A0A077ZA44_TRITR Loading...

NuA4 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZA44, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 203 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	45.7	Very low	60.9	Low	245 Å²	245	122.5 Å²	122.5	100%	1.207	67%	0.668	S	S	*	*				0	134.7	0	-72.3	173.9	169.2	0	0	106.4
2	S	51	Low	62	Low	126 Å²	126	120.2 Å²	120.2	88%	0.881	66%	0.66	S	S	*	*			trans	-94.3	143.9	-177	-51.4	0	0	0	0	110.3
3	D	51.3	Low	63.2	Low	133 Å²	133	120.5 Å²	120.5	71%	0.711	66%	0.66	S	S	*	*			trans	-59.8	136.5	-176	-108	-80.8	0	0	0	113.2	S5	D3-S5 WeakPolarHBondContact CB-OG 3.45Å; D3-S5 PolarHBondContact OD1-OG 2.99Å
4	S	56.3	Low	64.5	Low	105 Å²	105	123.7 Å²	123.7	73%	0.734	66%	0.657	S	S	*	*	S	Bend	trans	-100.7	16.3	171.7	75	0	0	0	0	112.5
5	S	58.5	Low	65.5	Low	56 Å²	56	124.9 Å²	124.9	39%	0.392	66%	0.655	S	S	.	*	H	α-helix	trans	-86.1	-38.7	-176.5	47	0	0	0	0	112.5	D3 D7 S8 D9	D3-S5 WeakPolarHBondContact CB-OG 3.45Å; D3-S5 PolarHBondContact OD1-OG 2.99Å; S5-D7 VanDerWaalsContact C-N 3.31Å; S5-D7 PolarHBondContact O-N 3.06Å; S5-S8 PolarHBondContact O-N 3.45Å; S5-S8 PolarHBondContact O-OG 3.49Å; S5-D9 PolarHBondContact O-N 3.15Å
6	D	58.9	Low	66.2	Low	120 Å²	120	120.4 Å²	120.4	64%	0.642	64%	0.641	S	S	*	*	H	α-helix	trans	-57.8	-35.7	177.9	-88.1	-19.1	0	0	0	114	R10	D6-R10 WeakPolarHBondContact O-CB 3.32Å; D6-R10 WeakPolarHBondContact O-CG 3.14Å; D6-R10 PolarHBondContact O-N 3.06Å; D6-R10 VanDerWaalsContact O-N 3.08Å
7	D	60.8	Low	67.1	Low	106 Å²	106	120.4 Å²	120.4	57%	0.567	63%	0.634	S	S	*	*	H	α-helix	trans	-71.2	-37.1	-178.9	-92.9	-25.5	0	0	0	112	S5 D9 R10 E11	S5-D7 VanDerWaalsContact C-N 3.31Å; S5-D7 PolarHBondContact O-N 3.06Å; D7-D9 PolarHBondContact O-N 3.4Å; D7-R10 PolarHBondContact O-N 3.03Å; D7-E11 WeakPolarHBondContact O-CG 3.33Å; D7-E11 PolarHBondContact O-N 3.04Å
8	S	64.7	Low	67.9	Low	64 Å²	64	121.8 Å²	121.8	45%	0.448	63%	0.634	S	S	.	*	H	α-helix	trans	-61.9	-44.2	175.3	27	0	0	0	0	112.5	S5 R10 E11 V12	S5-S8 PolarHBondContact O-N 3.45Å; S5-S8 PolarHBondContact O-OG 3.49Å; S8-R10 VanDerWaalsContact C-N 3.35Å; S8-E11 PolarHBondContact O-N 2.77Å; S8-V12 WeakPolarHBondContact O-CG2 3.39Å; S8-V12 PolarHBondContact O-N 2.82Å
9	D	72.7	Confident	68.5	Low	106 Å²	106	119.3 Å²	119.3	57%	0.567	62%	0.624	S	S	*	*	H	α-helix	trans	-69.4	-34.7	178.4	-83.1	6.6	0	0	0	111.5	S5 D7 V12 L13	S5-D9 PolarHBondContact O-N 3.15Å; D7-D9 PolarHBondContact O-N 3.4Å; D9-V12 PolarHBondContact O-N 3.37Å; D9-L13 WeakPolarHBondContact O-CB 3.26Å; D9-L13 VanDerWaalsContact O-CG 3.27Å; D9-L13 WeakPolarHBondContact O-CG 3.24Å; D9-L13 PolarHBondContact O-N 3.16Å
10	R	72	Confident	68.9	Low	151 Å²	151	119.9 Å²	119.9	57%	0.57	62%	0.624	S	S	*	*	H	α-helix	trans	-62.4	-39.8	170	-80.6	175.8	161.2	-170.5	-1.6	113	D6 D7 S8 R14	D6-R10 WeakPolarHBondContact O-CB 3.32Å; D6-R10 WeakPolarHBondContact O-CG 3.14Å; D6-R10 PolarHBondContact O-N 3.06Å; D6-R10 VanDerWaalsContact O-N 3.08Å; D7-R10 PolarHBondContact O-N 3.03Å; S8-R10 VanDerWaalsContact C-N 3.35Å; R10-R14 WeakPolarHBondContact O-CB 3.25Å; R10-R14 WeakPolarHBondContact O-CD 3.48Å; R10-R14 WeakPolarHBondContact O-CG 3.34Å; R10-R14 PolarHBondContact O-N 3.18Å
11	E	77.5	Confident	69.4	Low	136 Å²	136	117.5 Å²	117.5	64%	0.636	61%	0.609	S	S	*	*	H	α-helix	trans	-67.6	-42.7	175	-71.4	-152.5	138.8	0	0	112.1	D7 S8 L13 R14 F15	D7-E11 WeakPolarHBondContact O-CG 3.33Å; D7-E11 PolarHBondContact O-N 3.04Å; S8-E11 PolarHBondContact O-N 2.77Å; E11-L13 PolarHBondContact O-N 3.47Å; E11-R14 PolarHBondContact O-N 3.03Å; E11-F15 WeakPolarHBondContact O-CB 3.27Å; E11-F15 PolarHBondContact O-N 3.48Å
12	V	75	Confident	71	Confident	94 Å²	94	108.5 Å²	108.5	57%	0.57	57%	0.574	S	S	*	*	H	α-helix	trans	-60.6	-44.6	175.4	171.4	0	0	0	0	111.3	S8 D9 F15 A16	S8-V12 WeakPolarHBondContact O-CG2 3.39Å; S8-V12 PolarHBondContact O-N 2.82Å; D9-V12 PolarHBondContact O-N 3.37Å; V12-F15 PolarHBondContact O-N 2.91Å; V12-A16 WeakPolarHBondContact O-CB 3.45Å; V12-A16 PolarHBondContact O-N 2.65Å
13	L	76.8	Confident	71.9	Confident	125 Å²	125	105.3 Å²	105.3	65%	0.654	56%	0.555	S	S	*	*	H	α-helix	trans	-65	-41.6	176.3	-72.5	165.9	0	0	0	112.2	D9 E11 F15 A16 K17	D9-L13 WeakPolarHBondContact O-CB 3.26Å; D9-L13 VanDerWaalsContact O-CG 3.27Å; D9-L13 WeakPolarHBondContact O-CG 3.24Å; D9-L13 PolarHBondContact O-N 3.16Å; E11-L13 PolarHBondContact O-N 3.47Å; L13-F15 VanDerWaalsContact C-N 3.34Å; L13-F15 PolarHBondContact O-N 3.01Å; L13-A16 PolarHBondContact O-N 3.34Å; L13-K17 PolarHBondContact O-N 3.11Å
14	R	82	Confident	73	Confident	165 Å²	165	103.2 Å²	103.2	62%	0.623	54%	0.541	S	S	*	.	H	α-helix	trans	-62.8	-38.8	173.7	-76.8	168.8	173.3	-177.9	-0.2	112.1	R10 E11 K18	R10-R14 WeakPolarHBondContact O-CB 3.25Å; R10-R14 WeakPolarHBondContact O-CD 3.48Å; R10-R14 WeakPolarHBondContact O-CG 3.34Å; R10-R14 PolarHBondContact O-N 3.18Å; E11-R14 PolarHBondContact O-N 3.03Å; R14-K18 WeakPolarHBondContact O-CG 3.2Å; R14-K18 PolarHBondContact O-N 2.91Å; R14-K18 VanDerWaalsContact O-N 3.09Å
15	F	79.8	Confident	74	Confident	142 Å²	142	104 Å²	104	62%	0.623	53%	0.531	S	S	*	.	H	α-helix	trans	-68.4	-47.1	176.2	-179.3	-97.6	0	0	0	111.5	E11 V12 L13 K17 K18 V19	E11-F15 WeakPolarHBondContact O-CB 3.27Å; E11-F15 PolarHBondContact O-N 3.48Å; V12-F15 PolarHBondContact O-N 2.91Å; L13-F15 VanDerWaalsContact C-N 3.34Å; L13-F15 PolarHBondContact O-N 3.01Å; F15-K17 VanDerWaalsContact C-N 3.33Å; F15-K17 PolarHBondContact O-N 2.86Å; F15-K18 WeakPolarHBondContact O-CB 3.15Å; F15-K18 PolarHBondContact O-N 3.01Å; F15-K18 VanDerWaalsContact O-N 3.15Å; F15-V19 HydrophobicContact CD1-CG2 4.18Å; F15-V19 HydrophobicContact CE1-CG2 3.72Å; F15-V19 HydrophobicContact CE2-CG2 4.29Å; F15-V19 HydrophobicContact CZ-CG2 3.78Å; F15-V19 WeakPolarHBondContact O-CG2 3.41Å; F15-V19 PolarHBondContact O-N 3.11Å
16	A	76.5	Confident	74.6	Confident	52 Å²	52	103.8 Å²	103.8	43%	0.43	53%	0.533	S	S	.	.	H	α-helix	trans	-55.9	-46.9	176.3	0	0	0	0	0	111.5	V12 L13 K18 V19 E20	V12-A16 WeakPolarHBondContact O-CB 3.45Å; V12-A16 PolarHBondContact O-N 2.65Å; L13-A16 PolarHBondContact O-N 3.34Å; A16-K18 PolarHBondContact O-N 3.32Å; A16-V19 PolarHBondContact O-N 3.19Å; A16-E20 PolarHBondContact O-N 3.3Å
17	K	80.6	Confident	75	Confident	120 Å²	120	100.7 Å²	100.7	52%	0.522	51%	0.514	S	S	.	.	H	α-helix	trans	-63.1	-40.3	176.3	-162.7	-175.8	-174.9	-111	0	112.8	L13 F15 V19 E20 E21	L13-K17 PolarHBondContact O-N 3.11Å; F15-K17 VanDerWaalsContact C-N 3.33Å; F15-K17 PolarHBondContact O-N 2.86Å; K17-V19 VanDerWaalsContact C-N 3.31Å; K17-V19 PolarHBondContact O-N 3.24Å; K17-E20 PolarHBondContact O-N 3.36Å; K17-E21 WeakPolarHBondContact CE-OE1 3.19Å; K17-E21 HydrophobicContact CG-CG 4.5Å; K17-E21 IonicContact NZ-OE1 2.64Å; K17-E21 PolarHBondContact NZ-OE1 3.44Å; K17-E21 WeakPolarHBondContact O-CB 3.06Å; K17-E21 WeakPolarHBondContact O-CG 3.42Å; K17-E21 PolarHBondContact O-N 3.23Å
18	K	82.3	Confident	75.6	Confident	146 Å²	146	99.6 Å²	99.6	64%	0.635	51%	0.508	S	S	*	.	H	α-helix	trans	-61.7	-38	174.1	-79.2	177.6	177.7	-178.8	0	112.5	R14 F15 A16 A22	R14-K18 WeakPolarHBondContact O-CG 3.2Å; R14-K18 PolarHBondContact O-N 2.91Å; R14-K18 VanDerWaalsContact O-N 3.09Å; F15-K18 WeakPolarHBondContact O-CB 3.15Å; F15-K18 PolarHBondContact O-N 3.01Å; F15-K18 VanDerWaalsContact O-N 3.15Å; A16-K18 PolarHBondContact O-N 3.32Å; K18-A22 VanDerWaalsContact O-CB 3.23Å; K18-A22 WeakPolarHBondContact O-CB 3.35Å; K18-A22 PolarHBondContact O-N 2.79Å
19	V	79.5	Confident	76	Confident	75 Å²	75	105.3 Å²	105.3	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-68.9	-39.3	175.8	172.3	0	0	0	0	111.2	F15 A16 K17 A22 A23	F15-V19 HydrophobicContact CD1-CG2 4.18Å; F15-V19 HydrophobicContact CE1-CG2 3.72Å; F15-V19 HydrophobicContact CE2-CG2 4.29Å; F15-V19 HydrophobicContact CZ-CG2 3.78Å; F15-V19 WeakPolarHBondContact O-CG2 3.41Å; F15-V19 PolarHBondContact O-N 3.11Å; A16-V19 PolarHBondContact O-N 3.19Å; K17-V19 VanDerWaalsContact C-N 3.31Å; K17-V19 PolarHBondContact O-N 3.24Å; V19-A22 PolarHBondContact O-N 3.05Å; V19-A23 WeakPolarHBondContact O-CB 3.18Å; V19-A23 PolarHBondContact O-N 3.3Å
20	E	75.9	Confident	75.4	Confident	131 Å²	131	104.9 Å²	104.9	61%	0.612	52%	0.515	S	S	*	.	H	α-helix	trans	-64.3	-52	174.9	-171.2	163.9	-134.6	0	0	111.5	A16 K17 A22 A23 E24	A16-E20 PolarHBondContact O-N 3.3Å; K17-E20 PolarHBondContact O-N 3.36Å; E20-A22 VanDerWaalsContact C-N 3.25Å; E20-A22 PolarHBondContact O-N 2.93Å; E20-A23 PolarHBondContact O-N 3.15Å; E20-E24 PolarHBondContact O-N 2.9Å
21	E	80.3	Confident	74.9	Confident	69 Å²	69	102 Å²	102	32%	0.322	51%	0.509	S	S	.	.	H	α-helix	trans	-58.8	-34.2	175.4	-72.4	-179.9	-156	0	0	113	K17 K25	K17-E21 WeakPolarHBondContact CE-OE1 3.19Å; K17-E21 HydrophobicContact CG-CG 4.5Å; K17-E21 IonicContact NZ-OE1 2.64Å; K17-E21 PolarHBondContact NZ-OE1 3.44Å; K17-E21 WeakPolarHBondContact O-CB 3.06Å; K17-E21 WeakPolarHBondContact O-CG 3.42Å; K17-E21 PolarHBondContact O-N 3.23Å; E21-K25 WeakPolarHBondContact O-CB 3.45Å; E21-K25 WeakPolarHBondContact O-CD 3.23Å; E21-K25 VanDerWaalsContact O-CG 3.23Å; E21-K25 WeakPolarHBondContact O-CG 3.32Å; E21-K25 PolarHBondContact O-N 2.84Å; E21-K25 VanDerWaalsContact O-N 3.1Å; E21-K25 IonicContact OE2-NZ 3.52Å
22	A	77.5	Confident	74.6	Confident	57 Å²	57	99.9 Å²	99.9	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-72.6	-37.1	175.1	0	0	0	0	0	112.3	K18 V19 E20 A26	K18-A22 VanDerWaalsContact O-CB 3.23Å; K18-A22 WeakPolarHBondContact O-CB 3.35Å; K18-A22 PolarHBondContact O-N 2.79Å; V19-A22 PolarHBondContact O-N 3.05Å; E20-A22 VanDerWaalsContact C-N 3.25Å; E20-A22 PolarHBondContact O-N 2.93Å; A22-A26 WeakPolarHBondContact O-CB 3.46Å; A22-A26 PolarHBondContact O-N 3Å
23	A	71.5	Confident	74	Confident	58 Å²	58	101.6 Å²	101.6	48%	0.479	52%	0.52	S	S	.	.	H	α-helix	trans	-69.1	-39.1	176.3	0	0	0	0	0	112.1	V19 E20 A26 F27	V19-A23 WeakPolarHBondContact O-CB 3.18Å; V19-A23 PolarHBondContact O-N 3.3Å; E20-A23 PolarHBondContact O-N 3.15Å; A23-A26 PolarHBondContact O-N 2.98Å; A23-F27 WeakPolarHBondContact O-CB 3.5Å; A23-F27 PolarHBondContact O-N 3.42Å
24	E	73.1	Confident	73	Confident	90 Å²	90	98.7 Å²	98.7	42%	0.421	52%	0.52	S	S	.	.	H	α-helix	trans	-65.4	-49.1	172.9	-64	-155	126	0	0	111.1	E20 A26 F27 D28 R59	E20-E24 PolarHBondContact O-N 2.9Å; E24-A26 PolarHBondContact O-N 3.17Å; E24-F27 WeakPolarHBondContact O-CA 3.44Å; E24-F27 WeakPolarHBondContact O-CB 3.23Å; E24-F27 PolarHBondContact O-N 2.96Å; E24-D28 PolarHBondContact O-N 3.1Å; E24-R59 IonicContact OE1-CZ 3.34Å; E24-R59 IonicContact OE1-NH2 3.71Å; E24-R59 PolarHBondContact OE1-NH2 3.13Å
25	K	78	Confident	71.6	Confident	120 Å²	120	94.6 Å²	94.6	52%	0.522	51%	0.514	S	S	.	.	H	α-helix	trans	-59.9	-29.4	175.7	-73.2	164.8	-173.7	155.9	0	113.3	E21 R29	E21-K25 WeakPolarHBondContact O-CB 3.45Å; E21-K25 WeakPolarHBondContact O-CD 3.23Å; E21-K25 VanDerWaalsContact O-CG 3.23Å; E21-K25 WeakPolarHBondContact O-CG 3.32Å; E21-K25 PolarHBondContact O-N 2.84Å; E21-K25 VanDerWaalsContact O-N 3.1Å; E21-K25 IonicContact OE2-NZ 3.52Å; K25-R29 WeakPolarHBondContact O-CB 3.4Å; K25-R29 VanDerWaalsContact O-CD 3.27Å; K25-R29 WeakPolarHBondContact O-CD 3.18Å; K25-R29 WeakPolarHBondContact O-CG 3.47Å; K25-R29 PolarHBondContact O-N 3.41Å
