A0A060X3U9_ONCMY Loading...

Troponin I type 2a (skeletal, fast), tandem duplicate 2

Troponin I is the inhibitory subunit of troponin, the thin filament regulatory complex which confers calcium-sensitivity to striated muscle actomyosin ATPase activity.

AlphaFold DB , UniProt , Accession A0A060X3U9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110521356, Length 180 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	42.2	Very low	66.4	Low	254 Å²	254	133.2 Å²	133.2	100%	1.251	77%	0.767	S	S	*	*				0	91.5	0	-68.6	-172.8	179.5	0	0	107.2
2	A	46.9	Very low	68.5	Low	92 Å²	92	134.4 Å²	134.4	76%	0.76	75%	0.75	S	S	*	*			trans	-114.2	125.3	-166.5	0	0	0	0	0	111.5
3	D	48.4	Very low	70.4	Confident	147 Å²	147	130.9 Å²	130.9	79%	0.786	72%	0.722	S	S	*	*			trans	48.9	84	153.2	-65.4	-61.4	0	0	0	120.4
4	K	57.1	Low	72.1	Confident	222 Å²	222	130.4 Å²	130.4	97%	0.965	71%	0.711	S	S	*	*			trans	-103.9	33.6	156	-98.8	-179	-178.7	172.1	0	112.6
5	K	58	Low	73.6	Confident	199 Å²	199	126.1 Å²	126.1	87%	0.865	69%	0.691	S	S	*	*			trans	-129.9	83.6	173.4	-94.8	-176	173.9	177.8	0	109.3
6	G	61.1	Low	75	Confident	77 Å²	77	123.1 Å²	123.1	79%	0.794	67%	0.673	S	S	*	*	S	Bend	trans	-169.1	-9.5	177.5	0	0	0	0	0	117.9
7	N	71.9	Confident	76.2	Confident	137 Å²	137	123.9 Å²	123.9	73%	0.733	67%	0.669	S	S	*	*			trans	-133.1	125.1	-178	-117	-44.8	0	0	0	111.4	S9 K13	N7-S9 PolarHBondContact O-N 2.65Å; N7-K13 PolarHBondContact OD1-NZ 3.03Å
8	V	80.4	Confident	77.3	Confident	78 Å²	78	120.2 Å²	120.2	47%	0.473	65%	0.653	S	S	.	*			trans	-51.3	129.8	170.6	179.3	0	0	0	0	108.4	R12 K13	V8-R12 HydrophobicContact CG1-CB 3.58Å; V8-R12 HydrophobicContact CG1-CG 3.44Å; V8-R12 VanDerWaalsContact CG1-CG 3.44Å; V8-K13 HydrophobicContact CB-CG 4.11Å; V8-K13 HydrophobicContact CG1-CG 3.9Å; V8-K13 WeakPolarHBondContact O-CE 3.06Å
9	S	88.6	Confident	78.3	Confident	78 Å²	78	117.4 Å²	117.4	55%	0.545	64%	0.643	S	S	.	*			trans	-53	141.9	178.4	173.8	0	0	0	0	111	N7 S11 R12 K13	N7-S9 PolarHBondContact O-N 2.65Å; S9-S11 PolarHBondContact O-N 3.49Å; S9-R12 WeakPolarHBondContact O-CA 3.27Å; S9-R12 PolarHBondContact O-N 3.42Å; S9-K13 PolarHBondContact O-N 3.2Å
10	S	87.4	Confident	79.3	Confident	98 Å²	98	118.2 Å²	118.2	69%	0.685	64%	0.643	S	S	*	*	H	α-helix	trans	-51.9	-39.7	177.8	-174.8	0	0	0	0	112	R12 K13 H14	S10-R12 PolarHBondContact O-N 3.34Å; S10-K13 PolarHBondContact O-N 3.43Å; S10-H14 PolarHBondContact O-N 3.4Å
11	S	88.6	Confident	80.1	Confident	83 Å²	83	118.6 Å²	118.6	58%	0.58	64%	0.644	S	S	*	*	H	α-helix	trans	-58	-48.4	175.1	178.4	0	0	0	0	111.8	S9 K13 H14 T15	S9-S11 PolarHBondContact O-N 3.49Å; S11-K13 PolarHBondContact O-N 3.34Å; S11-H14 PolarHBondContact O-N 3.49Å; S11-T15 PolarHBondContact O-N 3.06Å; S11-T15 PolarHBondContact O-OG1 3.32Å; S11-T15 VanDerWaalsContact O-OG1 3.09Å
12	R	91.9	Very high	82.7	Confident	148 Å²	148	108.9 Å²	108.9	56%	0.558	61%	0.605	S	S	*	*	H	α-helix	trans	-65	-38	177.5	-180	63.1	177	-147.8	2.7	112.2	V8 S9 S10 H14 T15 L16	V8-R12 HydrophobicContact CG1-CB 3.58Å; V8-R12 HydrophobicContact CG1-CG 3.44Å; V8-R12 VanDerWaalsContact CG1-CG 3.44Å; S9-R12 WeakPolarHBondContact O-CA 3.27Å; S9-R12 PolarHBondContact O-N 3.42Å; S10-R12 PolarHBondContact O-N 3.34Å; R12-H14 VanDerWaalsContact C-N 3.33Å; R12-T15 PolarHBondContact O-N 3.33Å; R12-L16 HydrophobicContact CG-CD1 4.19Å; R12-L16 WeakPolarHBondContact O-CB 3.41Å; R12-L16 VanDerWaalsContact O-CG 3.27Å; R12-L16 WeakPolarHBondContact O-CG 3.3Å; R12-L16 PolarHBondContact O-N 3.46Å
