.3	65	0	0	0	111	L33 D149 F150 S157	L33-L153 HydrophobicContact CD1-CG 4.35Å; D149-L153 WeakPolarHBondContact O-CB 3.44Å; D149-L153 PolarHBondContact O-N 2.92Å; F150-L153 PolarHBondContact O-N 3.07Å; L153-S157 VanDerWaalsContact O-CB 3.3Å; L153-S157 WeakPolarHBondContact O-CB 3.37Å; L153-S157 PolarHBondContact O-N 2.95Å; L153-S157 PolarHBondContact O-OG 3.18Å
154	C	77.2	Confident	77.4	Confident	0 Å²	0	76 Å²	76	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-66.1	-39.3	176.6	-70.9	0	0	0	0	113.2	K37 F150 N151 Y152 S157 L158	K37-C154 HydrophobicContact CB-CB 4.1Å; K37-C154 HydrophobicContact CD-CB 3.83Å; K37-C154 HydrophobicContact CG-CB 3.96Å; F150-C154 WeakPolarHBondContact CE1-SG 3.5Å; F150-C154 WeakPolarHBondContact O-CB 3.47Å; F150-C154 PolarHBondContact O-N 3.1Å; F150-C154 PolarHBondContact O-SG 3.36Å; N151-C154 PolarHBondContact O-N 3.16Å; Y152-C154 VanDerWaalsContact C-N 3.3Å; Y152-C154 PolarHBondContact O-N 2.98Å; C154-S157 VanDerWaalsContact CA-OG 3.28Å; C154-S157 WeakPolarHBondContact CA-OG 3.39Å; C154-S157 PolarHBondContact O-N 3.14Å; C154-S157 PolarHBondContact O-OG 3.11Å; C154-L158 WeakPolarHBondContact O-CB 3.4Å; C154-L158 WeakPolarHBondContact O-CG 3.17Å; C154-L158 PolarHBondContact O-N 2.84Å
155	N	81.6	Confident	77.3	Confident	72 Å²	72	72.3 Å²	72.3	39%	0.385	37%	0.365	S	S	.	.	H	α-helix	trans	-70.7	-40	178.2	-71.9	-31.7	0	0	0	111.7	N151 Y152 L158 W159	N151-N155 WeakPolarHBondContact O-CB 3.44Å; N151-N155 VanDerWaalsContact O-CG 3.22Å; N151-N155 PolarHBondContact O-N 2.89Å; N151-N155 PolarHBondContact O-ND2 3.04Å; N151-N155 VanDerWaalsContact O-ND2 3.08Å; N151-N155 PolarHBondContact OD1-ND2 3.09Å; Y152-N155 PolarHBondContact O-N 3.27Å; N155-L158 PolarHBondContact O-N 3.41Å; N155-W159 PolarHBondContact O-N 3.4Å; N155-W159 VanDerWaalsContact O-N 3.09Å
156	A	81.2	Confident	77.2	Confident	48 Å²	48	72.4 Å²	72.4	40%	0.397	36%	0.364	S	S	.	.	H	α-helix	trans	-63.3	-43.7	173.6	0	0	0	0	0	111.2	Y152 W159 Q160	Y152-A156 WeakPolarHBondContact O-CB 3.34Å; Y152-A156 PolarHBondContact O-N 3.31Å; A156-W159 PolarHBondContact O-N 3.36Å; A156-Q160 WeakPolarHBondContact O-CB 3.47Å; A156-Q160 WeakPolarHBondContact O-CG 3.48Å; A156-Q160 PolarHBondContact O-N 3.1Å