26	A	71.8	Confident	70.2	Confident	52 Å²	52	93.5 Å²	93.5	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-73.9	-40.9	172.8	0	0	0	0	0	112.2	A22 A23 E24 Q30	A22-A26 WeakPolarHBondContact O-CB 3.46Å; A22-A26 PolarHBondContact O-N 3Å; A23-A26 PolarHBondContact O-N 2.98Å; E24-A26 PolarHBondContact O-N 3.17Å; A26-Q30 PolarHBondContact O-N 3.33Å; A26-Q30 VanDerWaalsContact O-N 3.11Å
27	F	65.7	Low	69	Low	55 Å²	55	91.7 Å²	91.7	24%	0.241	49%	0.493	C	S	.	.	H	α-helix	trans	-64.7	-50	176.3	177.8	-104.8	0	0	0	112	A23 E24 R29 Q30 M31 F50	A23-F27 WeakPolarHBondContact O-CB 3.5Å; A23-F27 PolarHBondContact O-N 3.42Å; E24-F27 WeakPolarHBondContact O-CA 3.44Å; E24-F27 WeakPolarHBondContact O-CB 3.23Å; E24-F27 PolarHBondContact O-N 2.96Å; F27-R29 VanDerWaalsContact C-N 3.26Å; F27-R29 PolarHBondContact O-N 2.91Å; F27-Q30 PolarHBondContact O-N 2.88Å; F27-M31 HydrophobicContact CD1-CG 4.2Å; F27-M31 HydrophobicContact CD2-CG 4.36Å; F27-M31 HydrophobicContact CE1-CG 3.72Å; F27-M31 HydrophobicContact CE1-SD 4.45Å; F27-M31 HydrophobicContact CE2-CG 3.87Å; F27-M31 HydrophobicContact CE2-SD 3.91Å; F27-M31 HydrophobicContact CZ-CG 3.54Å; F27-M31 HydrophobicContact CZ-SD 3.7Å; F27-M31 WeakPolarHBondContact O-CG 3.39Å; F27-M31 PolarHBondContact O-N 3.49Å; F27-F50 AromaticContact CE2-CE1 3.69Å; F27-F50 HydrophobicContact CE2-CE1 3.69Å; F27-F50 AromaticContact CE2-CZ 3.66Å; F27-F50 HydrophobicContact CE2-CZ 3.66Å; F27-F50 HydrophobicContact CZ-CE1 4.1Å; F27-F50 HydrophobicContact CZ-CZ 4.43Å
28	D	75.1	Confident	67.6	Low	83 Å²	83	91.6 Å²	91.6	44%	0.444	49%	0.492	S	S	.	.	H	α-helix	trans	-61	-36.8	179.8	-63.3	-23.7	0	0	0	111.4	E24 A32	E24-D28 PolarHBondContact O-N 3.1Å; D28-A32 VanDerWaalsContact O-CB 3.26Å; D28-A32 WeakPolarHBondContact O-CB 3.33Å; D28-A32 PolarHBondContact O-N 3.45Å
29	R	72.9	Confident	65.9	Low	184 Å²	184	88.1 Å²	88.1	69%	0.694	48%	0.484	S	S	*	.	H	α-helix	trans	-63.7	-41.9	171.9	-78.2	172.3	178.6	-171	-2.6	112.7	K25 F27 L33	K25-R29 WeakPolarHBondContact O-CB 3.4Å; K25-R29 VanDerWaalsContact O-CD 3.27Å; K25-R29 WeakPolarHBondContact O-CD 3.18Å; K25-R29 WeakPolarHBondContact O-CG 3.47Å; K25-R29 PolarHBondContact O-N 3.41Å; F27-R29 VanDerWaalsContact C-N 3.26Å; F27-R29 PolarHBondContact O-N 2.91Å; R29-L33 WeakPolarHBondContact O-CB 3.5Å; R29-L33 WeakPolarHBondContact O-CD1 3.14Å; R29-L33 WeakPolarHBondContact O-CG 3.27Å; R29-L33 PolarHBondContact O-N 2.95Å
30	Q	59.7	Low	64.3	Low	97 Å²	97	89.5 Å²	89.5	45%	0.453	49%	0.493	S	S	.	.	H	α-helix	trans	-67.1	-42.9	176.7	-75.5	-175.7	-24.2	0	0	111.7	A26 F27 A32 L33 G34 T35	A26-Q30 PolarHBondContact O-N 3.33Å; A26-Q30 VanDerWaalsContact O-N 3.11Å; F27-Q30 PolarHBondContact O-N 2.88Å; Q30-A32 PolarHBondContact O-N 2.93Å; Q30-L33 PolarHBondContact O-N 3.48Å; Q30-G34 PolarHBondContact O-N 2.86Å; Q30-T35 PolarHBondContact O-OG1 2.66Å
31	M	62.1	Low	62.9	Low	91 Å²	91	86.1 Å²	86.1	45%	0.448	48%	0.479	S	S	.	.	H	α-helix	trans	-61	-43.8	175	-66.3	-60.7	-60.5	0	0	111.9	F27 L33 G34 F50	F27-M31 HydrophobicContact CD1-CG 4.2Å; F27-M31 HydrophobicContact CD2-CG 4.36Å; F27-M31 HydrophobicContact CE1-CG 3.72Å; F27-M31 HydrophobicContact CE1-SD 4.45Å; F27-M31 HydrophobicContact CE2-CG 3.87Å; F27-M31 HydrophobicContact CE2-SD 3.91Å; F27-M31 HydrophobicContact CZ-CG 3.54Å; F27-M31 HydrophobicContact CZ-SD 3.7Å; F27-M31 WeakPolarHBondContact O-CG 3.39Å; F27-M31 PolarHBondContact O-N 3.49Å; M31-L33 VanDerWaalsContact C-N 3.28Å; M31-L33 PolarHBondContact O-N 3.42Å; M31-G34 PolarHBondContact O-N 2.87Å; M31-G34 VanDerWaalsContact O-N 3.15Å; M31-F50 HydrophobicContact SD-CE1 4.47Å
32	A	69.7	Low	61.8	Low	91 Å²	91	92.5 Å²	92.5	75%	0.752	51%	0.509	S	S	*	.	H	α-helix	trans	-67.7	-24.8	176.5	0	0	0	0	0	113.8	D28 Q30 G34	D28-A32 VanDerWaalsContact O-CB 3.26Å; D28-A32 WeakPolarHBondContact O-CB 3.33Å; D28-A32 PolarHBondContact O-N 3.45Å; Q30-A32 PolarHBondContact O-N 2.93Å; A32-G34 VanDerWaalsContact C-N 3.29Å
33	L	63.8	Low	60.5	Low	130 Å²	130	96 Å²	96	68%	0.681	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-1.6	174	-74.1	167.9	0	0	0	113.4	R29 Q30 M31 T35	R29-L33 WeakPolarHBondContact O-CB 3.5Å; R29-L33 WeakPolarHBondContact O-CD1 3.14Å; R29-L33 WeakPolarHBondContact O-CG 3.27Å; R29-L33 PolarHBondContact O-N 2.95Å; Q30-L33 PolarHBondContact O-N 3.48Å; M31-L33 VanDerWaalsContact C-N 3.28Å; M31-L33 PolarHBondContact O-N 3.42Å; L33-T35 PolarHBondContact O-N 3.17Å
34	G	54.7	Low	59.2	Low	64 Å²	64	95.7 Å²	95.7	66%	0.66	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	3.5	178.5	0	0	0	0	0	115	Q30 M31 A32 K36	Q30-G34 PolarHBondContact O-N 2.86Å; M31-G34 PolarHBondContact O-N 2.87Å; M31-G34 VanDerWaalsContact O-N 3.15Å; A32-G34 VanDerWaalsContact C-N 3.29Å; G34-K36 PolarHBondContact O-N 2.91Å
35	T	52.4	Low	57.8	Low	80 Å²	80	98.4 Å²	98.4	49%	0.491	53%	0.533	S	S	.	.			trans	-74	101	177.6	41	0	0	0	0	109	Q30 L33 P37	Q30-T35 PolarHBondContact O-OG1 2.66Å; L33-T35 PolarHBondContact O-N 3.17Å; T35-P37 WeakPolarHBondContact O-CD 3.47Å
36	K	51.3	Low	56.7	Low	118 Å²	118	99.5 Å²	99.5	51%	0.513	55%	0.549	S	S	.	.			trans	-41.3	112.1	167.3	-78.6	-172	-178.8	-179.1	0	107.8	G34 F38	G34-K36 PolarHBondContact O-N 2.91Å; K36-F38 PolarHBondContact O-N 3.05Å; K36-F38 VanDerWaalsContact O-N 3.16Å
37	P	50.2	Low	55.6	Low	15 Å²	15	100 Å²	100	10%	0.097	55%	0.545	C	S	.	.	S	Bend	trans	-69.1	124.1	175.4	-12.5	25.4	0	0	0	107.7	T35 P48 F50	T35-P37 WeakPolarHBondContact O-CD 3.47Å; P37-P48 VanDerWaalsContact C-CB 3.42Å; P37-P48 HydrophobicContact CB-CB 3.87Å; P37-F50 HydrophobicContact CB-CD2 3.46Å; P37-F50 VanDerWaalsContact CB-CD2 3.46Å; P37-F50 HydrophobicContact CB-CE2 3.64Å; P37-F50 HydrophobicContact CB-CG 4.05Å; P37-F50 HydrophobicContact CB-CZ 4.31Å; P37-F50 HydrophobicContact CG-CD1 4.06Å; P37-F50 HydrophobicContact CG-CD2 3.76Å; P37-F50 HydrophobicContact CG-CE1 4.14Å; P37-F50 HydrophobicContact CG-CE2 3.9Å; P37-F50 HydrophobicContact CG-CG 3.89Å; P37-F50 HydrophobicContact CG-CZ 4.09Å; P37-F50 WeakPolarHBondContact O-CB 3.44Å; P37-F50 WeakPolarHBondContact O-CD2 3.35Å; P37-F50 PolarHBondContact O-N 3.23Å
38	F	51.3	Low	54.8	Low	117 Å²	117	100 Å²	100	51%	0.513	55%	0.55	S	S	.	.			trans	68.6	78.8	168.4	-75.3	-74.8	0	0	0	110.9	K36 L47 P48 S51	K36-F38 PolarHBondContact O-N 3.05Å; K36-F38 VanDerWaalsContact O-N 3.16Å; F38-L47 HydrophobicContact CB-CD2 4.49Å; F38-L47 HydrophobicContact CB-CG 3.87Å; F38-P48 HydrophobicContact CB-CB 2.28Å; F38-P48 HydrophobicContact CB-CG 2.32Å; F38-P48 WeakPolarHBondContact CB-O 3.33Å; F38-P48 VanDerWaalsContact CD1-CA 3.47Å; F38-P48 HydrophobicContact CD1-CB 3.76Å; F38-P48 HydrophobicContact CD1-CG 3.2Å; F38-P48 HydrophobicContact CD2-CB 2.59Å; F38-P48 HydrophobicContact CD2-CG 3.26Å; F38-P48 HydrophobicContact CE1-CG 4.28Å; F38-P48 HydrophobicContact CE2-CB 3.91Å; F38-P48 HydrophobicContact CE2-CG 4.32Å; F38-P48 HydrophobicContact CG-CB 2.29Å; F38-P48 HydrophobicContact CG-CG 2.26Å; F38-P48 VanDerWaalsContact N-CB 3.33Å; F38-S51 WeakPolarHBondContact O-CB 3.32Å; F38-S51 PolarHBondContact O-OG 3.44Å
39	P	47.3	Very low	53.7	Low	73 Å²	73	97.5 Å²	97.5	47%	0.474	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-100.5	133.4	164.3	35.1	-28.1	0	0	0	113	D41 L47 S51	P39-D41 PolarHBondContact O-N 2.93Å; P39-L47 WeakPolarHBondContact O-CD2 3.46Å; P39-S51 WeakPolarHBondContact CA-OG 3.11Å; P39-S51 VanDerWaalsContact CB-OG 3.32Å; P39-S51 WeakPolarHBondContact CB-OG 3.33Å
40	V	45.7	Very low	52.7	Low	104 Å²	104	90 Å²	90	63%	0.63	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-67.6	129.4	-173.7	-150	0	0	0	0	109.2	L47	V40-L47 VanDerWaalsContact CA-CD1 3.49Å; V40-L47 HydrophobicContact CB-CD1 3.83Å; V40-L47 HydrophobicContact CG1-CD1 4.24Å; V40-L47 HydrophobicContact CG2-CD1 3.45Å; V40-L47 VanDerWaalsContact CG2-CD1 3.45Å
41	D	47.4	Very low	52.2	Low	60 Å²	60	87.1 Å²	87.1	32%	0.321	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-84.6	162.8	170.9	82.3	-35.5	0	0	0	111.2	P39 N43 G44 F45	P39-D41 PolarHBondContact O-N 2.93Å; D41-N43 PolarHBondContact O-N 3.45Å; D41-N43 WeakPolarHBondContact OD2-CB 3.43Å; D41-N43 PolarHBondContact OD2-ND2 3.01Å; D41-G44 PolarHBondContact O-N 3.03Å; D41-G44 PolarHBondContact OD1-N 2.88Å; D41-F45 WeakPolarHBondContact OD1-CB 3.3Å; D41-F45 PolarHBondContact OD1-N 3.25Å
42	E	56	Low	51.6	Low	203 Å²	203	86.8 Å²	86.8	95%	0.949	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-8.5	-178.7	-62.2	171.8	176.1	0	0	112.7
43	N	50.4	Low	50.8	Low	131 Å²	131	90.7 Å²	90.7	70%	0.701	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-1.3	177.1	-42.8	-79.1	0	0	0	113.4	D41 F45	D41-N43 PolarHBondContact O-N 3.45Å; D41-N43 WeakPolarHBondContact OD2-CB 3.43Å; D41-N43 PolarHBondContact OD2-ND2 3.01Å; N43-F45 HydrophobicContact CB-CD2 4.22Å; N43-F45 HydrophobicContact CB-CE2 4.32Å
44	G	43.8	Very low	50.4	Low	52 Å²	52	88.6 Å²	88.6	54%	0.536	51%	0.512	S	S	.	.			trans	84.6	25.3	169.4	0	0	0	0	0	116.8	D41	D41-G44 PolarHBondContact O-N 3.03Å; D41-G44 PolarHBondContact OD1-N 2.88Å
45	F	44.6	Very low	50.6	Low	146 Å²	146	89.5 Å²	89.5	64%	0.64	50%	0.499	S	S	*	.			trans	-70.6	139.2	-175.1	-87.4	-83.5	0	0	0	115	D41 N43 L47	D41-F45 WeakPolarHBondContact OD1-CB 3.3Å; D41-F45 PolarHBondContact OD1-N 3.25Å; N43-F45 HydrophobicContact CB-CD2 4.22Å; N43-F45 HydrophobicContact CB-CE2 4.32Å; F45-L47 WeakPolarHBondContact O-CB 3.33Å; F45-L47 VanDerWaalsContact O-CD2 3.23Å; F45-L47 WeakPolarHBondContact O-CD2 3.31Å
46	V	54.4	Low	51	Low	143 Å²	143	91.9 Å²	91.9	87%	0.867	51%	0.509	S	S	*	.			trans	-76.7	136.7	-166.7	-176.8	0	0	0	0	112.4
47	L	48.8	Very low	51.6	Low	63 Å²	63	91.9 Å²	91.9	33%	0.33	51%	0.513	S	S	.	.			trans	-138.2	149.6	-130	-153.4	-157.3	0	0	0	117.4	F38 P39 V40 F45	F38-L47 HydrophobicContact CB-CD2 4.49Å; F38-L47 HydrophobicContact CB-CG 3.87Å; P39-L47 WeakPolarHBondContact O-CD2 3.46Å; V40-L47 VanDerWaalsContact CA-CD1 3.49Å; V40-L47 HydrophobicContact CB-CD1 3.83Å; V40-L47 HydrophobicContact CG1-CD1 4.24Å; V40-L47 HydrophobicContact CG2-CD1 3.45Å; V40-L47 VanDerWaalsContact CG2-CD1 3.45Å; F45-L47 WeakPolarHBondContact O-CB 3.33Å; F45-L47 VanDerWaalsContact O-CD2 3.23Å; F45-L47 WeakPolarHBondContact O-CD2 3.31Å
48	P	49	Very low	52.5	Low	54 Å²	54	93.3 Å²	93.3	35%	0.351	52%	0.524	S	S	.	.			trans	-65.2	-165.7	171.6	-1.6	3.8	0	0	0	114.2	P37 F38 F50	P37-P48 VanDerWaalsContact C-CB 3.42Å; P37-P48 HydrophobicContact CB-CB 3.87Å; F38-P48 HydrophobicContact CB-CB 2.28Å; F38-P48 HydrophobicContact CB-CG 2.32Å; F38-P48 WeakPolarHBondContact CB-O 3.33Å; F38-P48 VanDerWaalsContact CD1-CA 3.47Å; F38-P48 HydrophobicContact CD1-CB 3.76Å; F38-P48 HydrophobicContact CD1-CG 3.2Å; F38-P48 HydrophobicContact CD2-CB 2.59Å; F38-P48 HydrophobicContact CD2-CG 3.26Å; F38-P48 HydrophobicContact CE1-CG 4.28Å; F38-P48 HydrophobicContact CE2-CB 3.91Å; F38-P48 HydrophobicContact CE2-CG 4.32Å; F38-P48 HydrophobicContact CG-CB 2.29Å; F38-P48 HydrophobicContact CG-CG 2.26Å; F38-P48 VanDerWaalsContact N-CB 3.33Å; P48-F50 HydrophobicContact CB-CD2 4.34Å; P48-F50 HydrophobicContact CB-CE2 4.44Å
49	L	52.2	Low	53.3	Low	31 Å²	31	93.4 Å²	93.4	16%	0.162	52%	0.521	C	S	.	.	S	Bend	trans	-103.3	2	-164.8	-62.6	98	0	0	0	117.6	R65 R66 L69	L49-R65 HydrophobicContact CD2-CB 4.21Å; L49-R65 HydrophobicContact CD2-CG 4.04Å; L49-R65 PolarHBondContact O-NH1 2.96Å; L49-R66 HydrophobicContact CD2-CB 4.06Å; L49-L69 HydrophobicContact CD2-CD1 3.79Å; L49-L69 HydrophobicContact CG-CD1 4.22Å