13	K	93	Very high	85.1	Confident	89 Å²	89	108.9 Å²	108.9	39%	0.387	59%	0.592	S	S	.	*	H	α-helix	trans	-61.4	-42	173.9	-68.4	-179.3	179.6	173.4	0	111.3	N7 V8 S9 S10 S11 L16 K17	N7-K13 PolarHBondContact OD1-NZ 3.03Å; V8-K13 HydrophobicContact CB-CG 4.11Å; V8-K13 HydrophobicContact CG1-CG 3.9Å; V8-K13 WeakPolarHBondContact O-CE 3.06Å; S9-K13 PolarHBondContact O-N 3.2Å; S10-K13 PolarHBondContact O-N 3.43Å; S11-K13 PolarHBondContact O-N 3.34Å; K13-L16 PolarHBondContact O-N 2.92Å; K13-K17 WeakPolarHBondContact O-CG 3.34Å; K13-K17 PolarHBondContact O-N 3.15Å
14	H	93.5	Very high	87.5	Confident	123 Å²	123	104.2 Å²	104.2	57%	0.569	57%	0.573	S	S	*	*	H	α-helix	trans	-65.6	-47.7	176.7	-175.2	-81.9	0	0	0	111.7	S10 S11 R12 L16 K17 S18	S10-H14 PolarHBondContact O-N 3.4Å; S11-H14 PolarHBondContact O-N 3.49Å; R12-H14 VanDerWaalsContact C-N 3.33Å; H14-L16 VanDerWaalsContact C-N 3.29Å; H14-L16 PolarHBondContact O-N 3.29Å; H14-K17 PolarHBondContact O-N 3.4Å; H14-K17 VanDerWaalsContact O-N 3.15Å; H14-S18 PolarHBondContact CE1-OG 3.3Å; H14-S18 PolarHBondContact O-N 3.03Å; H14-S18 PolarHBondContact O-OG 2.99Å
15	T	95.4	Very high	89.4	Confident	66 Å²	66	99.6 Å²	99.6	41%	0.405	55%	0.553	S	S	.	*	H	α-helix	trans	-55.2	-46	175.7	-54.1	0	0	0	0	111.4	S11 R12 S18 C19	S11-T15 PolarHBondContact O-N 3.06Å; S11-T15 PolarHBondContact O-OG1 3.32Å; S11-T15 VanDerWaalsContact O-OG1 3.09Å; R12-T15 PolarHBondContact O-N 3.33Å; T15-S18 PolarHBondContact O-N 3.48Å; T15-C19 PolarHBondContact O-N 3.37Å; T15-C19 PolarHBondContact O-SG 3Å
16	L	95.6	Very high	91.3	Very high	79 Å²	79	94.2 Å²	94.2	41%	0.414	53%	0.534	S	S	.	.	H	α-helix	trans	-61.6	-45.2	177.3	-71.8	169.5	0	0	0	111.9	R12 K13 H14 S18 C19 M20	R12-L16 HydrophobicContact CG-CD1 4.19Å; R12-L16 WeakPolarHBondContact O-CB 3.41Å; R12-L16 VanDerWaalsContact O-CG 3.27Å; R12-L16 WeakPolarHBondContact O-CG 3.3Å; R12-L16 PolarHBondContact O-N 3.46Å; K13-L16 PolarHBondContact O-N 2.92Å; H14-L16 VanDerWaalsContact C-N 3.29Å; H14-L16 PolarHBondContact O-N 3.29Å; L16-S18 VanDerWaalsContact C-N 3.34Å; L16-S18 PolarHBondContact O-N 2.98Å; L16-C19 PolarHBondContact O-N 2.95Å; L16-M20 VanDerWaalsContact O-CG 3.27Å; L16-M20 WeakPolarHBondContact O-CG 3.47Å; L16-M20 PolarHBondContact O-N 3.11Å
17	K	96.1	Very high	93	Very high	137 Å²	137	99.2 Å²	99.2	60%	0.596	53%	0.529	S	S	*	.	H	α-helix	trans	-59	-44.1	175	-73.9	177	179.6	-174.7	0	112.1	K13 H14 M20 L21	K13-K17 WeakPolarHBondContact O-CG 3.34Å; K13-K17 PolarHBondContact O-N 3.15Å; H14-K17 PolarHBondContact O-N 3.4Å; H14-K17 VanDerWaalsContact O-N 3.15Å; K17-M20 PolarHBondContact O-N 3.29Å; K17-L21 WeakPolarHBondContact O-CG 3.3Å; K17-L21 PolarHBondContact O-N 3.19Å
18	S	96.1	Very high	94.2	Very high	56 Å²	56	98.2 Å²	98.2	39%	0.392	52%	0.523	S	S	.	.	H	α-helix	trans	-62.1	-43.4	176.6	-60.9	0	0	0	0	111.9	H14 T15 L16 L21 A22	H14-S18 PolarHBondContact CE1-OG 3.3Å; H14-S18 PolarHBondContact O-N 3.03Å; H14-S18 PolarHBondContact O-OG 2.99Å; T15-S18 PolarHBondContact O-N 3.48Å; L16-S18 VanDerWaalsContact C-N 3.34Å; L16-S18 PolarHBondContact O-N 2.98Å; S18-L21 PolarHBondContact O-N 3.47Å; S18-A22 WeakPolarHBondContact O-CB 3.33Å; S18-A22 PolarHBondContact O-N 3.14Å