157	S	76.1	Confident	77.1	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.007	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-38.1	177.6	67.4	0	0	0	0	112.2	L33 L153 C154 W159 Q160 A161	L33-S157 VanDerWaalsContact CB-OG 3.27Å; L33-S157 WeakPolarHBondContact CB-OG 3.26Å; L153-S157 VanDerWaalsContact O-CB 3.3Å; L153-S157 WeakPolarHBondContact O-CB 3.37Å; L153-S157 PolarHBondContact O-N 2.95Å; L153-S157 PolarHBondContact O-OG 3.18Å; C154-S157 VanDerWaalsContact CA-OG 3.28Å; C154-S157 WeakPolarHBondContact CA-OG 3.39Å; C154-S157 PolarHBondContact O-N 3.14Å; C154-S157 PolarHBondContact O-OG 3.11Å; S157-W159 VanDerWaalsContact C-N 3.33Å; S157-W159 PolarHBondContact O-N 3.01Å; S157-Q160 PolarHBondContact O-N 3.46Å; S157-A161 WeakPolarHBondContact O-CB 3.1Å; S157-A161 PolarHBondContact O-N 3.23Å
158	L	75.4	Confident	76.8	Confident	51 Å²	51	71.5 Å²	71.5	27%	0.267	36%	0.359	S	S	.	.	H	α-helix	trans	-57	-46.4	170.6	-84.5	165.4	0	0	0	111.5	A34 K37 C154 N155 A161 I162	A34-L158 HydrophobicContact CB-CD2 3.49Å; A34-L158 VanDerWaalsContact CB-CD2 3.49Å; A34-L158 HydrophobicContact CB-CG 4.09Å; K37-L158 HydrophobicContact CB-CD1 4.35Å; K37-L158 HydrophobicContact CG-CD1 3.78Å; C154-L158 WeakPolarHBondContact O-CB 3.4Å; C154-L158 WeakPolarHBondContact O-CG 3.17Å; C154-L158 PolarHBondContact O-N 2.84Å; N155-L158 PolarHBondContact O-N 3.41Å; L158-A161 PolarHBondContact O-N 3.14Å; L158-I162 VanDerWaalsContact O-CG1 3.29Å; L158-I162 WeakPolarHBondContact O-CG1 3.15Å; L158-I162 PolarHBondContact O-N 3.05Å
159	W	75.8	Confident	76.3	Confident	180 Å²	180	73.9 Å²	73.9	68%	0.682	37%	0.365	S	S	*	.	H	α-helix	trans	-65.4	-41.6	179.2	-139.6	83.5	0	0	0	111.8	N155 A156 S157 I162 N163	N155-W159 PolarHBondContact O-N 3.4Å; N155-W159 VanDerWaalsContact O-N 3.09Å; A156-W159 PolarHBondContact O-N 3.36Å; S157-W159 VanDerWaalsContact C-N 3.33Å; S157-W159 PolarHBondContact O-N 3.01Å; W159-I162 PolarHBondContact O-N 3.39Å; W159-N163 WeakPolarHBondContact CZ3-ND2 3.36Å; W159-N163 PolarHBondContact O-N 3.17Å; W159-N163 PolarHBondContact O-ND2 2.74Å; W159-N163 VanDerWaalsContact O-ND2 3.17Å
160	Q	78.9	Confident	75.9	Confident	87 Å²	87	71.4 Å²	71.4	41%	0.407	36%	0.356	S	S	.	.	H	α-helix	trans	-66.9	-38.3	175.5	-73	171.6	-15.3	0	0	112.3	F30 A156 S157 N163 A164	F30-Q160 HydrophobicContact CB-CB 4.44Å; F30-Q160 HydrophobicContact CD1-CB 4.3Å; F30-Q160 HydrophobicContact CD2-CB 4.09Å; F30-Q160 HydrophobicContact CE2-CB 4.45Å; F30-Q160 HydrophobicContact CG-CB 4.01Å; A156-Q160 WeakPolarHBondContact O-CB 3.47Å; A156-Q160 WeakPolarHBondContact O-CG 3.48Å; A156-Q160 PolarHBondContact O-N 3.1Å; S157-Q160 PolarHBondContact O-N 3.46Å; Q160-N163 PolarHBondContact O-N 3.37Å; Q160-A164 WeakPolarHBondContact O-CB 3.47Å; Q160-A164 PolarHBondContact O-N 3.34Å