50	F	51.2	Low	54.5	Low	26 Å²	26	94.8 Å²	94.8	11%	0.114	52%	0.521	C	S	.	.			trans	-121.2	25.5	-154.2	-46.4	-119.9	0	0	0	114.7	F27 M31 P37 P48 I62	F27-F50 AromaticContact CE2-CE1 3.69Å; F27-F50 HydrophobicContact CE2-CE1 3.69Å; F27-F50 AromaticContact CE2-CZ 3.66Å; F27-F50 HydrophobicContact CE2-CZ 3.66Å; F27-F50 HydrophobicContact CZ-CE1 4.1Å; F27-F50 HydrophobicContact CZ-CZ 4.43Å; M31-F50 HydrophobicContact SD-CE1 4.47Å; P37-F50 HydrophobicContact CB-CD2 3.46Å; P37-F50 VanDerWaalsContact CB-CD2 3.46Å; P37-F50 HydrophobicContact CB-CE2 3.64Å; P37-F50 HydrophobicContact CB-CG 4.05Å; P37-F50 HydrophobicContact CB-CZ 4.31Å; P37-F50 HydrophobicContact CG-CD1 4.06Å; P37-F50 HydrophobicContact CG-CD2 3.76Å; P37-F50 HydrophobicContact CG-CE1 4.14Å; P37-F50 HydrophobicContact CG-CE2 3.9Å; P37-F50 HydrophobicContact CG-CG 3.89Å; P37-F50 HydrophobicContact CG-CZ 4.09Å; P37-F50 WeakPolarHBondContact O-CB 3.44Å; P37-F50 WeakPolarHBondContact O-CD2 3.35Å; P37-F50 PolarHBondContact O-N 3.23Å; P48-F50 HydrophobicContact CB-CD2 4.34Å; P48-F50 HydrophobicContact CB-CE2 4.44Å; F50-I62 HydrophobicContact CD1-CD1 3.99Å; F50-I62 HydrophobicContact CD1-CG1 4.35Å; F50-I62 HydrophobicContact CE1-CD1 3.7Å; F50-I62 HydrophobicContact CE1-CG1 4.08Å; F50-I62 HydrophobicContact CE1-CG2 3.7Å; F50-I62 HydrophobicContact CZ-CG2 3.69Å
51	S	49	Very low	55.5	Low	38 Å²	38	90.9 Å²	90.9	27%	0.266	50%	0.499	S	S	.	.			trans	-132.5	43.8	179.3	-54.5	0	0	0	0	113.5	F38 P39	F38-S51 WeakPolarHBondContact O-CB 3.32Å; F38-S51 PolarHBondContact O-OG 3.44Å; P39-S51 WeakPolarHBondContact CA-OG 3.11Å; P39-S51 VanDerWaalsContact CB-OG 3.32Å; P39-S51 WeakPolarHBondContact CB-OG 3.33Å
52	I	50.7	Low	56.3	Low	84 Å²	84	89 Å²	89	43%	0.431	49%	0.489	S	S	.	.			trans	-103.6	116.7	155	-62.4	-169.6	0	0	0	106.7	G54 E55	I52-G54 PolarHBondContact O-N 2.86Å; I52-E55 HydrophobicContact CB-CB 4.48Å; I52-E55 HydrophobicContact CB-CG 4.16Å; I52-E55 HydrophobicContact CG2-CG 3.97Å; I52-E55 PolarHBondContact O-N 3.46Å
53	E	51.8	Low	57	Low	172 Å²	172	82.5 Å²	82.5	80%	0.804	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	126.8	173.4	-58.4	-171.1	148.5	0	0	108.7
54	G	55.5	Low	58.1	Low	87 Å²	87	84.7 Å²	84.7	90%	0.897	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.7	2.3	-177	0	0	0	0	0	116.8	I52	I52-G54 PolarHBondContact O-N 2.86Å
55	E	58.9	Low	59.4	Low	82 Å²	82	85.2 Å²	85.2	38%	0.383	44%	0.444	S	S	.	.	S	Bend	trans	-85.1	146.9	165.3	-85.7	-166.3	-172.1	0	0	112.4	I52 L57 R65	I52-E55 HydrophobicContact CB-CB 4.48Å; I52-E55 HydrophobicContact CB-CG 4.16Å; I52-E55 HydrophobicContact CG2-CG 3.97Å; I52-E55 PolarHBondContact O-N 3.46Å; E55-L57 PolarHBondContact O-N 3Å; E55-L57 VanDerWaalsContact O-N 3.11Å; E55-R65 IonicContact OE1-CZ 2.71Å; E55-R65 IonicContact OE1-NE 3.5Å; E55-R65 IonicContact OE1-NH1 2.65Å; E55-R65 IonicContact OE1-NH2 3.82Å; E55-R65 VanDerWaalsContact OE2-CD 3.24Å; E55-R65 WeakPolarHBondContact OE2-CD 3.37Å; E55-R65 IonicContact OE2-CZ 3.67Å; E55-R65 IonicContact OE2-NE 2.64Å; E55-R65 PolarHBondContact OE2-NE 3.5Å; E55-R65 IonicContact OE2-NH1 2.69Å; E55-R65 PolarHBondContact OE2-NH1 3.26Å
56	D	60.9	Low	60.8	Low	131 Å²	131	85.7 Å²	85.7	70%	0.701	44%	0.442	S	S	*	.			trans	-58.6	109.9	171.3	-103.4	-32.6	0	0	0	111.3	S58 A61	D56-S58 PolarHBondContact O-N 3.42Å; D56-A61 HydrophobicContact CB-CB 3.83Å; D56-A61 VanDerWaalsContact O-CB 3.25Å; D56-A61 WeakPolarHBondContact O-CB 3.47Å
57	L	65.4	Low	61.8	Low	118 Å²	118	85.9 Å²	85.9	62%	0.618	43%	0.431	S	S	*	.			trans	-81	17.7	175.9	-63.7	176.7	0	0	0	113.5	E55 I62	E55-L57 PolarHBondContact O-N 3Å; E55-L57 VanDerWaalsContact O-N 3.11Å; L57-I62 VanDerWaalsContact O-CD1 3.27Å; L57-I62 WeakPolarHBondContact O-CD1 3.46Å
58	S	68.2	Low	63.1	Low	45 Å²	45	89.9 Å²	89.9	32%	0.315	45%	0.446	S	S	.	.			trans	-66.1	144.9	174.8	60.7	0	0	0	0	111.4	D56 E60 A61 I62	D56-S58 PolarHBondContact O-N 3.42Å; S58-E60 PolarHBondContact O-N 3.29Å; S58-E60 VanDerWaalsContact O-N 3.15Å; S58-A61 PolarHBondContact O-N 3.01Å; S58-A61 WeakPolarHBondContact OG-CB 3.4Å; S58-A61 PolarHBondContact OG-N 2.92Å; S58-I62 WeakPolarHBondContact O-CD1 3.4Å; S58-I62 WeakPolarHBondContact O-CG1 3.23Å; S58-I62 PolarHBondContact O-N 3.47Å
59	R	67.9	Low	64.6	Low	119 Å²	119	91.2 Å²	91.2	45%	0.449	45%	0.45	S	S	.	.	H	α-helix	trans	-55	-37.1	179.1	-174.4	-180	-179.9	-175.8	1	110.6	E24 I63	E24-R59 IonicContact OE1-CZ 3.34Å; E24-R59 IonicContact OE1-NH2 3.71Å; E24-R59 PolarHBondContact OE1-NH2 3.13Å; R59-I63 HydrophobicContact CG-CD1 3.83Å; R59-I63 VanDerWaalsContact O-CB 3.32Å; R59-I63 WeakPolarHBondContact O-CB 3.41Å; R59-I63 WeakPolarHBondContact O-CG1 3.35Å; R59-I63 PolarHBondContact O-N 3.1Å
60	E	72.8	Confident	65.8	Low	102 Å²	102	94 Å²	94	48%	0.477	46%	0.464	S	S	.	.	H	α-helix	trans	-65.8	-46.3	177.9	-65	60.3	-131	0	0	111.4	S58 I63 R64	S58-E60 PolarHBondContact O-N 3.29Å; S58-E60 VanDerWaalsContact O-N 3.15Å; E60-I63 PolarHBondContact O-N 2.93Å; E60-R64 WeakPolarHBondContact O-CB 3.5Å; E60-R64 WeakPolarHBondContact O-CD 3.36Å; E60-R64 WeakPolarHBondContact O-CG 3.34Å; E60-R64 PolarHBondContact O-N 2.87Å
61	A	66.7	Low	67.2	Low	21 Å²	21	99.4 Å²	99.4	17%	0.174	49%	0.488	C	S	.	.	H	α-helix	trans	-64.8	-45.3	176.2	0	0	0	0	0	111.6	D56 S58 I63 R64 R65	D56-A61 HydrophobicContact CB-CB 3.83Å; D56-A61 VanDerWaalsContact O-CB 3.25Å; D56-A61 WeakPolarHBondContact O-CB 3.47Å; S58-A61 PolarHBondContact O-N 3.01Å; S58-A61 WeakPolarHBondContact OG-CB 3.4Å; S58-A61 PolarHBondContact OG-N 2.92Å; A61-I63 PolarHBondContact O-N 2.94Å; A61-R64 PolarHBondContact O-N 3.27Å; A61-R65 WeakPolarHBondContact O-CB 3.17Å; A61-R65 PolarHBondContact O-N 3.19Å
62	I	64.8	Low	68.8	Low	21 Å²	21	101.8 Å²	101.8	11%	0.108	50%	0.497	C	S	.	.	H	α-helix	trans	-59.5	-45.4	176.1	-66.4	156.4	0	0	0	110.9	F50 L57 S58 R65 R66	F50-I62 HydrophobicContact CD1-CD1 3.99Å; F50-I62 HydrophobicContact CD1-CG1 4.35Å; F50-I62 HydrophobicContact CE1-CD1 3.7Å; F50-I62 HydrophobicContact CE1-CG1 4.08Å; F50-I62 HydrophobicContact CE1-CG2 3.7Å; F50-I62 HydrophobicContact CZ-CG2 3.69Å; L57-I62 VanDerWaalsContact O-CD1 3.27Å; L57-I62 WeakPolarHBondContact O-CD1 3.46Å; S58-I62 WeakPolarHBondContact O-CD1 3.4Å; S58-I62 WeakPolarHBondContact O-CG1 3.23Å; S58-I62 PolarHBondContact O-N 3.47Å; I62-R65 PolarHBondContact O-N 3.29Å; I62-R66 VanDerWaalsContact O-CB 3.31Å; I62-R66 WeakPolarHBondContact O-CB 3.38Å; I62-R66 PolarHBondContact O-N 3.09Å
63	I	70.8	Confident	70.3	Confident	67 Å²	67	101.5 Å²	101.5	34%	0.344	50%	0.496	S	S	.	.	H	α-helix	trans	-65	-42.7	176.4	-72.2	169.5	0	0	0	111.3	R59 E60 A61 R66 K67	R59-I63 HydrophobicContact CG-CD1 3.83Å; R59-I63 VanDerWaalsContact O-CB 3.32Å; R59-I63 WeakPolarHBondContact O-CB 3.41Å; R59-I63 WeakPolarHBondContact O-CG1 3.35Å; R59-I63 PolarHBondContact O-N 3.1Å; E60-I63 PolarHBondContact O-N 2.93Å; A61-I63 PolarHBondContact O-N 2.94Å; I63-R66 PolarHBondContact O-N 3.15Å; I63-K67 HydrophobicContact CG2-CD 4.12Å; I63-K67 WeakPolarHBondContact O-CB 3.45Å; I63-K67 WeakPolarHBondContact O-CG 3.37Å; I63-K67 PolarHBondContact O-N 2.87Å
64	R	73.1	Confident	71.7	Confident	176 Å²	176	98.3 Å²	98.3	66%	0.664	48%	0.481	S	S	*	.	H	α-helix	trans	-61.4	-45.6	175.1	-73.1	162.8	-174.6	161.3	2.1	111.1	E60 A61 K67 K68	E60-R64 WeakPolarHBondContact O-CB 3.5Å; E60-R64 WeakPolarHBondContact O-CD 3.36Å; E60-R64 WeakPolarHBondContact O-CG 3.34Å; E60-R64 PolarHBondContact O-N 2.87Å; A61-R64 PolarHBondContact O-N 3.27Å; R64-K67 PolarHBondContact O-N 3.44Å; R64-K68 WeakPolarHBondContact O-CB 3.3Å; R64-K68 PolarHBondContact O-N 2.71Å
65	R	71.1	Confident	73.1	Confident	63 Å²	63	98.4 Å²	98.4	24%	0.238	46%	0.458	C	S	.	.	H	α-helix	trans	-63.3	-46	177.7	-166.4	176.5	180	-158.9	-4.2	111.2	L49 E55 A61 I62 K67 K68 L69	L49-R65 HydrophobicContact CD2-CB 4.21Å; L49-R65 HydrophobicContact CD2-CG 4.04Å; L49-R65 PolarHBondContact O-NH1 2.96Å; E55-R65 IonicContact OE1-CZ 2.71Å; E55-R65 IonicContact OE1-NE 3.5Å; E55-R65 IonicContact OE1-NH1 2.65Å; E55-R65 IonicContact OE1-NH2 3.82Å; E55-R65 VanDerWaalsContact OE2-CD 3.24Å; E55-R65 WeakPolarHBondContact OE2-CD 3.37Å; E55-R65 IonicContact OE2-CZ 3.67Å; E55-R65 IonicContact OE2-NE 2.64Å; E55-R65 PolarHBondContact OE2-NE 3.5Å; E55-R65 IonicContact OE2-NH1 2.69Å; E55-R65 PolarHBondContact OE2-NH1 3.26Å; A61-R65 WeakPolarHBondContact O-CB 3.17Å; A61-R65 PolarHBondContact O-N 3.19Å; I62-R65 PolarHBondContact O-N 3.29Å; R65-K67 PolarHBondContact O-N 2.81Å; R65-K68 WeakPolarHBondContact O-CB 3.29Å; R65-K68 PolarHBondContact O-N 3.05Å; R65-L69 WeakPolarHBondContact O-CG 3.47Å; R65-L69 PolarHBondContact O-N 3.14Å
66	R	74.2	Confident	74.4	Confident	156 Å²	156	97.2 Å²	97.2	59%	0.589	46%	0.459	S	S	*	.	H	α-helix	trans	-58.3	-45	173.7	-174.7	178.3	177	-166.8	-1.1	112	L49 I62 I63 L69 L70	L49-R66 HydrophobicContact CD2-CB 4.06Å; I62-R66 VanDerWaalsContact O-CB 3.31Å; I62-R66 WeakPolarHBondContact O-CB 3.38Å; I62-R66 PolarHBondContact O-N 3.09Å; I63-R66 PolarHBondContact O-N 3.15Å; R66-L69 PolarHBondContact O-N 2.8Å; R66-L70 HydrophobicContact CG-CD1 4.09Å; R66-L70 WeakPolarHBondContact O-CB 3.38Å; R66-L70 VanDerWaalsContact O-CG 3.3Å; R66-L70 WeakPolarHBondContact O-CG 3.41Å; R66-L70 PolarHBondContact O-N 3.08Å
67	K	75.7	Confident	75.6	Confident	148 Å²	148	93 Å²	93	64%	0.643	44%	0.435	S	S	*	.	H	α-helix	trans	-62.9	-39.9	175.1	-74	176.4	179.6	-179.4	0	112	I63 R64 R65 K71	I63-K67 HydrophobicContact CG2-CD 4.12Å; I63-K67 WeakPolarHBondContact O-CB 3.45Å; I63-K67 WeakPolarHBondContact O-CG 3.37Å; I63-K67 PolarHBondContact O-N 2.87Å; R64-K67 PolarHBondContact O-N 3.44Å; R65-K67 PolarHBondContact O-N 2.81Å; K67-K71 PolarHBondContact O-N 3.34Å; K67-K71 VanDerWaalsContact O-N 3.1Å
68	K	75.9	Confident	76.6	Confident	147 Å²	147	91.6 Å²	91.6	64%	0.639	43%	0.425	S	S	*	.	H	α-helix	trans	-63.6	-47.6	174.8	-174.1	179.2	178.1	-176.3	0	111.9	R64 R65 K71 L72	R64-K68 WeakPolarHBondContact O-CB 3.3Å; R64-K68 PolarHBondContact O-N 2.71Å; R65-K68 WeakPolarHBondContact O-CB 3.29Å; R65-K68 PolarHBondContact O-N 3.05Å; K68-K71 PolarHBondContact O-N 3.19Å; K68-L72 HydrophobicContact CG-CD1 4.24Å; K68-L72 WeakPolarHBondContact O-CG 3.24Å; K68-L72 PolarHBondContact O-N 3.32Å
69	L	79.3	Confident	77.6	Confident	82 Å²	82	93 Å²	93	43%	0.429	43%	0.432	S	S	.	.	H	α-helix	trans	-63.9	-41.3	177.6	-67.7	-175.9	0	0	0	112.5	L49 R65 R66 K71 L72 L73	L49-L69 HydrophobicContact CD2-CD1 3.79Å; L49-L69 HydrophobicContact CG-CD1 4.22Å; R65-L69 WeakPolarHBondContact O-CG 3.47Å; R65-L69 PolarHBondContact O-N 3.14Å; R66-L69 PolarHBondContact O-N 2.8Å; L69-K71 VanDerWaalsContact C-N 3.31Å; L69-K71 PolarHBondContact O-N 2.81Å; L69-L72 HydrophobicContact CD2-CD1 4.41Å; L69-L72 PolarHBondContact O-N 3.36Å; L69-L73 WeakPolarHBondContact O-CB 3.21Å; L69-L73 PolarHBondContact O-N 3.35Å
70	L	78.8	Confident	78.5	Confident	88 Å²	88	90.3 Å²	90.3	46%	0.461	43%	0.428	S	S	.	.	H	α-helix	trans	-63.5	-35.3	175.8	-73.6	169.4	0	0	0	112.7	R66 H74	R66-L70 HydrophobicContact CG-CD1 4.09Å; R66-L70 WeakPolarHBondContact O-CB 3.38Å; R66-L70 VanDerWaalsContact O-CG 3.3Å; R66-L70 WeakPolarHBondContact O-CG 3.41Å; R66-L70 PolarHBondContact O-N 3.08Å; L70-H74 PolarHBondContact O-N 2.83Å; L70-H74 VanDerWaalsContact O-N 3.13Å