19	C	96.2	Very high	95	Very high	68 Å²	68	99.5 Å²	99.5	46%	0.459	52%	0.524	S	S	.	.	H	α-helix	trans	-62.8	-42.5	175	-67.5	0	0	0	0	112	T15 L16 L21 A22 L23	T15-C19 PolarHBondContact O-N 3.37Å; T15-C19 PolarHBondContact O-SG 3Å; L16-C19 PolarHBondContact O-N 2.95Å; C19-L21 VanDerWaalsContact C-N 3.34Å; C19-L21 PolarHBondContact O-N 3.18Å; C19-A22 PolarHBondContact O-N 3.37Å; C19-L23 WeakPolarHBondContact O-CG 3.31Å; C19-L23 PolarHBondContact O-N 3.01Å
20	M	97.1	Very high	95.4	Very high	132 Å²	132	98.3 Å²	98.3	65%	0.65	52%	0.519	S	S	*	.	H	α-helix	trans	-62.1	-41.9	176.7	-71.2	177.4	74.8	0	0	111.9	L16 K17 L23 A24	L16-M20 VanDerWaalsContact O-CG 3.27Å; L16-M20 WeakPolarHBondContact O-CG 3.47Å; L16-M20 PolarHBondContact O-N 3.11Å; K17-M20 PolarHBondContact O-N 3.29Å; M20-L23 PolarHBondContact O-N 3.32Å; M20-A24 VanDerWaalsContact O-CB 3.26Å; M20-A24 WeakPolarHBondContact O-CB 3.42Å; M20-A24 PolarHBondContact O-N 3.27Å
21	L	97.2	Very high	95.9	Very high	127 Å²	127	98.5 Å²	98.5	67%	0.665	51%	0.509	S	S	*	.	H	α-helix	trans	-67.7	-37.7	177	-71.6	172.6	0	0	0	112.3	K17 S18 C19 A24 K25	K17-L21 WeakPolarHBondContact O-CG 3.3Å; K17-L21 PolarHBondContact O-N 3.19Å; S18-L21 PolarHBondContact O-N 3.47Å; C19-L21 VanDerWaalsContact C-N 3.34Å; C19-L21 PolarHBondContact O-N 3.18Å; L21-A24 PolarHBondContact O-N 3.43Å; L21-K25 WeakPolarHBondContact O-CB 3.42Å; L21-K25 PolarHBondContact O-N 3.4Å
22	A	96.6	Very high	96.3	Very high	51 Å²	51	96.9 Å²	96.9	42%	0.421	50%	0.5	S	S	.	.	H	α-helix	trans	-61.5	-49.8	174.4	0	0	0	0	0	110.9	S18 C19 A24 K25 D26	S18-A22 WeakPolarHBondContact O-CB 3.33Å; S18-A22 PolarHBondContact O-N 3.14Å; C19-A22 PolarHBondContact O-N 3.37Å; A22-A24 PolarHBondContact O-N 3.15Å; A22-K25 WeakPolarHBondContact O-CB 3.39Å; A22-K25 PolarHBondContact O-N 3.46Å; A22-D26 VanDerWaalsContact O-CG 3.32Å; A22-D26 PolarHBondContact O-N 2.93Å
23	L	97.7	Very high	96.5	Very high	92 Å²	92	94.6 Å²	94.6	48%	0.482	50%	0.498	S	S	.	.	H	α-helix	trans	-62.1	-42.1	176.5	-70.9	171.8	0	0	0	112.7	C19 M20 K25 D26 W27	C19-L23 WeakPolarHBondContact O-CG 3.31Å; C19-L23 PolarHBondContact O-N 3.01Å; M20-L23 PolarHBondContact O-N 3.32Å; L23-K25 VanDerWaalsContact C-N 3.26Å; L23-K25 PolarHBondContact O-N 2.89Å; L23-D26 PolarHBondContact O-N 3.31Å; L23-W27 VanDerWaalsContact O-CG 3.31Å; L23-W27 PolarHBondContact O-N 3.48Å
24	A	97.8	Very high	96.7	Very high	48 Å²	48	94.5 Å²	94.5	40%	0.397	50%	0.5	S	S	.	.	H	α-helix	trans	-62.4	-36.3	177.8	0	0	0	0	0	112	M20 L21 A22 L28	M20-A24 VanDerWaalsContact O-CB 3.26Å; M20-A24 WeakPolarHBondContact O-CB 3.42Å; M20-A24 PolarHBondContact O-N 3.27Å; L21-A24 PolarHBondContact O-N 3.43Å; A22-A24 PolarHBondContact O-N 3.15Å; A24-L28 WeakPolarHBondContact O-CB 3.32Å; A24-L28 PolarHBondContact O-N 3.26Å