161	A	78.3	Confident	75.6	Confident	5 Å²	5	70.9 Å²	70.9	4%	0.041	36%	0.356	C	S	.	.	H	α-helix	trans	-63.2	-43.8	174.7	0	0	0	0	0	111.4	F30 Y31 A34 S157 L158 A164 S165	F30-A161 HydrophobicContact CB-CB 4.16Å; Y31-A161 HydrophobicContact CD1-CB 3.62Å; Y31-A161 HydrophobicContact CE1-CB 3.85Å; Y31-A161 VanDerWaalsContact CE1-O 3.26Å; Y31-A161 WeakPolarHBondContact CE1-O 3.41Å; A34-A161 HydrophobicContact CB-CB 3.95Å; S157-A161 WeakPolarHBondContact O-CB 3.1Å; S157-A161 PolarHBondContact O-N 3.23Å; L158-A161 PolarHBondContact O-N 3.14Å; A161-A164 PolarHBondContact O-N 3.15Å; A161-S165 WeakPolarHBondContact O-CB 3.45Å; A161-S165 PolarHBondContact O-N 3.46Å
162	I	78.1	Confident	75	Confident	96 Å²	96	72.5 Å²	72.5	49%	0.492	36%	0.364	S	S	.	.	H	α-helix	trans	-60.2	-50	174.9	-68.8	164.7	0	0	0	110.1	L158 W159 A164 S165 E166	L158-I162 VanDerWaalsContact O-CG1 3.29Å; L158-I162 WeakPolarHBondContact O-CG1 3.15Å; L158-I162 PolarHBondContact O-N 3.05Å; W159-I162 PolarHBondContact O-N 3.39Å; I162-A164 VanDerWaalsContact C-N 3.34Å; I162-A164 PolarHBondContact O-N 3.01Å; I162-S165 PolarHBondContact O-N 3.23Å; I162-S165 VanDerWaalsContact O-N 3.11Å; I162-S165 PolarHBondContact O-OG 2.9Å; I162-E166 PolarHBondContact O-N 3.45Å
163	N	78.3	Confident	74.4	Confident	74 Å²	74	72.9 Å²	72.9	40%	0.396	36%	0.364	S	S	.	.	H	α-helix	trans	-63.1	-39.9	178	-67.7	-33.1	0	0	0	113.1	W159 Q160 S165 E166 L167	W159-N163 WeakPolarHBondContact CZ3-ND2 3.36Å; W159-N163 PolarHBondContact O-N 3.17Å; W159-N163 PolarHBondContact O-ND2 2.74Å; W159-N163 VanDerWaalsContact O-ND2 3.17Å; Q160-N163 PolarHBondContact O-N 3.37Å; N163-S165 VanDerWaalsContact C-N 3.25Å; N163-S165 PolarHBondContact O-N 3.4Å; N163-E166 PolarHBondContact O-N 2.83Å; N163-L167 PolarHBondContact O-N 2.99Å
164	A	74.5	Confident	74	Confident	17 Å²	17	72.6 Å²	72.6	14%	0.14	36%	0.363	C	S	.	.	H	α-helix	trans	-62.4	-37.1	175.5	0	0	0	0	0	110.7	Q160 A161 I162 L167 T168	Q160-A164 WeakPolarHBondContact O-CB 3.47Å; Q160-A164 PolarHBondContact O-N 3.34Å; A161-A164 PolarHBondContact O-N 3.15Å; I162-A164 VanDerWaalsContact C-N 3.34Å; I162-A164 PolarHBondContact O-N 3.01Å; A164-L167 PolarHBondContact O-N 3.21Å; A164-T168 WeakPolarHBondContact O-CB 3.11Å; A164-T168 PolarHBondContact O-N 2.85Å; A164-T168 PolarHBondContact O-OG1 3.35Å