71	K	79.8	Confident	78.9	Confident	141 Å²	141	87.8 Å²	87.8	61%	0.613	42%	0.416	S	S	*	.	H	α-helix	trans	-66.8	-46.7	172.7	-173.7	178.7	178.2	178.9	0	111.3	K67 K68 L69 L73 H74 Q75	K67-K71 PolarHBondContact O-N 3.34Å; K67-K71 VanDerWaalsContact O-N 3.1Å; K68-K71 PolarHBondContact O-N 3.19Å; L69-K71 VanDerWaalsContact C-N 3.31Å; L69-K71 PolarHBondContact O-N 2.81Å; K71-L73 PolarHBondContact O-N 3.47Å; K71-H74 PolarHBondContact O-N 2.98Å; K71-Q75 WeakPolarHBondContact O-CG 3.39Å; K71-Q75 PolarHBondContact O-N 3.22Å
72	L	81.9	Confident	79.7	Confident	87 Å²	87	91.8 Å²	91.8	46%	0.455	43%	0.43	S	S	.	.	H	α-helix	trans	-61.4	-43.1	177.7	-71.7	168.2	0	0	0	112.1	K68 L69 H74 Q75 S76	K68-L72 HydrophobicContact CG-CD1 4.24Å; K68-L72 WeakPolarHBondContact O-CG 3.24Å; K68-L72 PolarHBondContact O-N 3.32Å; L69-L72 HydrophobicContact CD2-CD1 4.41Å; L69-L72 PolarHBondContact O-N 3.36Å; L72-H74 VanDerWaalsContact C-N 3.34Å; L72-H74 PolarHBondContact O-N 3.34Å; L72-Q75 PolarHBondContact O-N 2.7Å; L72-S76 PolarHBondContact O-N 3.18Å; L72-S76 PolarHBondContact O-OG 2.95Å
73	L	82.5	Confident	80.6	Confident	78 Å²	78	93.7 Å²	93.7	41%	0.408	44%	0.444	S	S	.	.	H	α-helix	trans	-58.5	-44.8	173.9	178.1	63.9	0	0	0	111.6	L69 K71 Q75 S76 E77	L69-L73 WeakPolarHBondContact O-CB 3.21Å; L69-L73 PolarHBondContact O-N 3.35Å; K71-L73 PolarHBondContact O-N 3.47Å; L73-Q75 VanDerWaalsContact C-N 3.34Å; L73-Q75 PolarHBondContact O-N 2.89Å; L73-S76 PolarHBondContact O-N 3.43Å; L73-S76 PolarHBondContact O-OG 3.38Å; L73-E77 HydrophobicContact CD1-CG 4.47Å; L73-E77 WeakPolarHBondContact O-CG 3.42Å; L73-E77 PolarHBondContact O-N 2.98Å
74	H	82.1	Confident	81.2	Confident	106 Å²	106	91 Å²	91	49%	0.491	43%	0.43	S	S	.	.	H	α-helix	trans	-64.4	-39.7	177.6	-173.4	30.6	0	0	0	112.3	L70 K71 L72 E78	L70-H74 PolarHBondContact O-N 2.83Å; L70-H74 VanDerWaalsContact O-N 3.13Å; K71-H74 PolarHBondContact O-N 2.98Å; L72-H74 VanDerWaalsContact C-N 3.34Å; L72-H74 PolarHBondContact O-N 3.34Å; H74-E78 WeakPolarHBondContact O-CB 3.3Å; H74-E78 PolarHBondContact O-N 3.47Å
75	Q	85.1	Confident	81.5	Confident	89 Å²	89	84.7 Å²	84.7	42%	0.416	41%	0.411	S	S	.	.	H	α-helix	trans	-66.6	-37.4	176.4	-70	176.4	-65.6	0	0	112.1	K71 L72 L73 T79	K71-Q75 WeakPolarHBondContact O-CG 3.39Å; K71-Q75 PolarHBondContact O-N 3.22Å; L72-Q75 PolarHBondContact O-N 2.7Å; L73-Q75 VanDerWaalsContact C-N 3.34Å; L73-Q75 PolarHBondContact O-N 2.89Å; Q75-T79 WeakPolarHBondContact O-CB 3.46Å; Q75-T79 PolarHBondContact O-N 2.88Å; Q75-T79 PolarHBondContact O-OG1 3.01Å
76	S	85.2	Confident	82	Confident	57 Å²	57	86.6 Å²	86.6	40%	0.399	42%	0.423	S	S	.	.	H	α-helix	trans	-69.5	-42.7	176	65.4	0	0	0	0	112.2	L72 L73 E78 T79 V80	L72-S76 PolarHBondContact O-N 3.18Å; L72-S76 PolarHBondContact O-OG 2.95Å; L73-S76 PolarHBondContact O-N 3.43Å; L73-S76 PolarHBondContact O-OG 3.38Å; S76-E78 VanDerWaalsContact C-N 3.34Å; S76-E78 PolarHBondContact O-N 3.39Å; S76-T79 PolarHBondContact O-N 3.15Å; S76-V80 WeakPolarHBondContact O-CG2 3.34Å; S76-V80 PolarHBondContact O-N 2.65Å
77	E	86.2	Confident	82.2	Confident	42 Å²	42	84.7 Å²	84.7	20%	0.196	42%	0.422	C	S	.	.	H	α-helix	trans	-59.6	-42.4	172.9	-70.9	178.6	128.1	0	0	112.3	L73 T79 H81 S141 R143	L73-E77 HydrophobicContact CD1-CG 4.47Å; L73-E77 WeakPolarHBondContact O-CG 3.42Å; L73-E77 PolarHBondContact O-N 2.98Å; E77-T79 VanDerWaalsContact C-N 3.34Å; E77-H81 WeakPolarHBondContact O-CB 3.42Å; E77-H81 PolarHBondContact O-N 2.9Å; E77-S141 WeakPolarHBondContact OE1-CB 3.42Å; E77-S141 PolarHBondContact OE1-OG 3.01Å; E77-R143 WeakPolarHBondContact OE1-CD 3.39Å; E77-R143 IonicContact OE2-CZ 3.88Å; E77-R143 IonicContact OE2-NE 3.69Å; E77-R143 IonicContact OE2-NH1 2.69Å; E77-R143 PolarHBondContact OE2-NH1 3.06Å
78	E	86.6	Confident	82.1	Confident	88 Å²	88	79.3 Å²	79.3	41%	0.411	40%	0.4	S	S	.	.	H	α-helix	trans	-65.9	-37.4	175.8	-161.7	-164	171.8	0	0	111.9	H74 S76 H81 K82	H74-E78 WeakPolarHBondContact O-CB 3.3Å; H74-E78 PolarHBondContact O-N 3.47Å; S76-E78 VanDerWaalsContact C-N 3.34Å; S76-E78 PolarHBondContact O-N 3.39Å; E78-H81 PolarHBondContact O-N 2.97Å; E78-K82 HydrophobicContact CG-CD 4.48Å; E78-K82 WeakPolarHBondContact O-CG 3.32Å; E78-K82 PolarHBondContact O-N 3.05Å; E78-K82 WeakPolarHBondContact OE1-CE 3.44Å; E78-K82 IonicContact OE1-NZ 3.12Å; E78-K82 PolarHBondContact OE1-NZ 2.99Å; E78-K82 IonicContact OE2-NZ 2.65Å
79	T	88.4	Confident	81.8	Confident	75 Å²	75	75 Å²	75	46%	0.46	39%	0.386	S	S	.	.	H	α-helix	trans	-68.6	-47.7	179	-59.1	0	0	0	0	111.1	Q75 S76 E77 H81 K82 C83	Q75-T79 WeakPolarHBondContact O-CB 3.46Å; Q75-T79 PolarHBondContact O-N 2.88Å; Q75-T79 PolarHBondContact O-OG1 3.01Å; S76-T79 PolarHBondContact O-N 3.15Å; E77-T79 VanDerWaalsContact C-N 3.34Å; T79-H81 VanDerWaalsContact C-N 3.29Å; T79-H81 PolarHBondContact O-N 3.11Å; T79-K82 PolarHBondContact O-N 2.9Å; T79-K82 VanDerWaalsContact O-N 3.15Å; T79-C83 PolarHBondContact O-N 3.44Å; T79-C83 PolarHBondContact O-SG 3.49Å; T79-C83 VanDerWaalsContact O-SG 3.34Å
80	V	86.6	Confident	81.4	Confident	62 Å²	62	76.9 Å²	76.9	38%	0.376	39%	0.391	S	S	.	.	H	α-helix	trans	-54.3	-48.5	173.1	168.3	0	0	0	0	110.2	S76 K82 C83 E84 F137	S76-V80 WeakPolarHBondContact O-CG2 3.34Å; S76-V80 PolarHBondContact O-N 2.65Å; V80-K82 VanDerWaalsContact C-N 3.35Å; V80-K82 PolarHBondContact O-N 2.83Å; V80-C83 PolarHBondContact O-N 3.18Å; V80-E84 WeakPolarHBondContact O-CB 3.4Å; V80-E84 PolarHBondContact O-N 2.57Å; V80-F137 HydrophobicContact CG1-CB 3.59Å
81	H	83.1	Confident	80.8	Confident	50 Å²	50	77 Å²	77	23%	0.231	39%	0.392	C	S	.	.	H	α-helix	trans	-62.2	-38.1	179.1	-172.3	72.6	0	0	0	113.3	E77 E78 T79 T85 R135 S138 Y144	E77-H81 WeakPolarHBondContact O-CB 3.42Å; E77-H81 PolarHBondContact O-N 2.9Å; E78-H81 PolarHBondContact O-N 2.97Å; T79-H81 VanDerWaalsContact C-N 3.29Å; T79-H81 PolarHBondContact O-N 3.11Å; H81-T85 WeakPolarHBondContact O-CB 3.48Å; H81-T85 PolarHBondContact O-N 3.25Å; H81-T85 PolarHBondContact O-OG1 3.23Å; H81-R135 PolarHBondContact CE1-NE 2.55Å; H81-R135 PolarHBondContact CE1-NH1 3.35Å; H81-R135 PolarHBondContact O-NH1 3.07Å; H81-S138 PolarHBondContact ND1-OG 2.91Å; H81-S138 VanDerWaalsContact ND1-OG 3.15Å; H81-Y144 AromaticContact CE1-CE2 3.6Å; H81-Y144 AromaticContact CE1-CZ 3.95Å; H81-Y144 AromaticContact ND1-CE2 3.46Å; H81-Y144 WeakPolarHBondContact ND1-CE2 3.43Å; H81-Y144 AromaticContact ND1-CZ 3.94Å
82	K	83.3	Confident	79.9	Confident	105 Å²	105	71.2 Å²	71.2	46%	0.457	37%	0.369	S	S	.	.	H	α-helix	trans	-66.5	-53.9	175	-75.9	169.4	-177.5	167.9	0	111.7	E78 T79 V80 E84 T85 E86	E78-K82 HydrophobicContact CG-CD 4.48Å; E78-K82 WeakPolarHBondContact O-CG 3.32Å; E78-K82 PolarHBondContact O-N 3.05Å; E78-K82 WeakPolarHBondContact OE1-CE 3.44Å; E78-K82 IonicContact OE1-NZ 3.12Å; E78-K82 PolarHBondContact OE1-NZ 2.99Å; E78-K82 IonicContact OE2-NZ 2.65Å; T79-K82 PolarHBondContact O-N 2.9Å; T79-K82 VanDerWaalsContact O-N 3.15Å; V80-K82 VanDerWaalsContact C-N 3.35Å; V80-K82 PolarHBondContact O-N 2.83Å; K82-E84 VanDerWaalsContact C-N 3.29Å; K82-E84 PolarHBondContact O-N 3.45Å; K82-T85 WeakPolarHBondContact O-CA 3.5Å; K82-T85 WeakPolarHBondContact O-CB 3.11Å; K82-T85 PolarHBondContact O-N 2.95Å; K82-E86 PolarHBondContact O-N 3.02Å
83	C	83.8	Confident	78.6	Confident	61 Å²	61	67.5 Å²	67.5	41%	0.412	35%	0.351	S	S	.	.	H	α-helix	trans	-58	-41.6	179	-64.8	0	0	0	0	111.8	T79 V80 E86 M87	T79-C83 PolarHBondContact O-N 3.44Å; T79-C83 PolarHBondContact O-SG 3.49Å; T79-C83 VanDerWaalsContact O-SG 3.34Å; V80-C83 PolarHBondContact O-N 3.18Å; C83-E86 PolarHBondContact O-N 3.39Å; C83-M87 WeakPolarHBondContact O-CB 3.35Å; C83-M87 WeakPolarHBondContact O-CG 3.41Å; C83-M87 PolarHBondContact O-N 2.84Å
84	E	82.9	Confident	77.3	Confident	11 Å²	11	65.8 Å²	65.8	5%	0.051	34%	0.342	C	S	.	.	H	α-helix	trans	-68.1	-35.5	176.1	-174.1	168.9	-131.5	0	0	112.6	V80 K82 M87 L88 R135 L136 F137 S138	V80-E84 WeakPolarHBondContact O-CB 3.4Å; V80-E84 PolarHBondContact O-N 2.57Å; K82-E84 VanDerWaalsContact C-N 3.29Å; K82-E84 PolarHBondContact O-N 3.45Å; E84-M87 PolarHBondContact O-N 3.3Å; E84-L88 HydrophobicContact CG-CD1 3.82Å; E84-L88 HydrophobicContact CG-CG 4.34Å; E84-L88 VanDerWaalsContact O-CB 3.32Å; E84-L88 WeakPolarHBondContact O-CB 3.21Å; E84-L88 VanDerWaalsContact O-CG 3.3Å; E84-L88 WeakPolarHBondContact O-CG 3.33Å; E84-L88 PolarHBondContact O-N 3.41Å; E84-R135 VanDerWaalsContact CD-C 3.49Å; E84-R135 HydrophobicContact CG-CB 4.4Å; E84-R135 HydrophobicContact CG-CG 4.34Å; E84-R135 WeakPolarHBondContact OE1-CA 3.42Å; E84-R135 VanDerWaalsContact OE2-CB 3.3Å; E84-R135 WeakPolarHBondContact OE2-CB 3.33Å; E84-L136 PolarHBondContact OE1-N 3.34Å; E84-F137 WeakPolarHBondContact OE1-CD2 3.36Å; E84-F137 PolarHBondContact OE1-N 2.84Å; E84-S138 VanDerWaalsContact OE2-CB 3.29Å; E84-S138 WeakPolarHBondContact OE2-CB 3.48Å; E84-S138 PolarHBondContact OE2-N 3.14Å; E84-S138 PolarHBondContact OE2-OG 2.89Å
85	T	79.2	Confident	75.9	Confident	43 Å²	43	70.2 Å²	70.2	26%	0.264	36%	0.36	S	S	.	.	H	α-helix	trans	-61.3	-46.8	171.3	-55.8	0	0	0	0	110.8	H81 K82 T89 V130 R135	H81-T85 WeakPolarHBondContact O-CB 3.48Å; H81-T85 PolarHBondContact O-N 3.25Å; H81-T85 PolarHBondContact O-OG1 3.23Å; K82-T85 WeakPolarHBondContact O-CA 3.5Å; K82-T85 WeakPolarHBondContact O-CB 3.11Å; K82-T85 PolarHBondContact O-N 2.95Å; T85-T89 VanDerWaalsContact O-CB 3.27Å; T85-T89 WeakPolarHBondContact O-CB 3.3Å; T85-T89 PolarHBondContact O-N 3.49Å; T85-T89 PolarHBondContact O-OG1 3.42Å; T85-V130 HydrophobicContact CG2-CG2 4.23Å; T85-R135 VanDerWaalsContact OG1-CZ 3.31Å; T85-R135 PolarHBondContact OG1-NH1 3.26Å; T85-R135 PolarHBondContact OG1-NH2 3.03Å
86	E	80.5	Confident	74.1	Confident	103 Å²	103	72 Å²	72	48%	0.481	37%	0.367	S	S	.	.	H	α-helix	trans	-62.3	-47.8	177	-76	-171.5	-135.1	0	0	112.2	K82 C83 T89 K90	K82-E86 PolarHBondContact O-N 3.02Å; C83-E86 PolarHBondContact O-N 3.39Å; E86-T89 PolarHBondContact O-N 2.86Å; E86-K90 WeakPolarHBondContact O-CB 3.46Å; E86-K90 WeakPolarHBondContact O-CD 3.39Å; E86-K90 WeakPolarHBondContact O-CG 3.38Å; E86-K90 PolarHBondContact O-N 2.95Å; E86-K90 IonicContact OE2-NZ 3.55Å; E86-K90 PolarHBondContact OE2-NZ 3.06Å
87	M	79.4	Confident	71.8	Confident	116 Å²	116	72.4 Å²	72.4	57%	0.571	38%	0.38	S	S	*	.	H	α-helix	trans	-60.3	-49.5	178.8	-74.2	-179.8	179.3	0	0	111.4	C83 E84 T89 K90 L91	C83-M87 WeakPolarHBondContact O-CB 3.35Å; C83-M87 WeakPolarHBondContact O-CG 3.41Å; C83-M87 PolarHBondContact O-N 2.84Å; E84-M87 PolarHBondContact O-N 3.3Å; M87-T89 VanDerWaalsContact C-N 3.32Å; M87-T89 PolarHBondContact O-N 2.9Å; M87-K90 PolarHBondContact O-N 2.88Å; M87-L91 WeakPolarHBondContact O-CB 3.27Å; M87-L91 WeakPolarHBondContact O-CG 3.39Å; M87-L91 PolarHBondContact O-N 3.25Å
88	L	73.1	Confident	69.7	Low	34 Å²	34	74 Å²	74	18%	0.178	39%	0.388	C	S	.	.	H	α-helix	trans	-65.6	-34	179.2	-69.9	170.7	0	0	0	112.4	E84 S92 V130 K134 R135	E84-L88 HydrophobicContact CG-CD1 3.82Å; E84-L88 HydrophobicContact CG-CG 4.34Å; E84-L88 VanDerWaalsContact O-CB 3.32Å; E84-L88 WeakPolarHBondContact O-CB 3.21Å; E84-L88 VanDerWaalsContact O-CG 3.3Å; E84-L88 WeakPolarHBondContact O-CG 3.33Å; E84-L88 PolarHBondContact O-N 3.41Å; L88-S92 WeakPolarHBondContact O-CB 3.39Å; L88-S92 PolarHBondContact O-N 2.97Å; L88-V130 HydrophobicContact CB-CG1 3.72Å; L88-V130 HydrophobicContact CB-CG2 4.16Å; L88-V130 HydrophobicContact CD1-CG1 3.51Å; L88-V130 HydrophobicContact CG-CG1 4.26Å; L88-K134 HydrophobicContact CD1-CB 4.24Å; L88-K134 HydrophobicContact CD2-CB 4.2Å; L88-R135 HydrophobicContact CD1-CG 3.76Å