25	K	96.8	Very high	96.8	Very high	126 Å²	126	94.6 Å²	94.6	55%	0.548	50%	0.498	S	S	.	.	H	α-helix	trans	-63.8	-49.3	173.6	-179.7	-173.2	166.8	-171.1	0	110.8	L21 A22 L23 W27 L28 E29	L21-K25 WeakPolarHBondContact O-CB 3.42Å; L21-K25 PolarHBondContact O-N 3.4Å; A22-K25 WeakPolarHBondContact O-CB 3.39Å; A22-K25 PolarHBondContact O-N 3.46Å; L23-K25 VanDerWaalsContact C-N 3.26Å; L23-K25 PolarHBondContact O-N 2.89Å; K25-W27 VanDerWaalsContact C-N 3.26Å; K25-W27 PolarHBondContact O-N 3.29Å; K25-L28 PolarHBondContact O-N 3.45Å; K25-L28 VanDerWaalsContact O-N 3.11Å; K25-E29 WeakPolarHBondContact CE-OE1 3.5Å; K25-E29 IonicContact NZ-OE1 3.64Å; K25-E29 PolarHBondContact O-N 3.38Å
26	D	97.4	Very high	96.9	Very high	86 Å²	86	94.1 Å²	94.1	46%	0.46	50%	0.495	S	S	.	.	H	α-helix	trans	-59.9	-39.8	179.9	-60.8	-17.4	0	0	0	111.2	A22 L23 E29 A30	A22-D26 VanDerWaalsContact O-CG 3.32Å; A22-D26 PolarHBondContact O-N 2.93Å; L23-D26 PolarHBondContact O-N 3.31Å; D26-E29 PolarHBondContact O-N 3.48Å; D26-A30 WeakPolarHBondContact O-CB 3.45Å; D26-A30 PolarHBondContact O-N 2.83Å
27	W	97.6	Very high	97	Very high	182 Å²	182	94.1 Å²	94.1	69%	0.689	49%	0.492	S	S	*	.	H	α-helix	trans	-66.4	-38.2	175.2	-67.6	-9	0	0	0	113.2	L23 K25 E29 A30 E31	L23-W27 VanDerWaalsContact O-CG 3.31Å; L23-W27 PolarHBondContact O-N 3.48Å; K25-W27 VanDerWaalsContact C-N 3.26Å; K25-W27 PolarHBondContact O-N 3.29Å; W27-E29 VanDerWaalsContact C-N 3.34Å; W27-A30 PolarHBondContact O-N 3.25Å; W27-E31 WeakPolarHBondContact O-CB 3.4Å; W27-E31 PolarHBondContact O-N 3.4Å
28	L	97.4	Very high	97	Very high	116 Å²	116	92.3 Å²	92.3	61%	0.607	49%	0.485	S	S	*	.	H	α-helix	trans	-67	-38.1	177.2	-170	147.7	0	0	0	111.4	A24 K25 A32	A24-L28 WeakPolarHBondContact O-CB 3.32Å; A24-L28 PolarHBondContact O-N 3.26Å; K25-L28 PolarHBondContact O-N 3.45Å; K25-L28 VanDerWaalsContact O-N 3.11Å; L28-A32 WeakPolarHBondContact O-CB 3.29Å; L28-A32 PolarHBondContact O-N 3.24Å
29	E	96.8	Very high	97	Very high	105 Å²	105	96.9 Å²	96.9	49%	0.491	49%	0.494	S	S	.	.	H	α-helix	trans	-66.6	-42.7	173.5	-70.2	179.2	-177.4	0	0	111.6	K25 D26 W27 A32 L33	K25-E29 WeakPolarHBondContact CE-OE1 3.5Å; K25-E29 IonicContact NZ-OE1 3.64Å; K25-E29 PolarHBondContact O-N 3.38Å; D26-E29 PolarHBondContact O-N 3.48Å; W27-E29 VanDerWaalsContact C-N 3.34Å; E29-A32 PolarHBondContact O-N 2.92Å; E29-L33 PolarHBondContact O-N 2.91Å
30	A	97.4	Very high	96.9	Very high	53 Å²	53	99.1 Å²	99.1	44%	0.438	50%	0.498	S	S	.	.	H	α-helix	trans	-62.7	-43.9	175	0	0	0	0	0	112.3	D26 W27 A32 L33 E34	D26-A30 WeakPolarHBondContact O-CB 3.45Å; D26-A30 PolarHBondContact O-N 2.83Å; W27-A30 PolarHBondContact O-N 3.25Å; A30-A32 VanDerWaalsContact C-N 3.35Å; A30-A32 PolarHBondContact O-N 3.32Å; A30-L33 PolarHBondContact O-N 2.98Å; A30-E34 PolarHBondContact O-N 3.45Å
31	E	97.4	Very high	96.9	Very high	102 Å²	102	97.9 Å²	97.9	48%	0.477	49%	0.486	S	S	.	.	H	α-helix	trans	-62.5	-41.2	175.8	-170.1	-165.4	175.9	0	0	111.5	W27 L33 E34 K35	W27-E31 WeakPolarHBondContact O-CB 3.4Å; W27-E31 PolarHBondContact O-N 3.4Å; E31-L33 VanDerWaalsContact C-N 3.32Å; E31-L33 PolarHBondContact O-N 3.26Å; E31-E34 PolarHBondContact O-N 3.15Å; E31-K35 VanDerWaalsContact CD-NZ 3.29Å; E31-K35 HydrophobicContact CG-CD 4.48Å; E31-K35 WeakPolarHBondContact O-CG 3.48Å; E31-K35 PolarHBondContact O-N 3.43Å; E31-K35 WeakPolarHBondContact OE1-CE 3.47Å; E31-K35 IonicContact OE1-NZ 2.96Å; E31-K35 PolarHBondContact OE1-NZ 3.34Å; E31-K35 IonicContact OE2-NZ 2.64Å