165	S	72.4	Confident	73.4	Confident	45 Å²	45	74.6 Å²	74.6	32%	0.315	38%	0.38	S	S	.	.	H	α-helix	trans	-67.7	-40.4	178	76.4	0	0	0	0	112.2	Y31 A161 I162 N163 T168 Y169	Y31-S165 WeakPolarHBondContact OH-CA 3.43Å; Y31-S165 VanDerWaalsContact OH-CB 3.29Å; Y31-S165 WeakPolarHBondContact OH-CB 3.41Å; Y31-S165 PolarHBondContact OH-N 3.22Å; A161-S165 WeakPolarHBondContact O-CB 3.45Å; A161-S165 PolarHBondContact O-N 3.46Å; I162-S165 PolarHBondContact O-N 3.23Å; I162-S165 VanDerWaalsContact O-N 3.11Å; I162-S165 PolarHBondContact O-OG 2.9Å; N163-S165 VanDerWaalsContact C-N 3.25Å; N163-S165 PolarHBondContact O-N 3.4Å; S165-T168 PolarHBondContact O-N 3.23Å; S165-Y169 VanDerWaalsContact O-CB 3.28Å; S165-Y169 WeakPolarHBondContact O-CB 3.44Å; S165-Y169 PolarHBondContact O-N 2.96Å
166	E	75.5	Confident	72.3	Confident	111 Å²	111	75.6 Å²	75.6	52%	0.519	38%	0.382	S	S	.	.	H	α-helix	trans	-64.4	-41.2	174.5	-70.7	-61.1	153.7	0	0	112	I162 N163 S170	I162-E166 PolarHBondContact O-N 3.45Å; N163-E166 PolarHBondContact O-N 2.83Å; E166-S170 VanDerWaalsContact O-CB 3.32Å; E166-S170 WeakPolarHBondContact O-CB 3.23Å; E166-S170 PolarHBondContact O-N 3.04Å; E166-S170 PolarHBondContact O-OG 3.41Å
167	L	71.5	Confident	71	Confident	107 Å²	107	77 Å²	77	56%	0.56	38%	0.382	S	S	*	.	H	α-helix	trans	-63.5	-50	173.8	-177.1	63.4	0	0	0	110.3	N163 A164 Y169 S170 L171	N163-L167 PolarHBondContact O-N 2.99Å; A164-L167 PolarHBondContact O-N 3.21Å; L167-Y169 VanDerWaalsContact C-N 3.31Å; L167-Y169 PolarHBondContact O-N 2.87Å; L167-S170 WeakPolarHBondContact O-CB 3.42Å; L167-S170 PolarHBondContact O-N 3.23Å; L167-S170 VanDerWaalsContact O-N 3.12Å; L167-L171 HydrophobicContact CD1-CD2 4.49Å; L167-L171 HydrophobicContact CD1-CG 4.32Å; L167-L171 HydrophobicContact CG-CD1 4.34Å; L167-L171 HydrophobicContact CG-CG 4.37Å; L167-L171 VanDerWaalsContact O-CG 3.28Å; L167-L171 WeakPolarHBondContact O-CG 3.45Å; L167-L171 PolarHBondContact O-N 3.36Å
168	T	68.2	Low	70	Confident	36 Å²	36	78.6 Å²	78.6	22%	0.221	40%	0.399	C	S	.	.	H	α-helix	trans	-59.5	-42.9	-179.8	-49.3	0	0	0	0	111.1	A164 S165 L171 L172	A164-T168 WeakPolarHBondContact O-CB 3.11Å; A164-T168 PolarHBondContact O-N 2.85Å; A164-T168 PolarHBondContact O-OG1 3.35Å; S165-T168 PolarHBondContact O-N 3.23Å; T168-L171 PolarHBondContact O-N 3.02Å; T168-L172 HydrophobicContact CG2-CD1 4.2Å; T168-L172 WeakPolarHBondContact O-CB 3.49Å; T168-L172 WeakPolarHBondContact O-CG 3.34Å; T168-L172 PolarHBondContact O-N 3.44Å