89	T	70.1	Confident	67.4	Low	57 Å²	57	73.6 Å²	73.6	35%	0.35	39%	0.391	S	S	.	.	H	α-helix	trans	-67.3	-47.4	173.7	-55.8	0	0	0	0	111	T85 E86 M87 S92 G93 V130	T85-T89 VanDerWaalsContact O-CB 3.27Å; T85-T89 WeakPolarHBondContact O-CB 3.3Å; T85-T89 PolarHBondContact O-N 3.49Å; T85-T89 PolarHBondContact O-OG1 3.42Å; E86-T89 PolarHBondContact O-N 2.86Å; M87-T89 VanDerWaalsContact C-N 3.32Å; M87-T89 PolarHBondContact O-N 2.9Å; T89-S92 WeakPolarHBondContact O-CB 3.32Å; T89-S92 PolarHBondContact O-N 3.34Å; T89-S92 PolarHBondContact O-OG 2.69Å; T89-G93 PolarHBondContact O-N 2.64Å; T89-V130 WeakPolarHBondContact OG1-CG2 3.18Å
90	K	70.5	Confident	65.2	Low	121 Å²	121	73.7 Å²	73.7	53%	0.526	39%	0.394	S	S	.	.	H	α-helix	trans	-58.5	-51	175.5	-71.2	162.1	-172.1	165.8	0	110.8	E86 M87 S92 G93 I94	E86-K90 WeakPolarHBondContact O-CB 3.46Å; E86-K90 WeakPolarHBondContact O-CD 3.39Å; E86-K90 WeakPolarHBondContact O-CG 3.38Å; E86-K90 PolarHBondContact O-N 2.95Å; E86-K90 IonicContact OE2-NZ 3.55Å; E86-K90 PolarHBondContact OE2-NZ 3.06Å; M87-K90 PolarHBondContact O-N 2.88Å; K90-S92 VanDerWaalsContact C-N 3.26Å; K90-S92 PolarHBondContact O-N 3.48Å; K90-G93 WeakPolarHBondContact O-CA 3.23Å; K90-G93 PolarHBondContact O-N 3.33Å; K90-I94 PolarHBondContact O-N 2.95Å; K90-I94 VanDerWaalsContact O-N 3.13Å
91	L	66.2	Low	63.2	Low	91 Å²	91	79.3 Å²	79.3	48%	0.476	41%	0.414	S	S	.	.	H	α-helix	trans	-58.2	-32.6	175.5	-70.8	173.4	0	0	0	113.3	M87 G93 I94 K95	M87-L91 WeakPolarHBondContact O-CB 3.27Å; M87-L91 WeakPolarHBondContact O-CG 3.39Å; M87-L91 PolarHBondContact O-N 3.25Å; L91-G93 VanDerWaalsContact C-N 3.33Å; L91-I94 HydrophobicContact CD2-CD1 3.98Å; L91-I94 WeakPolarHBondContact O-CB 3.49Å; L91-I94 PolarHBondContact O-N 3.32Å; L91-K95 PolarHBondContact O-N 2.98Å
92	S	60.4	Low	61.1	Low	20 Å²	20	82.8 Å²	82.8	14%	0.14	43%	0.43	C	S	.	.	H	α-helix	trans	-69.1	-31.5	173.9	83.5	0	0	0	0	112.9	L88 T89 K90 K96 F128	L88-S92 WeakPolarHBondContact O-CB 3.39Å; L88-S92 PolarHBondContact O-N 2.97Å; T89-S92 WeakPolarHBondContact O-CB 3.32Å; T89-S92 PolarHBondContact O-N 3.34Å; T89-S92 PolarHBondContact O-OG 2.69Å; K90-S92 VanDerWaalsContact C-N 3.26Å; K90-S92 PolarHBondContact O-N 3.48Å; S92-K96 WeakPolarHBondContact O-CG 3.4Å; S92-K96 PolarHBondContact O-N 3.4Å; S92-F128 VanDerWaalsContact CB-CE1 3.46Å; S92-F128 WeakPolarHBondContact OG-CE1 3.28Å; S92-F128 WeakPolarHBondContact OG-CZ 3.36Å
93	G	55.9	Low	59	Low	8 Å²	8	83 Å²	83	8%	0.082	44%	0.443	C	S	.	.	H	α-helix	trans	-64.4	-41.8	168.8	0	0	0	0	0	111.3	T89 K90 L91 K95 K96 G97 M98	T89-G93 PolarHBondContact O-N 2.64Å; K90-G93 WeakPolarHBondContact O-CA 3.23Å; K90-G93 PolarHBondContact O-N 3.33Å; L91-G93 VanDerWaalsContact C-N 3.33Å; G93-K95 PolarHBondContact O-N 2.91Å; G93-K96 CarbonylContact O-C 3.31Å; G93-K96 WeakPolarHBondContact O-CA 3.3Å; G93-K96 PolarHBondContact O-N 2.84Å; G93-G97 PolarHBondContact O-N 3.44Å; G93-M98 WeakPolarHBondContact O-CB 3.47Å; G93-M98 PolarHBondContact O-N 3.34Å; G93-M98 VanDerWaalsContact O-N 3.09Å
94	I	54.6	Low	57	Low	42 Å²	42	82.7 Å²	82.7	22%	0.215	44%	0.441	C	S	.	.	H	α-helix	trans	-58.9	-48.6	175.2	-48.3	-170.5	0	0	0	111.1	K90 L91 K96 G97 M98 C100 F101	K90-I94 PolarHBondContact O-N 2.95Å; K90-I94 VanDerWaalsContact O-N 3.13Å; L91-I94 HydrophobicContact CD2-CD1 3.98Å; L91-I94 WeakPolarHBondContact O-CB 3.49Å; L91-I94 PolarHBondContact O-N 3.32Å; I94-K96 PolarHBondContact O-N 2.64Å; I94-K96 VanDerWaalsContact O-N 3.08Å; I94-G97 PolarHBondContact O-N 3.36Å; I94-M98 VanDerWaalsContact CA-O 3.25Å; I94-M98 WeakPolarHBondContact CA-O 3.2Å; I94-M98 WeakPolarHBondContact CG1-O 3.36Å; I94-C100 HydrophobicContact CD1-CB 3.71Å; I94-C100 HydrophobicContact CG1-CB 4.2Å; I94-F101 HydrophobicContact CD1-CD2 4.25Å; I94-F101 HydrophobicContact CD1-CE2 4.02Å
95	K	52.6	Low	55.6	Low	199 Å²	199	90.3 Å²	90.3	87%	0.865	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-3.2	176.6	-68.1	-165.6	174.1	-169.3	0	114.8	L91 G93	L91-K95 PolarHBondContact O-N 2.98Å; G93-K95 PolarHBondContact O-N 2.91Å
96	K	47.8	Very low	54.3	Low	128 Å²	128	95.4 Å²	95.4	56%	0.557	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	13.1	168.1	-69.4	-179.2	-176.9	-177.7	0	113.2	S92 G93 I94	S92-K96 WeakPolarHBondContact O-CG 3.4Å; S92-K96 PolarHBondContact O-N 3.4Å; G93-K96 CarbonylContact O-C 3.31Å; G93-K96 WeakPolarHBondContact O-CA 3.3Å; G93-K96 PolarHBondContact O-N 2.84Å; I94-K96 PolarHBondContact O-N 2.64Å; I94-K96 VanDerWaalsContact O-N 3.08Å
97	G	36.3	Very low	52.8	Low	65 Å²	65	97.7 Å²	97.7	67%	0.67	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.6	13.7	174.3	0	0	0	0	0	116.2	G93 I94	G93-G97 PolarHBondContact O-N 3.44Å; I94-G97 PolarHBondContact O-N 3.36Å
98	M	42.2	Very low	51.2	Low	76 Å²	76	99.2 Å²	99.2	37%	0.374	51%	0.514	S	S	.	.			trans	-95.9	83	171.4	-66.3	-179.9	58.2	0	0	111.5	G93 I94 C100 I122	G93-M98 WeakPolarHBondContact O-CB 3.47Å; G93-M98 PolarHBondContact O-N 3.34Å; G93-M98 VanDerWaalsContact O-N 3.09Å; I94-M98 VanDerWaalsContact CA-O 3.25Å; I94-M98 WeakPolarHBondContact CA-O 3.2Å; I94-M98 WeakPolarHBondContact CG1-O 3.36Å; M98-C100 PolarHBondContact O-N 3.48Å; M98-I122 HydrophobicContact CE-CD1 3.56Å; M98-I122 HydrophobicContact CE-CG1 4.33Å; M98-I122 HydrophobicContact SD-CD1 4.04Å; M98-I122 HydrophobicContact SD-CG1 4.18Å; M98-I122 HydrophobicContact SD-CG2 4.43Å
99	T	39.5	Very low	49.9	Very low	78 Å²	78	104.4 Å²	104.4	48%	0.479	54%	0.537	S	S	.	.			trans	-64.7	101.8	177.5	41	0	0	0	0	111.6	F101 E102	T99-F101 VanDerWaalsContact C-N 3.26Å; T99-F101 PolarHBondContact O-N 3Å; T99-E102 WeakPolarHBondContact CB-OE2 3.46Å; T99-E102 WeakPolarHBondContact CG2-OE2 3.46Å; T99-E102 PolarHBondContact OG1-OE2 3.15Å
100	C	41.1	Very low	48.7	Very low	77 Å²	77	107.1 Å²	107.1	52%	0.52	56%	0.555	S	S	.	*	S	Bend	trans	-81.1	1	178.3	-63.8	0	0	0	0	114.4	I94 M98	I94-C100 HydrophobicContact CD1-CB 3.71Å; I94-C100 HydrophobicContact CG1-CB 4.2Å; M98-C100 PolarHBondContact O-N 3.48Å
101	F	44.9	Very low	47.8	Very low	181 Å²	181	106.2 Å²	106.2	79%	0.794	56%	0.564	S	S	*	*	S	Bend	trans	-125.5	2.6	-174.8	-66.2	-74.7	0	0	0	113.5	I94 T99	I94-F101 HydrophobicContact CD1-CD2 4.25Å; I94-F101 HydrophobicContact CD1-CE2 4.02Å; T99-F101 VanDerWaalsContact C-N 3.26Å; T99-F101 PolarHBondContact O-N 3Å
102	E	38.7	Very low	47.1	Very low	123 Å²	123	105.9 Å²	105.9	58%	0.575	57%	0.566	S	S	*	*	S	Bend	trans	-103.8	121.5	164.4	-70.7	175.6	135.7	0	0	108.2	T99 S104	T99-E102 WeakPolarHBondContact CB-OE2 3.46Å; T99-E102 WeakPolarHBondContact CG2-OE2 3.46Å; T99-E102 PolarHBondContact OG1-OE2 3.15Å; E102-S104 VanDerWaalsContact C-N 3.29Å; E102-S104 PolarHBondContact O-N 2.94Å
103	P	38.8	Very low	46.8	Very low	110 Å²	110	109.4 Å²	109.4	71%	0.714	59%	0.591	S	S	*	*			trans	-72.4	88.8	167.5	30.6	-32	0	0	0	108.5	E105	P103-E105 PolarHBondContact O-N 3Å
104	S	42.7	Very low	46.5	Very low	54 Å²	54	119 Å²	119	38%	0.378	62%	0.624	S	S	.	*			trans	-56.4	130.4	172	176	0	0	0	0	109.9	E102 E106 Q107	E102-S104 VanDerWaalsContact C-N 3.29Å; E102-S104 PolarHBondContact O-N 2.94Å; S104-E106 PolarHBondContact O-N 2.94Å; S104-E106 VanDerWaalsContact O-N 3.12Å; S104-Q107 WeakPolarHBondContact O-CB 3.41Å; S104-Q107 PolarHBondContact O-N 2.92Å
105	E	52.5	Low	46.1	Very low	171 Å²	171	118.7 Å²	118.7	80%	0.799	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-57.9	-27.8	-179.8	-60.3	179.5	153.2	0	0	112	P103 Q107 Q108	P103-E105 PolarHBondContact O-N 3Å; E105-Q107 PolarHBondContact O-N 2.74Å; E105-Q107 VanDerWaalsContact O-N 3.13Å; E105-Q108 PolarHBondContact O-N 3.28Å
106	E	51.8	Low	45.8	Very low	150 Å²	150	114.8 Å²	114.8	70%	0.701	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-58.8	-22.6	172.3	-65.2	-160.1	148.9	0	0	113.6	S104 K118	S104-E106 PolarHBondContact O-N 2.94Å; S104-E106 VanDerWaalsContact O-N 3.12Å; E106-K118 IonicContact OE2-NZ 3.91Å
107	Q	50.5	Low	45.8	Very low	150 Å²	150	117.6 Å²	117.6	70%	0.701	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-81.4	-12.8	-178.9	-65.4	-168.3	-1.1	0	0	114	S104 E105 H109	S104-Q107 WeakPolarHBondContact O-CB 3.41Å; S104-Q107 PolarHBondContact O-N 2.92Å; E105-Q107 PolarHBondContact O-N 2.74Å; E105-Q107 VanDerWaalsContact O-N 3.13Å; Q107-H109 VanDerWaalsContact C-N 3.27Å; Q107-H109 PolarHBondContact O-N 3.4Å
108	Q	45.4	Very low	46.2	Very low	148 Å²	148	121.4 Å²	121.4	69%	0.692	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-77.9	-10.5	180	-62.8	-170.7	1.4	0	0	113.5	E105 P110	E105-Q108 PolarHBondContact O-N 3.28Å; Q108-P110 WeakPolarHBondContact O-CD 3.33Å
109	H	46.5	Very low	46.2	Very low	144 Å²	144	122.3 Å²	122.3	67%	0.667	64%	0.637	S	S	*	*			trans	-123.4	80.1	176	-70.9	-52.7	0	0	0	113.1	Q107 S111	Q107-H109 VanDerWaalsContact C-N 3.27Å; Q107-H109 PolarHBondContact O-N 3.4Å; H109-S111 PolarHBondContact O-N 3.04Å
110	P	44.3	Very low	46.3	Very low	114 Å²	114	126.2 Å²	126.2	74%	0.74	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	12.6	177.4	30.5	-36.8	0	0	0	114.8	Q108 T112	Q108-P110 WeakPolarHBondContact O-CD 3.33Å; P110-T112 PolarHBondContact O-N 3.34Å
111	S	52.3	Low	46.4	Very low	101 Å²	101	127.4 Å²	127.4	71%	0.706	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-8.7	-169.9	54.1	0	0	0	0	115.5	H109	H109-S111 PolarHBondContact O-N 3.04Å
112	T	50.6	Low	46.3	Very low	85 Å²	85	122.4 Å²	122.4	52%	0.521	63%	0.633	S	S	.	*			trans	-101.1	130.7	-176.8	69.9	0	0	0	0	113.5	P110 R114 G115	P110-T112 PolarHBondContact O-N 3.34Å; T112-R114 PolarHBondContact O-N 3.3Å; T112-G115 PolarHBondContact O-N 2.99Å
113	S	54.8	Low	46.4	Very low	93 Å²	93	121.7 Å²	121.7	65%	0.65	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-8.1	-178	63.7	0	0	0	0	115
114	R	48.9	Very low	46.4	Very low	210 Å²	210	124.6 Å²	124.6	79%	0.792	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-35.9	170.2	-81.5	-179.4	166.3	170.1	-4.1	112.9	T112 L116 R117	T112-R114 PolarHBondContact O-N 3.3Å; R114-L116 PolarHBondContact O-N 2.97Å; R114-R117 PolarHBondContact O-N 3.48Å; R114-R117 VanDerWaalsContact O-N 3.11Å
115	G	46.9	Very low	46.3	Very low	35 Å²	35	126.4 Å²	126.4	36%	0.361	65%	0.648	S	S	.	*	H	α-helix	trans	-60.7	-46.4	-179.4	0	0	0	0	0	112.4	T112 R117 K118	T112-G115 PolarHBondContact O-N 2.99Å; G115-R117 PolarHBondContact O-N 2.91Å; G115-K118 PolarHBondContact O-N 3.4Å; G115-K118 VanDerWaalsContact O-N 3.08Å
116	L	45.4	Very low	45.7	Very low	117 Å²	117	128.1 Å²	128.1	61%	0.613	65%	0.653	S	S	*	*	H	α-helix	trans	-58.8	-19.1	175.5	-77.7	161.9	0	0	0	114.5	R114	R114-L116 PolarHBondContact O-N 2.97Å
117	R	47.7	Very low	45	Very low	188 Å²	188	124.3 Å²	124.3	71%	0.709	65%	0.654	S	S	*	*	H	α-helix	trans	-82.7	-36.7	175	-63	-172.9	-174.5	-155.4	0.2	112.5	R114 G115 C119 K120	R114-R117 PolarHBondContact O-N 3.48Å; R114-R117 VanDerWaalsContact O-N 3.11Å; G115-R117 PolarHBondContact O-N 2.91Å; R117-C119 VanDerWaalsContact C-N 3.34Å; R117-C119 PolarHBondContact O-N 2.97Å; R117-K120 PolarHBondContact O-N 3.23Å
118	K	44.6	Very low	44.7	Very low	144 Å²	144	121.2 Å²	121.2	63%	0.626	64%	0.638	S	S	*	*	H	α-helix	trans	-64	-35.6	177.5	-72.5	-175	179.9	176.7	0	112.5	E106 G115 T121	E106-K118 IonicContact OE2-NZ 3.91Å; G115-K118 PolarHBondContact O-N 3.4Å; G115-K118 VanDerWaalsContact O-N 3.08Å; K118-T121 PolarHBondContact O-OG1 3.13Å; K118-T121 VanDerWaalsContact O-OG1 3.07Å