32	A	96.8	Very high	96.8	Very high	48 Å²	48	98 Å²	98	40%	0.397	48%	0.478	S	S	.	.	H	α-helix	trans	-61.5	-41.1	176.3	0	0	0	0	0	111.8	L28 E29 A30 K35 V36	L28-A32 WeakPolarHBondContact O-CB 3.29Å; L28-A32 PolarHBondContact O-N 3.24Å; E29-A32 PolarHBondContact O-N 2.92Å; A30-A32 VanDerWaalsContact C-N 3.35Å; A30-A32 PolarHBondContact O-N 3.32Å; A32-K35 PolarHBondContact O-N 3.28Å; A32-V36 WeakPolarHBondContact O-CG2 3.35Å; A32-V36 PolarHBondContact O-N 2.92Å
33	L	96.9	Very high	96.8	Very high	100 Å²	100	100.5 Å²	100.5	52%	0.524	48%	0.483	S	S	.	.	H	α-helix	trans	-64.9	-44.2	175.8	-174.8	67	0	0	0	111.8	E29 A30 E31 K35 V36 K37	E29-L33 PolarHBondContact O-N 2.91Å; A30-L33 PolarHBondContact O-N 2.98Å; E31-L33 VanDerWaalsContact C-N 3.32Å; E31-L33 PolarHBondContact O-N 3.26Å; L33-K35 VanDerWaalsContact C-N 3.33Å; L33-K35 PolarHBondContact O-N 2.97Å; L33-V36 PolarHBondContact O-N 3.47Å; L33-K37 WeakPolarHBondContact O-CG 3.35Å; L33-K37 PolarHBondContact O-N 3.39Å; L33-K37 VanDerWaalsContact O-N 3.08Å
34	E	96.9	Very high	96.5	Very high	88 Å²	88	103 Å²	103	41%	0.411	49%	0.492	S	S	.	.	H	α-helix	trans	-63.3	-37.8	176.4	-74.9	-56.5	128.2	0	0	112.4	A30 E31 V36 K37 E38	A30-E34 PolarHBondContact O-N 3.45Å; E31-E34 PolarHBondContact O-N 3.15Å; E34-V36 VanDerWaalsContact C-N 3.31Å; E34-V36 PolarHBondContact O-N 2.9Å; E34-K37 PolarHBondContact O-N 2.82Å; E34-K37 IonicContact OE1-NZ 2.77Å; E34-K37 PolarHBondContact OE1-NZ 3.5Å; E34-E38 WeakPolarHBondContact O-CB 3.5Å; E34-E38 PolarHBondContact O-N 2.82Å
35	K	96.8	Very high	96.3	Very high	124 Å²	124	108.1 Å²	108.1	54%	0.539	51%	0.507	S	S	.	.	H	α-helix	trans	-61.2	-37.7	173.7	-76.9	173.9	-178.3	164.4	0	112.7	E31 A32 L33 R39	E31-K35 VanDerWaalsContact CD-NZ 3.29Å; E31-K35 HydrophobicContact CG-CD 4.48Å; E31-K35 WeakPolarHBondContact O-CG 3.48Å; E31-K35 PolarHBondContact O-N 3.43Å; E31-K35 WeakPolarHBondContact OE1-CE 3.47Å; E31-K35 IonicContact OE1-NZ 2.96Å; E31-K35 PolarHBondContact OE1-NZ 3.34Å; E31-K35 IonicContact OE2-NZ 2.64Å; A32-K35 PolarHBondContact O-N 3.28Å; L33-K35 VanDerWaalsContact C-N 3.33Å; L33-K35 PolarHBondContact O-N 2.97Å; K35-R39 WeakPolarHBondContact O-CB 3.27Å; K35-R39 PolarHBondContact O-N 3.38Å
36	V	96.9	Very high	96.1	Very high	57 Å²	57	106.7 Å²	106.7	35%	0.345	51%	0.506	S	S	.	.	H	α-helix	trans	-67	-46.3	175.9	174.2	0	0	0	0	110.6	A32 L33 E34 E38 R39 E40	A32-V36 WeakPolarHBondContact O-CG2 3.35Å; A32-V36 PolarHBondContact O-N 2.92Å; L33-V36 PolarHBondContact O-N 3.47Å; E34-V36 VanDerWaalsContact C-N 3.31Å; E34-V36 PolarHBondContact O-N 2.9Å; V36-E38 PolarHBondContact O-N 2.88Å; V36-R39 WeakPolarHBondContact O-CB 3.33Å; V36-R39 PolarHBondContact O-N 3.46Å; V36-E40 WeakPolarHBondContact O-CG 3.24Å; V36-E40 PolarHBondContact O-N 2.89Å
37	K	96.8	Very high	95.8	Very high	78 Å²	78	107 Å²	107	34%	0.339	51%	0.514	S	S	.	.	H	α-helix	trans	-62.2	-41.5	177	-67.2	177.2	-170.4	164.6	0	112.6	L33 E34 R39 E40 R41	L33-K37 WeakPolarHBondContact O-CG 3.35Å; L33-K37 PolarHBondContact O-N 3.39Å; L33-K37 VanDerWaalsContact O-N 3.08Å; E34-K37 PolarHBondContact O-N 2.82Å; E34-K37 IonicContact OE1-NZ 2.77Å; E34-K37 PolarHBondContact OE1-NZ 3.5Å; K37-R39 VanDerWaalsContact C-N 3.32Å; K37-R39 PolarHBondContact O-N 3.44Å; K37-E40 WeakPolarHBondContact O-CB 3.31Å; K37-E40 PolarHBondContact O-N 2.82Å; K37-R41 WeakPolarHBondContact O-CG 3.49Å; K37-R41 PolarHBondContact O-N 2.93Å