169	Y	68	Low	68.8	Low	149 Å²	149	81.8 Å²	81.8	58%	0.584	41%	0.407	S	S	*	.	H	α-helix	trans	-61.9	-45.5	174.6	176.6	-104.3	0	0	0	111.9	S165 L167 L171 L172 R173	S165-Y169 VanDerWaalsContact O-CB 3.28Å; S165-Y169 WeakPolarHBondContact O-CB 3.44Å; S165-Y169 PolarHBondContact O-N 2.96Å; L167-Y169 VanDerWaalsContact C-N 3.31Å; L167-Y169 PolarHBondContact O-N 2.87Å; Y169-L171 VanDerWaalsContact C-N 3.33Å; Y169-L171 PolarHBondContact O-N 2.77Å; Y169-L172 PolarHBondContact O-N 3.41Å; Y169-R173 VanDerWaalsContact O-CB 3.28Å; Y169-R173 WeakPolarHBondContact O-CB 3.44Å; Y169-R173 PolarHBondContact O-N 3.2Å
170	S	71.3	Confident	67	Low	51 Å²	51	80.3 Å²	80.3	36%	0.357	40%	0.403	S	S	.	.	H	α-helix	trans	-62.2	-40.6	176.9	-64	0	0	0	0	112	E166 L167 R173 N174	E166-S170 VanDerWaalsContact O-CB 3.32Å; E166-S170 WeakPolarHBondContact O-CB 3.23Å; E166-S170 PolarHBondContact O-N 3.04Å; E166-S170 PolarHBondContact O-OG 3.41Å; L167-S170 WeakPolarHBondContact O-CB 3.42Å; L167-S170 PolarHBondContact O-N 3.23Å; L167-S170 VanDerWaalsContact O-N 3.12Å; S170-R173 PolarHBondContact O-N 3.39Å; S170-N174 WeakPolarHBondContact O-CB 3.15Å; S170-N174 PolarHBondContact O-N 3.2Å; S170-N174 PolarHBondContact O-ND2 2.82Å
171	L	67.4	Low	65.2	Low	62 Å²	62	80.5 Å²	80.5	33%	0.325	41%	0.412	S	S	.	.	H	α-helix	trans	-67	-44.2	176.2	-66.3	-169.4	0	0	0	112.1	L167 T168 Y169 N174 A175	L167-L171 HydrophobicContact CD1-CD2 4.49Å; L167-L171 HydrophobicContact CD1-CG 4.32Å; L167-L171 HydrophobicContact CG-CD1 4.34Å; L167-L171 HydrophobicContact CG-CG 4.37Å; L167-L171 VanDerWaalsContact O-CG 3.28Å; L167-L171 WeakPolarHBondContact O-CG 3.45Å; L167-L171 PolarHBondContact O-N 3.36Å; T168-L171 PolarHBondContact O-N 3.02Å; Y169-L171 VanDerWaalsContact C-N 3.33Å; Y169-L171 PolarHBondContact O-N 2.77Å; L171-N174 PolarHBondContact O-N 3.07Å; L171-A175 WeakPolarHBondContact O-CB 3.48Å; L171-A175 PolarHBondContact O-N 2.89Å
172	L	65.4	Low	63.6	Low	96 Å²	96	84.9 Å²	84.9	50%	0.503	44%	0.443	S	S	.	.	H	α-helix	trans	-62.4	-42.8	174.9	-77.9	168.5	0	0	0	111.6	T168 Y169 A175 H176	T168-L172 HydrophobicContact CG2-CD1 4.2Å; T168-L172 WeakPolarHBondContact O-CB 3.49Å; T168-L172 WeakPolarHBondContact O-CG 3.34Å; T168-L172 PolarHBondContact O-N 3.44Å; Y169-L172 PolarHBondContact O-N 3.41Å; L172-A175 PolarHBondContact O-N 3.11Å; L172-H176 WeakPolarHBondContact O-CB 3.45Å; L172-H176 PolarHBondContact O-N 3.41Å