119	C	42.5	Very low	45.2	Very low	95 Å²	95	123.2 Å²	123.2	64%	0.642	65%	0.645	S	S	*	*	H	α-helix	trans	-71.1	-31.3	178.8	-68	0	0	0	0	113.3	R117	R117-C119 VanDerWaalsContact C-N 3.34Å; R117-C119 PolarHBondContact O-N 2.97Å
120	K	40.9	Very low	45.8	Very low	161 Å²	161	117.2 Å²	117.2	70%	0.7	62%	0.618	S	S	*	*	H	α-helix	trans	-76.7	-26.6	-176.1	-71.9	-174	177.3	-172.5	0	113.8	R117 I122 S123	R117-K120 PolarHBondContact O-N 3.23Å; K120-I122 VanDerWaalsContact C-N 3.31Å; K120-I122 PolarHBondContact O-N 2.9Å; K120-S123 WeakPolarHBondContact O-CB 3.38Å; K120-S123 PolarHBondContact O-N 2.64Å
121	T	43.2	Very low	47	Very low	102 Å²	102	115 Å²	115	63%	0.626	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-72.7	-18	-179.2	39.7	0	0	0	0	114.4	K118 S123 Q124	K118-T121 PolarHBondContact O-OG1 3.13Å; K118-T121 VanDerWaalsContact O-OG1 3.07Å; T121-S123 PolarHBondContact O-N 3.45Å; T121-Q124 PolarHBondContact O-N 3.18Å
122	I	43.6	Very low	47.8	Very low	76 Å²	76	113.3 Å²	113.3	39%	0.39	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-63.8	-27.4	175	-63	153.3	0	0	0	111.3	M98 K120 Q124 Q125	M98-I122 HydrophobicContact CE-CD1 3.56Å; M98-I122 HydrophobicContact CE-CG1 4.33Å; M98-I122 HydrophobicContact SD-CD1 4.04Å; M98-I122 HydrophobicContact SD-CG1 4.18Å; M98-I122 HydrophobicContact SD-CG2 4.43Å; K120-I122 VanDerWaalsContact C-N 3.31Å; K120-I122 PolarHBondContact O-N 2.9Å; I122-Q124 PolarHBondContact O-N 3.12Å; I122-Q125 PolarHBondContact O-N 3.5Å
123	S	39.6	Very low	48.7	Very low	108 Å²	108	115.6 Å²	115.6	76%	0.755	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-63.7	-7.7	-179.4	-168.1	0	0	0	0	115.2	K120 T121	K120-S123 WeakPolarHBondContact O-CB 3.38Å; K120-S123 PolarHBondContact O-N 2.64Å; T121-S123 PolarHBondContact O-N 3.45Å
124	Q	39.8	Very low	49.5	Very low	171 Å²	171	117.3 Å²	117.3	80%	0.799	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-119.4	20.3	-176.1	-66.4	-170.3	-11.9	0	0	114.3	T121 I122 K126	T121-Q124 PolarHBondContact O-N 3.18Å; I122-Q124 PolarHBondContact O-N 3.12Å; Q124-K126 PolarHBondContact O-N 3.13Å
125	Q	41.5	Very low	50.7	Low	91 Å²	91	107.9 Å²	107.9	43%	0.425	55%	0.546	S	S	.	.			trans	-65.8	102.2	169.1	-71	-156.1	29.1	0	0	110.9	I122 G127	I122-Q125 PolarHBondContact O-N 3.5Å; Q125-G127 PolarHBondContact O-N 3.21Å
126	K	39.5	Very low	52.2	Low	208 Å²	208	112.6 Å²	112.6	90%	0.904	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.7	108.8	178.9	-68.3	179	177.4	178.8	0	111.8	Q124 F128	Q124-K126 PolarHBondContact O-N 3.13Å; K126-F128 PolarHBondContact O-N 3.41Å
127	G	36.8	Very low	53.8	Low	69 Å²	69	113.3 Å²	113.3	71%	0.711	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.4	58.4	160.9	0	0	0	0	0	115.9	Q125 K129	Q125-G127 PolarHBondContact O-N 3.21Å; G127-K129 VanDerWaalsContact C-N 3.35Å; G127-K129 PolarHBondContact O-N 2.88Å
128	F	44.1	Very low	55.5	Low	85 Å²	85	104.6 Å²	104.6	37%	0.373	53%	0.529	S	S	.	.			trans	-65.3	95.8	169	-172.2	-96	0	0	0	110.2	S92 K126 V130	S92-F128 VanDerWaalsContact CB-CE1 3.46Å; S92-F128 WeakPolarHBondContact OG-CE1 3.28Å; S92-F128 WeakPolarHBondContact OG-CZ 3.36Å; K126-F128 PolarHBondContact O-N 3.41Å; F128-V130 HydrophobicContact CD1-CG2 3.97Å; F128-V130 HydrophobicContact CE1-CG2 3.99Å; F128-V130 PolarHBondContact O-N 3.12Å
129	K	56.1	Low	57.1	Low	191 Å²	191	101.3 Å²	101.3	83%	0.83	51%	0.512	S	S	*	.			trans	-68.5	102	170.2	-71	-170.2	176.6	-174.2	0	108.6	G127 D131	G127-K129 VanDerWaalsContact C-N 3.35Å; G127-K129 PolarHBondContact O-N 2.88Å; K129-D131 PolarHBondContact O-N 2.94Å; K129-D131 VanDerWaalsContact O-N 3.14Å
130	V	59.8	Low	58.9	Low	17 Å²	17	101.7 Å²	101.7	10%	0.103	52%	0.516	C	S	.	.			trans	-56.5	116.3	163	174.4	0	0	0	0	107.3	T85 L88 T89 F128 D132 R135	T85-V130 HydrophobicContact CG2-CG2 4.23Å; L88-V130 HydrophobicContact CB-CG1 3.72Å; L88-V130 HydrophobicContact CB-CG2 4.16Å; L88-V130 HydrophobicContact CD1-CG1 3.51Å; L88-V130 HydrophobicContact CG-CG1 4.26Å; T89-V130 WeakPolarHBondContact OG1-CG2 3.18Å; F128-V130 HydrophobicContact CD1-CG2 3.97Å; F128-V130 HydrophobicContact CE1-CG2 3.99Å; F128-V130 PolarHBondContact O-N 3.12Å; V130-D132 PolarHBondContact O-N 3Å; V130-R135 HydrophobicContact CG1-CG 4.35Å
131	D	67.5	Low	60.9	Low	69 Å²	69	95.1 Å²	95.1	37%	0.369	49%	0.49	S	S	.	.			trans	-63.4	113.3	173.6	167.8	18.6	0	0	0	109.1	K129 K133 K134	K129-D131 PolarHBondContact O-N 2.94Å; K129-D131 VanDerWaalsContact O-N 3.14Å; D131-K133 PolarHBondContact O-N 3.26Å; D131-K133 VanDerWaalsContact O-N 3.11Å; D131-K133 WeakPolarHBondContact OD1-CB 3.25Å; D131-K133 PolarHBondContact OD1-N 3.13Å; D131-K134 HydrophobicContact CB-CD 4.25Å; D131-K134 HydrophobicContact CB-CG 4.25Å; D131-K134 WeakPolarHBondContact O-CB 3.46Å; D131-K134 PolarHBondContact O-N 3.29Å; D131-K134 IonicContact OD2-NZ 3.62Å; D131-K134 PolarHBondContact OD2-NZ 2.67Å
132	D	69	Low	62.6	Low	64 Å²	64	97 Å²	97	34%	0.342	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-58.5	-27.3	-176.6	-70.6	-37	0	0	0	111.9	V130 K134 R135 W139 Y144	V130-D132 PolarHBondContact O-N 3Å; D132-K134 PolarHBondContact O-N 2.85Å; D132-R135 VanDerWaalsContact O-CB 3.28Å; D132-R135 WeakPolarHBondContact O-CB 3.21Å; D132-R135 PolarHBondContact O-N 3.19Å; D132-R135 VanDerWaalsContact OD1-CD 3.23Å; D132-R135 WeakPolarHBondContact OD1-CD 3.39Å; D132-R135 IonicContact OD1-CZ 3.32Å; D132-R135 IonicContact OD1-NE 2.66Å; D132-R135 PolarHBondContact OD1-NE 2.68Å; D132-R135 IonicContact OD1-NH2 3.91Å; D132-W139 PolarHBondContact O-NE1 2.96Å; D132-Y144 PolarHBondContact OD1-OH 2.93Å
133	K	70.1	Confident	64.3	Low	133 Å²	133	99.3 Å²	99.3	58%	0.578	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-62.7	-10.6	175.3	-61.3	-175.8	179.1	-176.7	0	113.6	D131 T161	D131-K133 PolarHBondContact O-N 3.26Å; D131-K133 VanDerWaalsContact O-N 3.11Å; D131-K133 WeakPolarHBondContact OD1-CB 3.25Å; D131-K133 PolarHBondContact OD1-N 3.13Å; K133-T161 PolarHBondContact NZ-O 3.11Å
134	K	71.8	Confident	66.1	Low	130 Å²	130	95.4 Å²	95.4	57%	0.565	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-94.6	-2.1	175.2	-59.1	-176.3	174.1	72.7	0	114.2	L88 D131 D132 L136	L88-K134 HydrophobicContact CD1-CB 4.24Å; L88-K134 HydrophobicContact CD2-CB 4.2Å; D131-K134 HydrophobicContact CB-CD 4.25Å; D131-K134 HydrophobicContact CB-CG 4.25Å; D131-K134 WeakPolarHBondContact O-CB 3.46Å; D131-K134 PolarHBondContact O-N 3.29Å; D131-K134 IonicContact OD2-NZ 3.62Å; D131-K134 PolarHBondContact OD2-NZ 2.67Å; D132-K134 PolarHBondContact O-N 2.85Å; K134-L136 PolarHBondContact O-N 2.95Å; K134-L136 VanDerWaalsContact O-N 3.14Å
135	R	74.2	Confident	67.9	Low	12 Å²	12	91.2 Å²	91.2	5%	0.045	44%	0.443	C	S	.	.			trans	-87.6	63.4	-173.5	-67.2	-180	175.5	-81.9	10.3	113.8	H81 E84 T85 L88 V130 D132 F137 S138 W139 Y144	H81-R135 PolarHBondContact CE1-NE 2.55Å; H81-R135 PolarHBondContact CE1-NH1 3.35Å; H81-R135 PolarHBondContact O-NH1 3.07Å; E84-R135 VanDerWaalsContact CD-C 3.49Å; E84-R135 HydrophobicContact CG-CB 4.4Å; E84-R135 HydrophobicContact CG-CG 4.34Å; E84-R135 WeakPolarHBondContact OE1-CA 3.42Å; E84-R135 VanDerWaalsContact OE2-CB 3.3Å; E84-R135 WeakPolarHBondContact OE2-CB 3.33Å; T85-R135 VanDerWaalsContact OG1-CZ 3.31Å; T85-R135 PolarHBondContact OG1-NH1 3.26Å; T85-R135 PolarHBondContact OG1-NH2 3.03Å; L88-R135 HydrophobicContact CD1-CG 3.76Å; V130-R135 HydrophobicContact CG1-CG 4.35Å; D132-R135 VanDerWaalsContact O-CB 3.28Å; D132-R135 WeakPolarHBondContact O-CB 3.21Å; D132-R135 PolarHBondContact O-N 3.19Å; D132-R135 VanDerWaalsContact OD1-CD 3.23Å; D132-R135 WeakPolarHBondContact OD1-CD 3.39Å; D132-R135 IonicContact OD1-CZ 3.32Å; D132-R135 IonicContact OD1-NE 2.66Å; D132-R135 PolarHBondContact OD1-NE 2.68Å; D132-R135 IonicContact OD1-NH2 3.91Å; R135-F137 VanDerWaalsContact C-N 3.25Å; R135-F137 PolarHBondContact O-N 3.47Å; R135-S138 PolarHBondContact O-N 3.05Å; R135-S138 VanDerWaalsContact O-N 3.11Å; R135-W139 PolarHBondContact O-N 3.19Å; R135-Y144 WeakPolarHBondContact CD-OH 3.43Å
136	L	78.7	Confident	69.7	Low	133 Å²	133	92 Å²	92	70%	0.696	45%	0.445	S	S	*	.	H	α-helix	trans	-50.9	-40.7	-173.5	-175.6	62.2	0	0	0	113.8	E84 K134 S140	E84-L136 PolarHBondContact OE1-N 3.34Å; K134-L136 PolarHBondContact O-N 2.95Å; K134-L136 VanDerWaalsContact O-N 3.14Å; L136-S140 PolarHBondContact O-N 2.89Å
137	F	79.8	Confident	71.6	Confident	133 Å²	133	89 Å²	89	58%	0.583	43%	0.432	S	S	*	.	H	α-helix	trans	-77.9	-33.8	-179.4	-58.9	-72.7	0	0	0	112.7	V80 E84 R135 S140	V80-F137 HydrophobicContact CG1-CB 3.59Å; E84-F137 WeakPolarHBondContact OE1-CD2 3.36Å; E84-F137 PolarHBondContact OE1-N 2.84Å; R135-F137 VanDerWaalsContact C-N 3.25Å; R135-F137 PolarHBondContact O-N 3.47Å; F137-S140 PolarHBondContact O-OG 3.25Å
138	S	81.5	Confident	73.5	Confident	5 Å²	5	86.7 Å²	86.7	4%	0.035	40%	0.404	C	S	.	.	H	α-helix	trans	-65.3	-43.7	169.8	-55.8	0	0	0	0	110.7	H81 E84 R135 S140 S141 Y144	H81-S138 PolarHBondContact ND1-OG 2.91Å; H81-S138 VanDerWaalsContact ND1-OG 3.15Å; E84-S138 VanDerWaalsContact OE2-CB 3.29Å; E84-S138 WeakPolarHBondContact OE2-CB 3.48Å; E84-S138 PolarHBondContact OE2-N 3.14Å; E84-S138 PolarHBondContact OE2-OG 2.89Å; R135-S138 PolarHBondContact O-N 3.05Å; R135-S138 VanDerWaalsContact O-N 3.11Å; S138-S140 VanDerWaalsContact C-N 3.27Å; S138-S140 PolarHBondContact O-N 3.08Å; S138-S141 PolarHBondContact O-N 2.97Å; S138-Y144 VanDerWaalsContact CB-CD1 3.44Å; S138-Y144 VanDerWaalsContact O-CB 3.24Å; S138-Y144 WeakPolarHBondContact O-CB 3.39Å; S138-Y144 VanDerWaalsContact O-CD1 3.3Å; S138-Y144 WeakPolarHBondContact O-CD1 3.47Å
139	W	78.9	Confident	75	Confident	75 Å²	75	84.9 Å²	84.9	28%	0.284	40%	0.397	S	S	.	.	H	α-helix	trans	-65.4	-20.6	-178.5	-78.9	109.4	0	0	0	114.8	D132 R135 S141 Y144 H145 V148	D132-W139 PolarHBondContact O-NE1 2.96Å; R135-W139 PolarHBondContact O-N 3.19Å; W139-S141 PolarHBondContact O-N 2.69Å; W139-Y144 HydrophobicContact CD2-CD1 4.48Å; W139-Y144 HydrophobicContact CD2-CE1 4.35Å; W139-Y144 HydrophobicContact CG-CE1 4.5Å; W139-H145 HydrophobicContact CE3-CB 3.99Å; W139-H145 AromaticContact CE3-CD2 3.65Å; W139-H145 AromaticContact CE3-CG 3.93Å; W139-H145 HydrophobicContact CZ3-CB 3.95Å; W139-H145 AromaticContact CZ3-CD2 3.48Å; W139-H145 VanDerWaalsContact CZ3-CD2 3.48Å; W139-H145 WeakPolarHBondContact CZ3-CD2 3.35Å; W139-H145 AromaticContact CZ3-CG 3.58Å; W139-H145 AromaticContact CZ3-NE2 3.95Å; W139-V148 HydrophobicContact CH2-CB 4.05Å; W139-V148 HydrophobicContact CH2-CG1 3.82Å; W139-V148 HydrophobicContact CH2-CG2 4.49Å; W139-V148 HydrophobicContact CZ2-CB 4.46Å; W139-V148 HydrophobicContact CZ2-CG1 4.04Å
140	S	81	Confident	75.8	Confident	102 Å²	102	80 Å²	80	71%	0.713	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-13.1	171.8	58.5	0	0	0	0	113.5	L136 F137 S138	L136-S140 PolarHBondContact O-N 2.89Å; F137-S140 PolarHBondContact O-OG 3.25Å; S138-S140 VanDerWaalsContact C-N 3.27Å; S138-S140 PolarHBondContact O-N 3.08Å
141	S	81.6	Confident	76.5	Confident	23 Å²	23	82 Å²	82	16%	0.161	40%	0.398	C	S	.	.			trans	-87.8	119.7	166	173.7	0	0	0	0	111.6	E77 S138 W139 R143 Y144 H145	E77-S141 WeakPolarHBondContact OE1-CB 3.42Å; E77-S141 PolarHBondContact OE1-OG 3.01Å; S138-S141 PolarHBondContact O-N 2.97Å; W139-S141 PolarHBondContact O-N 2.69Å; S141-R143 PolarHBondContact O-N 3.11Å; S141-R143 WeakPolarHBondContact OG-CB 3.27Å; S141-R143 PolarHBondContact OG-N 3.18Å; S141-Y144 WeakPolarHBondContact O-CB 3.46Å; S141-Y144 PolarHBondContact O-N 3.1Å; S141-Y144 VanDerWaalsContact O-N 3.07Å; S141-Y144 PolarHBondContact OG-N 3.41Å; S141-H145 PolarHBondContact O-N 3.08Å