38	E	96.9	Very high	95.4	Very high	99 Å²	99	102 Å²	102	46%	0.463	51%	0.505	S	S	.	.	H	α-helix	trans	-63	-41	176.6	-176.6	60.2	-159.6	0	0	111.2	E34 V36 E40 R41 Y42	E34-E38 WeakPolarHBondContact O-CB 3.5Å; E34-E38 PolarHBondContact O-N 2.82Å; V36-E38 PolarHBondContact O-N 2.88Å; E38-E40 VanDerWaalsContact C-N 3.32Å; E38-E40 PolarHBondContact O-N 2.98Å; E38-R41 PolarHBondContact O-N 3.2Å; E38-R41 IonicContact OE2-CZ 3.23Å; E38-R41 IonicContact OE2-NE 2.91Å; E38-R41 PolarHBondContact OE2-NE 3.38Å; E38-R41 IonicContact OE2-NH2 2.82Å; E38-R41 PolarHBondContact OE2-NH2 3.08Å; E38-Y42 WeakPolarHBondContact O-CB 3.29Å; E38-Y42 PolarHBondContact O-N 2.95Å
39	R	95.8	Very high	95.1	Very high	153 Å²	153	102 Å²	102	58%	0.577	51%	0.512	S	S	*	.	H	α-helix	trans	-61.1	-41.5	172.8	-173.6	-174.4	69.2	-170.4	0.8	111.7	K35 V36 K37 M43	K35-R39 WeakPolarHBondContact O-CB 3.27Å; K35-R39 PolarHBondContact O-N 3.38Å; V36-R39 WeakPolarHBondContact O-CB 3.33Å; V36-R39 PolarHBondContact O-N 3.46Å; K37-R39 VanDerWaalsContact C-N 3.32Å; K37-R39 PolarHBondContact O-N 3.44Å; R39-M43 WeakPolarHBondContact O-CB 3.46Å; R39-M43 WeakPolarHBondContact O-CG 3.42Å; R39-M43 PolarHBondContact O-N 3.27Å
40	E	95.2	Very high	94.6	Very high	115 Å²	115	102.7 Å²	102.7	54%	0.537	52%	0.518	S	S	.	.	H	α-helix	trans	-63.3	-47.6	176.4	-72.4	170.5	176.6	0	0	111.5	V36 K37 E38 Y42 M43 E44	V36-E40 WeakPolarHBondContact O-CG 3.24Å; V36-E40 PolarHBondContact O-N 2.89Å; K37-E40 WeakPolarHBondContact O-CB 3.31Å; K37-E40 PolarHBondContact O-N 2.82Å; E38-E40 VanDerWaalsContact C-N 3.32Å; E38-E40 PolarHBondContact O-N 2.98Å; E40-Y42 PolarHBondContact O-N 3.27Å; E40-M43 PolarHBondContact O-N 3.05Å; E40-E44 PolarHBondContact O-N 3.43Å
41	R	96.3	Very high	94	Very high	106 Å²	106	108.6 Å²	108.6	40%	0.4	54%	0.537	S	S	.	.	H	α-helix	trans	-55.9	-49	174	-73.8	-169	-71.6	-102.5	6.2	112	K37 E38 M43 E44 E45	K37-R41 WeakPolarHBondContact O-CG 3.49Å; K37-R41 PolarHBondContact O-N 2.93Å; E38-R41 PolarHBondContact O-N 3.2Å; E38-R41 IonicContact OE2-CZ 3.23Å; E38-R41 IonicContact OE2-NE 2.91Å; E38-R41 PolarHBondContact OE2-NE 3.38Å; E38-R41 IonicContact OE2-NH2 2.82Å; E38-R41 PolarHBondContact OE2-NH2 3.08Å; R41-M43 VanDerWaalsContact C-N 3.32Å; R41-M43 PolarHBondContact O-N 3.49Å; R41-E44 PolarHBondContact O-N 3.35Å; R41-E45 WeakPolarHBondContact O-CG 3.38Å; R41-E45 PolarHBondContact O-N 3.24Å; R41-E45 VanDerWaalsContact O-N 3.08Å
42	Y	95.9	Very high	93.2	Very high	129 Å²	129	109.5 Å²	109.5	51%	0.506	54%	0.542	S	S	.	.	H	α-helix	trans	-59.8	-42.3	178.4	179.9	-88.9	0	0	0	112	E38 E40 E45 N46	E38-Y42 WeakPolarHBondContact O-CB 3.29Å; E38-Y42 PolarHBondContact O-N 2.95Å; E40-Y42 PolarHBondContact O-N 3.27Å; Y42-E45 PolarHBondContact O-N 3.49Å; Y42-N46 VanDerWaalsContact CD2-ND2 3.35Å; Y42-N46 WeakPolarHBondContact CD2-ND2 3.43Å; Y42-N46 HydrophobicContact CE1-CB 4.17Å; Y42-N46 WeakPolarHBondContact CE2-ND2 3.25Å; Y42-N46 WeakPolarHBondContact O-CB 3.31Å; Y42-N46 PolarHBondContact O-N 2.96Å; Y42-N46 PolarHBondContact O-ND2 3.26Å