173	R	70.5	Confident	61.9	Low	148 Å²	148	88.2 Å²	88.2	56%	0.558	46%	0.456	S	S	*	.	H	α-helix	trans	-61.7	-45.7	175.2	-178.8	178.5	174.4	-122.9	-1.5	111.1	Y169 S170 H176 L177	Y169-R173 VanDerWaalsContact O-CB 3.28Å; Y169-R173 WeakPolarHBondContact O-CB 3.44Å; Y169-R173 PolarHBondContact O-N 3.2Å; S170-R173 PolarHBondContact O-N 3.39Å; R173-H176 PolarHBondContact O-N 3.3Å; R173-L177 HydrophobicContact CG-CD1 4Å; R173-L177 HydrophobicContact CG-CG 4.47Å; R173-L177 WeakPolarHBondContact O-CB 3.43Å; R173-L177 VanDerWaalsContact O-CG 3.29Å; R173-L177 WeakPolarHBondContact O-CG 3.26Å; R173-L177 PolarHBondContact O-N 3.44Å
174	N	68.5	Low	60.1	Low	89 Å²	89	93 Å²	93	48%	0.476	48%	0.476	S	S	.	.	H	α-helix	trans	-65.8	-38	176.9	-73.5	-24.4	0	0	0	112.1	S170 L171 L177 G178	S170-N174 WeakPolarHBondContact O-CB 3.15Å; S170-N174 PolarHBondContact O-N 3.2Å; S170-N174 PolarHBondContact O-ND2 2.82Å; L171-N174 PolarHBondContact O-N 3.07Å; N174-L177 PolarHBondContact O-N 3.38Å; N174-G178 PolarHBondContact O-N 3.29Å
175	A	65	Low	58.6	Low	41 Å²	41	97.7 Å²	97.7	34%	0.339	50%	0.503	S	S	.	.	H	α-helix	trans	-65	-41.1	173.6	0	0	0	0	0	111.7	L171 L172 G178 R179	L171-A175 WeakPolarHBondContact O-CB 3.48Å; L171-A175 PolarHBondContact O-N 2.89Å; L172-A175 PolarHBondContact O-N 3.11Å; A175-G178 PolarHBondContact O-N 3.45Å; A175-R179 PolarHBondContact O-N 3.43Å; A175-R179 VanDerWaalsContact O-N 3.17Å
176	H	57.4	Low	56.8	Low	93 Å²	93	100.6 Å²	100.6	43%	0.431	52%	0.523	S	S	.	.	H	α-helix	trans	-69.6	-37.3	176.7	-158.7	-62	0	0	0	112.3	L172 R173 R179 Y180	L172-H176 WeakPolarHBondContact O-CB 3.45Å; L172-H176 PolarHBondContact O-N 3.41Å; R173-H176 PolarHBondContact O-N 3.3Å; H176-R179 WeakPolarHBondContact O-CB 3.4Å; H176-R179 PolarHBondContact O-N 3.34Å; H176-Y180 AromaticContact CE1-CE2 3.38Å; H176-Y180 WeakPolarHBondContact CE1-CE2 3.22Å; H176-Y180 AromaticContact CE1-CZ 3.83Å; H176-Y180 AromaticContact ND1-CD2 3.86Å; H176-Y180 AromaticContact ND1-CE2 3.25Å; H176-Y180 WeakPolarHBondContact ND1-CE2 3.33Å; H176-Y180 VanDerWaalsContact O-CD2 3.26Å; H176-Y180 WeakPolarHBondContact O-CD2 3.46Å
177	L	55	Low	55.4	Low	79 Å²	79	100.9 Å²	100.9	41%	0.414	54%	0.535	S	S	.	.	H	α-helix	trans	-69.6	-38.3	173	-72.1	172	0	0	0	111.9	R173 N174 R179 Y180 C181	R173-L177 HydrophobicContact CG-CD1 4Å; R173-L177 HydrophobicContact CG-CG 4.47Å; R173-L177 WeakPolarHBondContact O-CB 3.43Å; R173-L177 VanDerWaalsContact O-CG 3.29Å; R173-L177 WeakPolarHBondContact O-CG 3.26Å; R173-L177 PolarHBondContact O-N 3.44Å; N174-L177 PolarHBondContact O-N 3.38Å; L177-R179 PolarHBondContact O-N 3.49Å; L177-Y180 PolarHBondContact O-N 3.1Å; L177-C181 PolarHBondContact O-N 3.47Å