142	F	80	Confident	76.6	Confident	143 Å²	143	80.7 Å²	80.7	63%	0.627	39%	0.391	S	S	*	.	H	α-helix	trans	-58.3	-30.3	167.6	-179.5	-102.3	0	0	0	112.7	H145 K146	F142-H145 PolarHBondContact O-N 3.32Å; F142-K146 WeakPolarHBondContact O-CB 3.44Å; F142-K146 PolarHBondContact O-N 3.14Å
143	R	78.9	Confident	76.7	Confident	124 Å²	124	83 Å²	83	47%	0.468	40%	0.398	S	S	.	.	H	α-helix	trans	-67.6	-38.7	175.4	-54.7	178.8	70.2	-158.5	8.8	110.9	E77 S141 K147	E77-R143 WeakPolarHBondContact OE1-CD 3.39Å; E77-R143 IonicContact OE2-CZ 3.88Å; E77-R143 IonicContact OE2-NE 3.69Å; E77-R143 IonicContact OE2-NH1 2.69Å; E77-R143 PolarHBondContact OE2-NH1 3.06Å; S141-R143 PolarHBondContact O-N 3.11Å; S141-R143 WeakPolarHBondContact OG-CB 3.27Å; S141-R143 PolarHBondContact OG-N 3.18Å; R143-K147 WeakPolarHBondContact O-CB 3.2Å; R143-K147 PolarHBondContact O-N 2.92Å
144	Y	77.8	Confident	76.8	Confident	25 Å²	25	81.1 Å²	81.1	10%	0.098	41%	0.407	C	S	.	.	H	α-helix	trans	-69.2	-45.6	174.6	-179.1	-97	0	0	0	111.7	H81 D132 R135 S138 W139 S141 K146 K147 V148	H81-Y144 AromaticContact CE1-CE2 3.6Å; H81-Y144 AromaticContact CE1-CZ 3.95Å; H81-Y144 AromaticContact ND1-CE2 3.46Å; H81-Y144 WeakPolarHBondContact ND1-CE2 3.43Å; H81-Y144 AromaticContact ND1-CZ 3.94Å; D132-Y144 PolarHBondContact OD1-OH 2.93Å; R135-Y144 WeakPolarHBondContact CD-OH 3.43Å; S138-Y144 VanDerWaalsContact CB-CD1 3.44Å; S138-Y144 VanDerWaalsContact O-CB 3.24Å; S138-Y144 WeakPolarHBondContact O-CB 3.39Å; S138-Y144 VanDerWaalsContact O-CD1 3.3Å; S138-Y144 WeakPolarHBondContact O-CD1 3.47Å; W139-Y144 HydrophobicContact CD2-CD1 4.48Å; W139-Y144 HydrophobicContact CD2-CE1 4.35Å; W139-Y144 HydrophobicContact CG-CE1 4.5Å; S141-Y144 WeakPolarHBondContact O-CB 3.46Å; S141-Y144 PolarHBondContact O-N 3.1Å; S141-Y144 VanDerWaalsContact O-N 3.07Å; S141-Y144 PolarHBondContact OG-N 3.41Å; Y144-K146 VanDerWaalsContact C-N 3.32Å; Y144-K146 PolarHBondContact O-N 3.11Å; Y144-K147 WeakPolarHBondContact O-CA 3.4Å; Y144-K147 WeakPolarHBondContact O-CB 3.26Å; Y144-K147 PolarHBondContact O-N 3.47Å; Y144-V148 HydrophobicContact CD1-CG2 4.09Å; Y144-V148 HydrophobicContact CE1-CG2 3.55Å; Y144-V148 HydrophobicContact CE2-CG2 4.04Å; Y144-V148 VanDerWaalsContact CZ-CG2 3.49Å; Y144-V148 PolarHBondContact O-N 2.62Å
145	H	76.4	Confident	76.7	Confident	84 Å²	84	78.1 Å²	78.1	39%	0.389	41%	0.406	S	S	.	.	H	α-helix	trans	-50.7	-52.2	173.8	-174.1	-54.3	0	0	0	111.2	W139 S141 F142 K147 V148 E149	W139-H145 HydrophobicContact CE3-CB 3.99Å; W139-H145 AromaticContact CE3-CD2 3.65Å; W139-H145 AromaticContact CE3-CG 3.93Å; W139-H145 HydrophobicContact CZ3-CB 3.95Å; W139-H145 AromaticContact CZ3-CD2 3.48Å; W139-H145 VanDerWaalsContact CZ3-CD2 3.48Å; W139-H145 WeakPolarHBondContact CZ3-CD2 3.35Å; W139-H145 AromaticContact CZ3-CG 3.58Å; W139-H145 AromaticContact CZ3-NE2 3.95Å; S141-H145 PolarHBondContact O-N 3.08Å; F142-H145 PolarHBondContact O-N 3.32Å; H145-K147 VanDerWaalsContact C-N 3.32Å; H145-K147 PolarHBondContact O-N 3.48Å; H145-V148 PolarHBondContact O-N 3.02Å; H145-E149 WeakPolarHBondContact O-CB 3.3Å; H145-E149 PolarHBondContact O-N 3.5Å
146	K	80.9	Confident	76.5	Confident	108 Å²	108	79.5 Å²	79.5	47%	0.47	42%	0.424	S	S	.	.	H	α-helix	trans	-66.8	-30	179.1	-168.7	166.5	-174.9	170.3	0	113.2	F142 Y144 N150	F142-K146 WeakPolarHBondContact O-CB 3.44Å; F142-K146 PolarHBondContact O-N 3.14Å; Y144-K146 VanDerWaalsContact C-N 3.32Å; Y144-K146 PolarHBondContact O-N 3.11Å; K146-N150 VanDerWaalsContact O-CB 3.3Å; K146-N150 WeakPolarHBondContact O-CB 3.37Å; K146-N150 PolarHBondContact O-N 3.31Å
147	K	79.2	Confident	75.9	Confident	144 Å²	144	75.6 Å²	75.6	63%	0.626	40%	0.404	S	S	*	.	H	α-helix	trans	-66.7	-43.7	173.2	-177.2	-178	176.6	-175.3	0	111.6	R143 Y144 H145 A151	R143-K147 WeakPolarHBondContact O-CB 3.2Å; R143-K147 PolarHBondContact O-N 2.92Å; Y144-K147 WeakPolarHBondContact O-CA 3.4Å; Y144-K147 WeakPolarHBondContact O-CB 3.26Å; Y144-K147 PolarHBondContact O-N 3.47Å; H145-K147 VanDerWaalsContact C-N 3.32Å; H145-K147 PolarHBondContact O-N 3.48Å; K147-A151 WeakPolarHBondContact O-CB 3.45Å; K147-A151 PolarHBondContact O-N 3.37Å; K147-A151 VanDerWaalsContact O-N 3.11Å
148	V	76.6	Confident	75.4	Confident	20 Å²	20	71.4 Å²	71.4	12%	0.121	39%	0.388	C	S	.	.	H	α-helix	trans	-67	-46.6	176.2	176.4	0	0	0	0	110.5	W139 Y144 H145 N150 A151 L152	W139-V148 HydrophobicContact CH2-CB 4.05Å; W139-V148 HydrophobicContact CH2-CG1 3.82Å; W139-V148 HydrophobicContact CH2-CG2 4.49Å; W139-V148 HydrophobicContact CZ2-CB 4.46Å; W139-V148 HydrophobicContact CZ2-CG1 4.04Å; Y144-V148 HydrophobicContact CD1-CG2 4.09Å; Y144-V148 HydrophobicContact CE1-CG2 3.55Å; Y144-V148 HydrophobicContact CE2-CG2 4.04Å; Y144-V148 VanDerWaalsContact CZ-CG2 3.49Å; Y144-V148 PolarHBondContact O-N 2.62Å; H145-V148 PolarHBondContact O-N 3.02Å; V148-N150 PolarHBondContact O-N 3.39Å; V148-A151 PolarHBondContact O-N 2.81Å; V148-A151 VanDerWaalsContact O-N 3.1Å; V148-L152 HydrophobicContact CG1-CD1 4.08Å; V148-L152 HydrophobicContact CG1-CG 4.42Å; V148-L152 WeakPolarHBondContact O-CG 3.23Å; V148-L152 PolarHBondContact O-N 3.02Å
149	E	74.5	Confident	74.6	Confident	48 Å²	48	73.2 Å²	73.2	22%	0.224	40%	0.4	C	S	.	.	H	α-helix	trans	-55.6	-47.6	176.7	-171.9	-159.8	147.7	0	0	112.3	H145 A151 L152 K153 P159	H145-E149 WeakPolarHBondContact O-CB 3.3Å; H145-E149 PolarHBondContact O-N 3.5Å; E149-A151 VanDerWaalsContact C-N 3.34Å; E149-A151 PolarHBondContact O-N 2.58Å; E149-L152 PolarHBondContact O-N 3.48Å; E149-K153 HydrophobicContact CG-CD 4.4Å; E149-K153 WeakPolarHBondContact O-CG 3.42Å; E149-K153 PolarHBondContact O-N 2.95Å; E149-K153 IonicContact OE1-NZ 2.62Å; E149-K153 PolarHBondContact OE1-NZ 2.86Å; E149-P159 HydrophobicContact CG-CB 3.86Å; E149-P159 HydrophobicContact CG-CG 4.35Å
150	N	74.5	Confident	74.1	Confident	88 Å²	88	76.3 Å²	76.3	47%	0.471	42%	0.422	S	S	.	.	H	α-helix	trans	-64	-37	176	-76.6	-1.3	0	0	0	112.4	K146 V148 A154	K146-N150 VanDerWaalsContact O-CB 3.3Å; K146-N150 WeakPolarHBondContact O-CB 3.37Å; K146-N150 PolarHBondContact O-N 3.31Å; V148-N150 PolarHBondContact O-N 3.39Å; N150-A154 VanDerWaalsContact O-CB 3.3Å; N150-A154 WeakPolarHBondContact O-CB 3.43Å; N150-A154 PolarHBondContact O-N 3.03Å
151	A	73.4	Confident	73.3	Confident	60 Å²	60	75.8 Å²	75.8	50%	0.496	41%	0.414	S	S	.	.	H	α-helix	trans	-68.8	-38.1	177.7	0	0	0	0	0	112.4	K147 V148 E149 A155	K147-A151 WeakPolarHBondContact O-CB 3.45Å; K147-A151 PolarHBondContact O-N 3.37Å; K147-A151 VanDerWaalsContact O-N 3.11Å; V148-A151 PolarHBondContact O-N 2.81Å; V148-A151 VanDerWaalsContact O-N 3.1Å; E149-A151 VanDerWaalsContact C-N 3.34Å; E149-A151 PolarHBondContact O-N 2.58Å; A151-A155 WeakPolarHBondContact O-CB 3.48Å; A151-A155 PolarHBondContact O-N 3.37Å; A151-A155 VanDerWaalsContact O-N 3.07Å
152	L	70.2	Confident	72.1	Confident	41 Å²	41	76.1 Å²	76.1	22%	0.215	42%	0.421	C	S	.	.	H	α-helix	trans	-64.3	-48.7	173.3	-68.2	172.5	0	0	0	110.8	V148 E149 A154 A155 G156 L157 P159	V148-L152 HydrophobicContact CG1-CD1 4.08Å; V148-L152 HydrophobicContact CG1-CG 4.42Å; V148-L152 WeakPolarHBondContact O-CG 3.23Å; V148-L152 PolarHBondContact O-N 3.02Å; E149-L152 PolarHBondContact O-N 3.48Å; L152-A154 VanDerWaalsContact C-N 3.35Å; L152-A154 PolarHBondContact O-N 3.09Å; L152-A155 CarbonylContact O-C 3.46Å; L152-A155 WeakPolarHBondContact O-CA 3.4Å; L152-A155 PolarHBondContact O-N 3.34Å; L152-G156 PolarHBondContact O-N 3.27Å; L152-L157 CarbonylContact C-O 3.53Å; L152-L157 VanDerWaalsContact C-O 3.31Å; L152-L157 HydrophobicContact CB-CB 4.21Å; L152-L157 HydrophobicContact CD2-CB 4.16Å; L152-L157 HydrophobicContact CD2-CD1 3.77Å; L152-L157 WeakPolarHBondContact O-CB 3.49Å; L152-L157 PolarHBondContact O-N 2.86Å; L152-P159 HydrophobicContact CD1-CB 4.45Å
153	K	71.1	Confident	70.4	Confident	111 Å²	111	70.4 Å²	70.4	48%	0.483	40%	0.402	S	S	.	.	H	α-helix	trans	-57.5	-44.2	175.7	-73.1	172.8	175.9	176.8	0	112.5	E149 A155 G156	E149-K153 HydrophobicContact CG-CD 4.4Å; E149-K153 WeakPolarHBondContact O-CG 3.42Å; E149-K153 PolarHBondContact O-N 2.95Å; E149-K153 IonicContact OE1-NZ 2.62Å; E149-K153 PolarHBondContact OE1-NZ 2.86Å; K153-A155 VanDerWaalsContact C-N 3.26Å; K153-A155 PolarHBondContact O-N 3.01Å; K153-G156 PolarHBondContact O-N 3.04Å; K153-G156 VanDerWaalsContact O-N 3.11Å
154	A	71.1	Confident	69	Low	95 Å²	95	69.2 Å²	69.2	79%	0.785	41%	0.411	S	S	*	.	H	α-helix	trans	-65.9	-26	176.4	0	0	0	0	0	113.5	N150 L152 G156	N150-A154 VanDerWaalsContact O-CB 3.3Å; N150-A154 WeakPolarHBondContact O-CB 3.43Å; N150-A154 PolarHBondContact O-N 3.03Å; L152-A154 VanDerWaalsContact C-N 3.35Å; L152-A154 PolarHBondContact O-N 3.09Å; A154-G156 VanDerWaalsContact C-N 3.32Å
155	A	70.5	Confident	68.1	Low	66 Å²	66	71.7 Å²	71.7	55%	0.545	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	4.2	174.1	0	0	0	0	0	113.8	A151 L152 K153 L157	A151-A155 WeakPolarHBondContact O-CB 3.48Å; A151-A155 PolarHBondContact O-N 3.37Å; A151-A155 VanDerWaalsContact O-N 3.07Å; L152-A155 CarbonylContact O-C 3.46Å; L152-A155 WeakPolarHBondContact O-CA 3.4Å; L152-A155 PolarHBondContact O-N 3.34Å; K153-A155 VanDerWaalsContact C-N 3.26Å; K153-A155 PolarHBondContact O-N 3.01Å; A155-L157 VanDerWaalsContact C-N 3.26Å; A155-L157 HydrophobicContact CB-CD1 4.2Å; A155-L157 HydrophobicContact CB-CG 4.11Å; A155-L157 PolarHBondContact O-N 3.07Å
156	G	69.4	Low	67.1	Low	41 Å²	41	73.6 Å²	73.6	42%	0.423	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	22.5	-175.1	0	0	0	0	0	113.7	L152 K153 A154 V165	L152-G156 PolarHBondContact O-N 3.27Å; K153-G156 PolarHBondContact O-N 3.04Å; K153-G156 VanDerWaalsContact O-N 3.11Å; A154-G156 VanDerWaalsContact C-N 3.32Å; G156-V165 WeakPolarHBondContact O-CG2 3.43Å; G156-V165 PolarHBondContact O-N 3.03Å
157	L	67.3	Low	65.8	Low	51 Å²	51	75.6 Å²	75.6	27%	0.267	46%	0.461	S	S	.	.	B	Isolated β-bridge	trans	-103.3	140	178.2	-56.5	177.4	0	0	0	110.7	L152 A155 G163	L152-L157 CarbonylContact C-O 3.53Å; L152-L157 VanDerWaalsContact C-O 3.31Å; L152-L157 HydrophobicContact CB-CB 4.21Å; L152-L157 HydrophobicContact CD2-CB 4.16Å; L152-L157 HydrophobicContact CD2-CD1 3.77Å; L152-L157 WeakPolarHBondContact O-CB 3.49Å; L152-L157 PolarHBondContact O-N 2.86Å; A155-L157 VanDerWaalsContact C-N 3.26Å; A155-L157 HydrophobicContact CB-CD1 4.2Å; A155-L157 HydrophobicContact CB-CG 4.11Å; A155-L157 PolarHBondContact O-N 3.07Å; L157-G163 CarbonylContact C-O 3.53Å; L157-G163 VanDerWaalsContact CA-O 3.23Å; L157-G163 WeakPolarHBondContact CA-O 3.35Å
158	D	68.7	Low	64.4	Low	45 Å²	45	77.1 Å²	77.1	24%	0.241	47%	0.47	C	S	.	.			trans	-67.3	127.5	170	158.2	41.9	0	0	0	109.5	D160 T161 G162 G163 V165	D158-D160 VanDerWaalsContact C-N 3.3Å; D158-D160 PolarHBondContact O-N 3.28Å; D158-D160 PolarHBondContact OD1-N 2.9Å; D158-T161 VanDerWaalsContact OD2-CB 3.23Å; D158-T161 WeakPolarHBondContact OD2-CB 3.23Å; D158-T161 VanDerWaalsContact OD2-CG2 3.26Å; D158-T161 WeakPolarHBondContact OD2-CG2 3.48Å; D158-T161 PolarHBondContact OD2-N 3.45Å; D158-T161 PolarHBondContact OD2-OG1 2.73Å; D158-G162 WeakPolarHBondContact O-CA 3.48Å; D158-G162 PolarHBondContact O-N 3.28Å; D158-G163 PolarHBondContact N-O 3.03Å; D158-V165 HydrophobicContact CB-CG2 4.22Å