43	M	94.7	Very high	92.5	Very high	103 Å²	103	109.1 Å²	109.1	51%	0.507	54%	0.537	S	S	.	.	H	α-helix	trans	-68	-37.2	178.6	-72.3	-66.4	-179.2	0	0	112.2	R39 E40 R41 E45 C47	R39-M43 WeakPolarHBondContact O-CB 3.46Å; R39-M43 WeakPolarHBondContact O-CG 3.42Å; R39-M43 PolarHBondContact O-N 3.27Å; E40-M43 PolarHBondContact O-N 3.05Å; R41-M43 VanDerWaalsContact C-N 3.32Å; R41-M43 PolarHBondContact O-N 3.49Å; M43-E45 VanDerWaalsContact C-N 3.35Å; M43-C47 CarbonylContact O-C 3.2Å; M43-C47 VanDerWaalsContact O-CA 3.31Å; M43-C47 WeakPolarHBondContact O-CA 3.36Å; M43-C47 PolarHBondContact O-N 2.92Å
44	E	93.4	Very high	91.9	Very high	146 Å²	146	114 Å²	114	68%	0.682	56%	0.556	S	S	*	*	H	α-helix	trans	-63.7	-39.9	176.1	-172.1	171.3	-163.9	0	0	111.9	E40 R41	E40-E44 PolarHBondContact O-N 3.43Å; R41-E44 PolarHBondContact O-N 3.35Å
45	E	93.5	Very high	91.6	Very high	154 Å²	154	112.2 Å²	112.2	72%	0.72	55%	0.554	S	S	*	*	H	α-helix	trans	-73.2	-42.3	177.6	-69.1	177.4	-176	0	0	113.1	R41 Y42 M43	R41-E45 WeakPolarHBondContact O-CG 3.38Å; R41-E45 PolarHBondContact O-N 3.24Å; R41-E45 VanDerWaalsContact O-N 3.08Å; Y42-E45 PolarHBondContact O-N 3.49Å; M43-E45 VanDerWaalsContact C-N 3.35Å
46	N	92.3	Very high	91.4	Very high	96 Å²	96	114 Å²	114	51%	0.513	56%	0.562	S	S	.	*	H	α-helix	trans	-93.8	-23.7	-171.1	-69.9	-86.1	0	0	0	113.8	Y42	Y42-N46 VanDerWaalsContact CD2-ND2 3.35Å; Y42-N46 WeakPolarHBondContact CD2-ND2 3.43Å; Y42-N46 HydrophobicContact CE1-CB 4.17Å; Y42-N46 WeakPolarHBondContact CE2-ND2 3.25Å; Y42-N46 WeakPolarHBondContact O-CB 3.31Å; Y42-N46 PolarHBondContact O-N 2.96Å; Y42-N46 PolarHBondContact O-ND2 3.26Å
47	C	90.3	Very high	91.2	Very high	93 Å²	93	116.3 Å²	116.3	63%	0.628	57%	0.572	S	S	*	*	S	Bend	trans	-140.1	66.8	-179.1	-164.8	0	0	0	0	110.3	M43	M43-C47 CarbonylContact O-C 3.2Å; M43-C47 VanDerWaalsContact O-CA 3.31Å; M43-C47 WeakPolarHBondContact O-CA 3.36Å; M43-C47 PolarHBondContact O-N 2.92Å
48	P	89.9	Confident	90.9	Very high	77 Å²	77	116.6 Å²	116.6	50%	0.5	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-63.4	158.5	177.8	27.7	-35.4	0	0	0	111.1	L50	P48-L50 PolarHBondContact O-N 2.82Å
49	P	90.1	Very high	90.6	Very high	115 Å²	115	114.7 Å²	114.7	75%	0.747	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-51.4	135.6	174.7	-26.2	34.9	0	0	0	111.9	E51	P49-E51 PolarHBondContact O-N 3.33Å
50	L	87.6	Confident	90.5	Very high	121 Å²	121	111.7 Å²	111.7	63%	0.634	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-67.7	120	-178	-75.5	160.6	0	0	0	110.9	P48 M66	P48-L50 PolarHBondContact O-N 2.82Å; L50-M66 HydrophobicContact CD2-CE 3.66Å
51	E	83.2	Confident	90.4	Very high	176 Å²	176	110.9 Å²	110.9	82%	0.822	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-88.7	116.2	167.4	-65.3	-175.5	173.6	0	0	109.4	P49	P49-E51 PolarHBondContact O-N 3.33Å
52	M	81.3	Confident	90.2	Very high	121 Å²	121	108 Å²	108	60%	0.596	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-87	116.1	179	-62.7	-62.2	-74.4	0	0	109.5	L59	M52-L59 HydrophobicContact CE-CD1 3.95Å; M52-L59 HydrophobicContact CE-CD2 4.34Å; M52-L59 HydrophobicContact CE-CG 4.42Å