178	G	55.6	Low	54.2	Low	34 Å²	34	102.2 Å²	102.2	35%	0.351	55%	0.547	S	S	.	.	H	α-helix	trans	-59.6	-31.5	173.6	0	0	0	0	0	113	N174 A175 S182	N174-G178 PolarHBondContact O-N 3.29Å; A175-G178 PolarHBondContact O-N 3.45Å; G178-S182 WeakPolarHBondContact O-CB 3.4Å; G178-S182 PolarHBondContact O-N 3.04Å; G178-S182 VanDerWaalsContact O-N 3.1Å; G178-S182 PolarHBondContact O-OG 3.12Å
179	R	50.2	Low	53.1	Low	118 Å²	118	105 Å²	105	45%	0.445	57%	0.568	S	S	.	*	H	α-helix	trans	-64.8	-37.7	170.8	-80.5	-170	-100	-139.9	4.1	113.2	E3 A175 H176 L177	E3-R179 WeakPolarHBondContact OE1-CD 3.48Å; E3-R179 WeakPolarHBondContact OE1-CG 3.48Å; E3-R179 IonicContact OE1-CZ 3.85Å; E3-R179 IonicContact OE1-NE 2.89Å; E3-R179 PolarHBondContact OE1-NE 2.85Å; E3-R179 IonicContact OE1-NH1 2.84Å; E3-R179 PolarHBondContact OE1-NH1 2.87Å; E3-R179 IonicContact OE2-CZ 3.35Å; E3-R179 IonicContact OE2-NH1 3.21Å; E3-R179 PolarHBondContact OE2-NH1 3.22Å; A175-R179 PolarHBondContact O-N 3.43Å; A175-R179 VanDerWaalsContact O-N 3.17Å; H176-R179 WeakPolarHBondContact O-CB 3.4Å; H176-R179 PolarHBondContact O-N 3.34Å; L177-R179 PolarHBondContact O-N 3.49Å
180	Y	38.3	Very low	51.9	Low	149 Å²	149	103.5 Å²	103.5	58%	0.584	58%	0.579	S	S	*	*	H	α-helix	trans	-72.3	-44.1	176.3	-72.7	-70.2	0	0	0	112.4	H176 L177 S182 H183	H176-Y180 AromaticContact CE1-CE2 3.38Å; H176-Y180 WeakPolarHBondContact CE1-CE2 3.22Å; H176-Y180 AromaticContact CE1-CZ 3.83Å; H176-Y180 AromaticContact ND1-CD2 3.86Å; H176-Y180 AromaticContact ND1-CE2 3.25Å; H176-Y180 WeakPolarHBondContact ND1-CE2 3.33Å; H176-Y180 VanDerWaalsContact O-CD2 3.26Å; H176-Y180 WeakPolarHBondContact O-CD2 3.46Å; L177-Y180 PolarHBondContact O-N 3.1Å; Y180-S182 PolarHBondContact O-N 3.44Å; Y180-H183 PolarHBondContact O-N 2.9Å
181	C	40.4	Very low	50.2	Low	90 Å²	90	106.8 Å²	106.8	61%	0.608	60%	0.597	S	S	*	*	H	α-helix	trans	-63.1	-27.7	176.7	-65	0	0	0	0	112.5	L177 H183	L177-C181 PolarHBondContact O-N 3.47Å; C181-H183 VanDerWaalsContact C-N 3.26Å; C181-H183 PolarHBondContact O-N 3.46Å
182	S	44.2	Very low	49.2	Very low	98 Å²	98	115.6 Å²	115.6	69%	0.685	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-16.7	175.4	-57.1	0	0	0	0	113.4	G178 Y180	G178-S182 WeakPolarHBondContact O-CB 3.4Å; G178-S182 PolarHBondContact O-N 3.04Å; G178-S182 VanDerWaalsContact O-N 3.1Å; G178-S182 PolarHBondContact O-OG 3.12Å; Y180-S182 PolarHBondContact O-N 3.44Å