159	P	65.6	Low	63.1	Low	44 Å²	44	85.9 Å²	85.9	29%	0.286	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-29.2	179.8	27.9	-37.9	0	0	0	114.3	E149 L152	E149-P159 HydrophobicContact CG-CB 3.86Å; E149-P159 HydrophobicContact CG-CG 4.35Å; L152-P159 HydrophobicContact CD1-CB 4.45Å
160	D	68.2	Low	61.8	Low	140 Å²	140	93.4 Å²	93.4	75%	0.749	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-44	-174.8	-88.8	0.2	0	0	0	112.2	D158	D158-D160 VanDerWaalsContact C-N 3.3Å; D158-D160 PolarHBondContact O-N 3.28Å; D158-D160 PolarHBondContact OD1-N 2.9Å
161	T	63.2	Low	60.4	Low	91 Å²	91	93.9 Å²	93.9	56%	0.558	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-40.6	176.6	61.2	0	0	0	0	112.5	K133 D158 G163	K133-T161 PolarHBondContact NZ-O 3.11Å; D158-T161 VanDerWaalsContact OD2-CB 3.23Å; D158-T161 WeakPolarHBondContact OD2-CB 3.23Å; D158-T161 VanDerWaalsContact OD2-CG2 3.26Å; D158-T161 WeakPolarHBondContact OD2-CG2 3.48Å; D158-T161 PolarHBondContact OD2-N 3.45Å; D158-T161 PolarHBondContact OD2-OG1 2.73Å; T161-G163 VanDerWaalsContact C-N 3.32Å; T161-G163 PolarHBondContact OG1-N 3.37Å
162	G	57	Low	58.8	Low	30 Å²	30	96.8 Å²	96.8	31%	0.309	56%	0.563	S	S	.	*			trans	81.3	8.5	-162.6	0	0	0	0	0	113.8	D158	D158-G162 WeakPolarHBondContact O-CA 3.48Å; D158-G162 PolarHBondContact O-N 3.28Å
163	G	43.8	Very low	57.9	Low	22 Å²	22	104.9 Å²	104.9	23%	0.227	60%	0.596	C	S	.	*	S	Bend	trans	-85.6	167.5	173.7	0	0	0	0	0	112.6	L157 D158 T161	L157-G163 CarbonylContact C-O 3.53Å; L157-G163 VanDerWaalsContact CA-O 3.23Å; L157-G163 WeakPolarHBondContact CA-O 3.35Å; D158-G163 PolarHBondContact N-O 3.03Å; T161-G163 VanDerWaalsContact C-N 3.32Å; T161-G163 PolarHBondContact OG1-N 3.37Å
164	P	50.4	Low	56.8	Low	99 Å²	99	111 Å²	111	64%	0.643	62%	0.616	S	S	*	*	B	Isolated β-bridge	trans	-60.5	138.2	173.2	27.6	-34.6	0	0	0	110.6	V166	P164-V166 PolarHBondContact O-N 3.39Å
165	V	57.8	Low	55.9	Low	77 Å²	77	116.4 Å²	116.4	47%	0.467	62%	0.622	S	S	.	*			trans	-65.1	101	173	177.8	0	0	0	0	108.5	G156 D158 L167	G156-V165 WeakPolarHBondContact O-CG2 3.43Å; G156-V165 PolarHBondContact O-N 3.03Å; D158-V165 HydrophobicContact CB-CG2 4.22Å; V165-L167 VanDerWaalsContact C-N 3.3Å; V165-L167 HydrophobicContact CG1-CD2 4.41Å; V165-L167 PolarHBondContact O-N 2.92Å
166	V	55.2	Low	54.8	Low	124 Å²	124	118 Å²	118	75%	0.752	63%	0.634	S	S	*	*			trans	-69.4	93.8	168.2	-178.8	0	0	0	0	107.1	P164 E168	P164-V166 PolarHBondContact O-N 3.39Å; V166-E168 PolarHBondContact O-N 2.87Å
167	L	53.9	Low	54	Low	150 Å²	150	121.3 Å²	121.3	79%	0.785	64%	0.643	S	S	*	*			trans	-60.3	102.4	164.8	-73.2	172.8	0	0	0	107.7	V165 K169	V165-L167 VanDerWaalsContact C-N 3.3Å; V165-L167 HydrophobicContact CG1-CD2 4.41Å; V165-L167 PolarHBondContact O-N 2.92Å; L167-K169 PolarHBondContact O-N 2.91Å; L167-K169 VanDerWaalsContact O-N 3.08Å
168	E	50.1	Low	53.5	Low	176 Å²	176	123.7 Å²	123.7	82%	0.822	66%	0.661	S	S	*	*			trans	-53.1	120.9	168.5	-71.3	-158.6	146.5	0	0	108.4	V166 K170	V166-E168 PolarHBondContact O-N 2.87Å; E168-K170 PolarHBondContact O-N 2.94Å
169	K	49.5	Very low	52.8	Low	204 Å²	204	126.4 Å²	126.4	89%	0.887	68%	0.676	S	S	*	*			trans	-58.5	109.3	172.4	-76.3	-178.1	175.6	178.6	0	107	L167 S171	L167-K169 PolarHBondContact O-N 2.91Å; L167-K169 VanDerWaalsContact O-N 3.08Å; K169-S171 PolarHBondContact O-N 3.27Å
170	K	47.5	Very low	52.1	Low	207 Å²	207	127 Å²	127	90%	0.9	69%	0.685	S	S	*	*			trans	-45.3	105	177.4	-73.8	-178.6	177.6	176	0	109	E168	E168-K170 PolarHBondContact O-N 2.94Å
171	S	44.2	Very low	51.1	Low	98 Å²	98	124 Å²	124	69%	0.685	68%	0.679	S	S	*	*			trans	-65	150	-178.9	48.5	0	0	0	0	109.2	K169 K173	K169-S171 PolarHBondContact O-N 3.27Å; S171-K173 PolarHBondContact O-N 2.8Å
172	P	41.2	Very low	50.5	Low	121 Å²	121	127.5 Å²	127.5	79%	0.786	69%	0.687	S	S	*	*			trans	-55.3	132.2	-176.6	-25.9	34.8	0	0	0	110.6	R174	P172-R174 PolarHBondContact O-N 2.99Å
173	K	49.6	Very low	49.9	Very low	211 Å²	211	134 Å²	134	92%	0.917	71%	0.709	S	S	*	*			trans	-49.6	99	-175.1	-71	-179	177.5	179.1	0	111.2	S171	S171-K173 PolarHBondContact O-N 2.8Å
174	R	48.6	Very low	49.9	Very low	238 Å²	238	137.8 Å²	137.8	90%	0.898	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-62	137.8	161.6	-74	-173.6	170.8	-170	-3.1	107.3	P172 A176	P172-R174 PolarHBondContact O-N 2.99Å; R174-A176 PolarHBondContact O-N 3.01Å
175	K	51.7	Low	49.6	Very low	210 Å²	210	141.7 Å²	141.7	91%	0.913	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-57.5	128.2	175.8	-70.5	-177	176.5	-178.9	0	108.2	N177	K175-N177 PolarHBondContact O-N 3.08Å
176	A	48.6	Very low	48.9	Very low	98 Å²	98	144.8 Å²	144.8	81%	0.81	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-65	127.8	-179.7	0	0	0	0	0	109.8	R174	R174-A176 PolarHBondContact O-N 3.01Å
177	N	51.5	Low	48.3	Very low	112 Å²	112	145.8 Å²	145.8	60%	0.599	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-74.9	122.3	170.4	-163.8	41.6	0	0	0	107.8	K175 D179 A180	K175-N177 PolarHBondContact O-N 3.08Å; N177-D179 PolarHBondContact O-N 3.07Å; N177-D179 VanDerWaalsContact O-N 3.12Å; N177-A180 PolarHBondContact O-N 3.11Å
178	P	56.7	Low	47.7	Very low	101 Å²	101	146.5 Å²	146.5	66%	0.656	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-61.2	-27.4	-167.5	21.6	-33.3	0	0	0	114.1	A180 A181	P178-A180 VanDerWaalsContact C-N 3.34Å; P178-A180 PolarHBondContact O-N 3.47Å; P178-A181 PolarHBondContact O-N 3.36Å
179	D	55.1	Low	47.2	Very low	101 Å²	101	146.7 Å²	146.7	54%	0.54	75%	0.75	S	S	.	*	G	3₁₀ helix	trans	-72	-24	-178.7	-61.2	-64.2	0	0	0	114.4	N177 A181 K182	N177-D179 PolarHBondContact O-N 3.07Å; N177-D179 VanDerWaalsContact O-N 3.12Å; D179-A181 PolarHBondContact O-N 3.46Å; D179-A181 VanDerWaalsContact O-N 3.13Å; D179-K182 PolarHBondContact O-N 3.37Å
180	A	50.5	Low	46.7	Very low	58 Å²	58	144.6 Å²	144.6	48%	0.479	75%	0.748	S	S	.	*	G	3₁₀ helix	trans	-65.7	-16.2	179.1	0	0	0	0	0	113.3	N177 P178 K182	N177-A180 PolarHBondContact O-N 3.11Å; P178-A180 VanDerWaalsContact C-N 3.34Å; P178-A180 PolarHBondContact O-N 3.47Å; A180-K182 PolarHBondContact O-N 3.4Å
181	A	47.2	Very low	46.1	Very low	76 Å²	76	136.9 Å²	136.9	63%	0.628	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-73.6	-5.1	-178.6	0	0	0	0	0	114.6	P178 D179	P178-A181 PolarHBondContact O-N 3.36Å; D179-A181 PolarHBondContact O-N 3.46Å; D179-A181 VanDerWaalsContact O-N 3.13Å
182	K	49.7	Very low	45.8	Very low	165 Å²	165	142.9 Å²	142.9	72%	0.717	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-91.1	-23.5	-176.1	-72.9	173.5	-179.3	162.8	0	114.7	D179 A180	D179-K182 PolarHBondContact O-N 3.37Å; A180-K182 PolarHBondContact O-N 3.4Å
183	E	44.6	Very low	45.5	Very low	165 Å²	165	144 Å²	144	77%	0.771	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-26.8	-174.4	-61.2	-173.1	138.5	0	0	113.6	K185	E183-K185 PolarHBondContact O-N 3.07Å
184	V	44.4	Very low	45.2	Very low	102 Å²	102	141.3 Å²	141.3	62%	0.618	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	9	-169.3	-161	0	0	0	0	114.3
185	K	44.5	Very low	44.7	Very low	182 Å²	182	139.9 Å²	139.9	79%	0.791	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-7.1	-177.6	-78.7	-168.7	173.4	-176.2	0	115.6	E183	E183-K185 PolarHBondContact O-N 3.07Å
186	N	42.2	Very low	44.2	Very low	141 Å²	141	135.9 Å²	135.9	75%	0.754	72%	0.719	S	S	*	*	S	Bend	trans	-99.6	-9.2	-172.4	-74.9	-9.4	0	0	0	115.9	N188	N186-N188 VanDerWaalsContact C-N 3.33Å; N186-N188 PolarHBondContact O-N 3.03Å
187	E	42.3	Very low	44.1	Very low	146 Å²	146	139.5 Å²	139.5	68%	0.682	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-77.3	-11.9	-170.4	-61.5	-168.7	129.3	0	0	115.1	Q189	E187-Q189 PolarHBondContact O-N 3.42Å
188	N	41.2	Very low	43.7	Very low	165 Å²	165	145.5 Å²	145.5	88%	0.882	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-74.7	18.2	178.6	-77.7	-22.2	0	0	0	114.6	N186	N186-N188 VanDerWaalsContact C-N 3.33Å; N186-N188 PolarHBondContact O-N 3.03Å
189	Q	40.8	Very low	43.4	Very low	180 Å²	180	147 Å²	147	84%	0.841	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-114.8	37.9	174	-65.5	-164.5	7.6	0	0	113.3	E187 G191	E187-Q189 PolarHBondContact O-N 3.42Å; Q189-G191 PolarHBondContact O-N 3.28Å
190	L	39.6	Very low	43	Very low	160 Å²	160	151.9 Å²	151.9	84%	0.838	75%	0.754	S	S	*	*			trans	-73.8	67.8	169.9	-79.1	167.9	0	0	0	112.3
191	G	34.9	Very low	42.9	Very low	45 Å²	45	158.9 Å²	158.9	46%	0.464	77%	0.774	S	S	.	*			trans	-64.5	160.3	162.8	0	0	0	0	0	112	Q189 N193	Q189-G191 PolarHBondContact O-N 3.28Å; G191-N193 PolarHBondContact O-N 2.95Å
192	Y	36.3	Very low	43.3	Very low	224 Å²	224	161.3 Å²	161.3	88%	0.878	78%	0.781	S	S	*	*			trans	-60.9	83.4	-169	-60.3	-88.8	0	0	0	115	L194	Y192-L194 PolarHBondContact O-N 3.43Å
193	N	36.4	Very low	43.2	Very low	143 Å²	143	166.1 Å²	166.1	77%	0.765	81%	0.809	S	S	*	*			trans	-79.2	81.8	172.6	-82.1	-54.2	0	0	0	111.7	G191 R195	G191-N193 PolarHBondContact O-N 2.95Å; N193-R195 PolarHBondContact O-N 3.03Å; N193-R195 VanDerWaalsContact O-N 3.14Å
194	L	43.1	Very low	43.1	Very low	155 Å²	155	166.2 Å²	166.2	81%	0.812	81%	0.811	S	S	*	*			trans	-58	115.6	170.3	-82.3	168.7	0	0	0	110.5	Y192 T196	Y192-L194 PolarHBondContact O-N 3.43Å; L194-T196 VanDerWaalsContact C-N 3.31Å; L194-T196 PolarHBondContact O-N 3.39Å
195	R	38.4	Very low	43.1	Very low	208 Å²	208	169.6 Å²	169.6	79%	0.785	82%	0.821	S	S	*	*			trans	-76.6	67	-159.5	-159.3	-177.3	-161.2	174.7	9.7	113.9	N193 K197	N193-R195 PolarHBondContact O-N 3.03Å; N193-R195 VanDerWaalsContact O-N 3.14Å; R195-K197 VanDerWaalsContact C-N 3.35Å; R195-K197 PolarHBondContact O-N 2.7Å
196	T	40.3	Very low	43	Very low	127 Å²	127	168.9 Å²	168.9	78%	0.779	82%	0.823	S	S	*	*			trans	-69.3	84.4	176.2	49.9	0	0	0	0	112	L194 R198	L194-T196 VanDerWaalsContact C-N 3.31Å; L194-T196 PolarHBondContact O-N 3.39Å; T196-R198 PolarHBondContact O-N 3.08Å
197	K	46	Very low	43	Very low	174 Å²	174	170.5 Å²	170.5	76%	0.757	83%	0.827	S	S	*	*			trans	-66.6	80.6	167.5	-77.9	-167.8	173.8	-173.3	0	110.7	R195 T199	R195-K197 VanDerWaalsContact C-N 3.35Å; R195-K197 PolarHBondContact O-N 2.7Å; K197-T199 PolarHBondContact O-N 2.92Å; K197-T199 VanDerWaalsContact O-N 3.08Å
198	R	44	Very low	43.1	Very low	238 Å²	238	172.1 Å²	172.1	90%	0.898	84%	0.836	S	S	*	*			trans	-64	103.4	161.1	-84.8	-175.8	167.9	176.3	-3.4	108.5	T196 K200	T196-R198 PolarHBondContact O-N 3.08Å; R198-K200 PolarHBondContact O-N 2.83Å
199	T	49.5	Very low	43.2	Very low	132 Å²	132	172.5 Å²	172.5	81%	0.81	83%	0.833	S	S	*	*			trans	-63.6	121.5	164.6	37	0	0	0	0	108.7	K197 K201	K197-T199 PolarHBondContact O-N 2.92Å; K197-T199 VanDerWaalsContact O-N 3.08Å; T199-K201 PolarHBondContact O-N 2.91Å
200	K	47.8	Very low	43.4	Very low	204 Å²	204	172 Å²	172	89%	0.887	83%	0.832	S	S	*	*			trans	-68	114.3	165.5	-76.9	-170.3	176.6	-176.5	0	107.5	R198 T202	R198-K200 PolarHBondContact O-N 2.83Å; K200-T202 PolarHBondContact O-N 3.27Å
201	K	47.2	Very low	43.7	Very low	205 Å²	205	172.9 Å²	172.9	89%	0.891	83%	0.832	S	S	*	*			trans	-78.2	104.5	163.9	-161.4	-178.4	-174.9	-170.9	0	106.4	T199	T199-K201 PolarHBondContact O-N 2.91Å
202	T	56.9	Low	44.4	Very low	127 Å²	127	183.6 Å²	183.6	78%	0.779	86%	0.863	S	S	*	*			trans	-63.8	150.1	160.4	33.5	0	0	0	0	109	K200	K200-T202 PolarHBondContact O-N 3.27Å
203	M	46.9	Very low	45.1	Very low	266 Å²	266	179.9 Å²	179.9	100%	1.31	86%	0.861	S	S	*	*			trans	-73.2	0	165.2	-60.4	-167.1	-173.3	0	0	110

Retrieved 203 of 203 residues in 302.9 ms (Link to these results)

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