183	H	42.4	Very low	48.4	Very low	166 Å²	166	116.6 Å²	116.6	77%	0.769	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-11.2	179.5	-104.3	-75.6	0	0	0	114.3	Y180 C181	Y180-H183 PolarHBondContact O-N 2.9Å; C181-H183 VanDerWaalsContact C-N 3.26Å; C181-H183 PolarHBondContact O-N 3.46Å
184	E	40.8	Very low	47.2	Very low	173 Å²	173	114.9 Å²	114.9	81%	0.808	66%	0.655	S	S	*	*	S	Bend	trans	-97.2	3.5	179.8	-82	-173.4	153.5	0	0	115	S186	E184-S186 PolarHBondContact O-N 3.23Å
185	V	43.3	Very low	46	Very low	116 Å²	116	116.3 Å²	116.3	70%	0.703	67%	0.665	S	S	*	*			trans	-100.1	67.6	171.9	-170.8	0	0	0	0	110.1	P187	V185-P187 WeakPolarHBondContact O-CD 3.46Å
186	S	34.8	Very low	44.9	Very low	107 Å²	107	120.8 Å²	120.8	75%	0.748	68%	0.684	S	S	*	*			trans	-99.6	100.4	150.6	-81.4	0	0	0	0	107.3	E184 V188	E184-S186 PolarHBondContact O-N 3.23Å; S186-V188 PolarHBondContact O-N 2.87Å; S186-V188 VanDerWaalsContact O-N 3.12Å
187	P	44.3	Very low	44.1	Very low	117 Å²	117	122.5 Å²	122.5	76%	0.76	70%	0.7	S	S	*	*			trans	-62.4	119.8	175.2	24.2	-30.2	0	0	0	108.8	V185 S189	V185-P187 WeakPolarHBondContact O-CD 3.46Å; P187-S189 PolarHBondContact O-N 2.87Å
188	V	46.7	Very low	43.4	Very low	135 Å²	135	125.4 Å²	125.4	82%	0.818	72%	0.719	S	S	*	*			trans	-44.8	123	167.4	172.5	0	0	0	0	108.3	S186 S190	S186-V188 PolarHBondContact O-N 2.87Å; S186-V188 VanDerWaalsContact O-N 3.12Å; V188-S190 VanDerWaalsContact C-N 3.35Å; V188-S190 PolarHBondContact O-N 3.18Å
189	S	44.9	Very low	42.5	Very low	94 Å²	94	131.9 Å²	131.9	66%	0.657	75%	0.745	S	S	*	*			trans	-60	95.7	172.2	60	0	0	0	0	109	P187 T191	P187-S189 PolarHBondContact O-N 2.87Å; S189-T191 PolarHBondContact O-N 3.32Å; S189-T191 PolarHBondContact O-OG1 3.43Å
190	S	42.9	Very low	41.9	Very low	117 Å²	117	133 Å²	133	82%	0.818	77%	0.768	S	S	*	*			trans	-69.7	86.5	162.1	53.6	0	0	0	0	107.3	V188	V188-S190 VanDerWaalsContact C-N 3.35Å; V188-S190 PolarHBondContact O-N 3.18Å
191	T	36.9	Very low	42.2	Very low	120 Å²	120	131.7 Å²	131.7	74%	0.736	78%	0.784	S	S	*	*			trans	-83.5	112.2	160.5	21.3	0	0	0	0	106.2	S189	S189-T191 PolarHBondContact O-N 3.32Å; S189-T191 PolarHBondContact O-OG1 3.43Å
192	L	45.2	Very low	42.4	Very low	247 Å²	247	135.5 Å²	135.5	100%	1.293	80%	0.8	S	S	*	*			trans	-176.2	0	146.1	-94.5	173.6	0	0	0	106.9

Retrieved 192 of 192 residues in 1285.9 ms (Link to these results)

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