53	S	82.6	Confident	90	Very high	40 Å²	40	105.8 Å²	105.8	28%	0.28	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-68.4	152	172.6	51.8	0	0	0	0	111.4	D58 L59	S53-D58 VanDerWaalsContact OG-CB 3.3Å; S53-D58 WeakPolarHBondContact OG-CB 3.34Å; S53-L59 WeakPolarHBondContact O-CD1 3.38Å; S53-L59 WeakPolarHBondContact OG-CD1 3.32Å; S53-L59 PolarHBondContact OG-N 2.91Å
54	H	82.7	Confident	90	Very high	202 Å²	202	107.9 Å²	107.9	94%	0.935	56%	0.561	S	S	*	*	S	Bend	trans	-89.1	-10	-179.7	-60.1	-53.2	0	0	0	113.5
55	S	92.1	Very high	90	Very high	52 Å²	52	106 Å²	106	36%	0.364	55%	0.55	S	S	.	*	S	Bend	trans	-93.2	139.5	178.3	-176.3	0	0	0	0	111.4	D57 D58 L59	S55-D57 VanDerWaalsContact C-N 3.33Å; S55-D57 PolarHBondContact O-N 3.44Å; S55-D58 VanDerWaalsContact CB-OD2 3.3Å; S55-D58 WeakPolarHBondContact CB-OD2 3.38Å; S55-L59 PolarHBondContact O-N 2.76Å
56	K	91.6	Very high	90	Very high	160 Å²	160	102 Å²	102	70%	0.696	53%	0.533	S	S	*	.	H	α-helix	trans	-61.8	-40.1	179.1	-177.1	-173.1	172.2	-176.2	0	112.4	L59 M60	K56-L59 PolarHBondContact O-N 2.95Å; K56-M60 HydrophobicContact CG-CE 4.23Å; K56-M60 PolarHBondContact O-N 3.24Å; K56-M60 VanDerWaalsContact O-N 3.11Å
57	D	92.4	Very high	90.2	Very high	106 Å²	106	104.4 Å²	104.4	57%	0.567	54%	0.536	S	S	*	.	H	α-helix	trans	-71.5	-43.5	-175	-66.2	-25.5	0	0	0	111.1	S55 L59 M60 E61	S55-D57 VanDerWaalsContact C-N 3.33Å; S55-D57 PolarHBondContact O-N 3.44Å; D57-L59 VanDerWaalsContact C-N 3.26Å; D57-L59 PolarHBondContact O-N 3.45Å; D57-M60 PolarHBondContact O-N 3.19Å; D57-M60 VanDerWaalsContact OD1-CE 3.27Å; D57-M60 WeakPolarHBondContact OD1-CE 3.37Å; D57-E61 PolarHBondContact O-N 3.5Å
58	D	90.9	Very high	90.5	Very high	84 Å²	84	104.7 Å²	104.7	45%	0.449	53%	0.531	S	S	.	.	H	α-helix	trans	-59.7	-38.5	174.4	-60.4	-16	0	0	0	111.4	S53 S55 E61 L62	S53-D58 VanDerWaalsContact OG-CB 3.3Å; S53-D58 WeakPolarHBondContact OG-CB 3.34Å; S55-D58 VanDerWaalsContact CB-OD2 3.3Å; S55-D58 WeakPolarHBondContact CB-OD2 3.38Å; D58-E61 PolarHBondContact O-N 3.37Å; D58-L62 WeakPolarHBondContact O-CB 3.22Å; D58-L62 PolarHBondContact O-N 3.19Å
59	L	91.3	Very high	90.8	Very high	59 Å²	59	107 Å²	107	31%	0.309	53%	0.533	S	S	.	.	H	α-helix	trans	-66.1	-42.9	177.6	-137.3	75.8	0	0	0	111.9	M52 S53 S55 K56 D57 E61 L62 C63	M52-L59 HydrophobicContact CE-CD1 3.95Å; M52-L59 HydrophobicContact CE-CD2 4.34Å; M52-L59 HydrophobicContact CE-CG 4.42Å; S53-L59 WeakPolarHBondContact O-CD1 3.38Å; S53-L59 WeakPolarHBondContact OG-CD1 3.32Å; S53-L59 PolarHBondContact OG-N 2.91Å; S55-L59 PolarHBondContact O-N 2.76Å; K56-L59 PolarHBondContact O-N 2.95Å; D57-L59 VanDerWaalsContact C-N 3.26Å; D57-L59 PolarHBondContact O-N 3.45Å; L59-E61 VanDerWaalsContact C-N 3.33Å; L59-E61 PolarHBondContact O-N 3.46Å; L59-L62 PolarHBondContact O-N 2.64Å; L59-C63 PolarHBondContact O-N 2.96Å; L59-C63 PolarHBondContact O-SG 3.05Å
60	M	93.1	Very high	91	Very high	90 Å²	90	106.4 Å²	106.4	44%	0.443	52%	0.522	S	S	.	.	H	α-helix	trans	-63.5	-39.4	176.1	-79.4	-171.9	-66.3	0	0	111.9	K56 D57 K64	K56-M60 HydrophobicContact CG-CE 4.23Å; K56-M60 PolarHBondContact O-N 3.24Å; K56-M60 VanDerWaalsContact O-N 3.11Å; D57-M60 PolarHBondContact O-N 3.19Å; D57-M60 VanDerWaalsContact OD1-CE 3.27Å; D57-M60 WeakPolarHBondContact OD1-CE 3.37Å; M60-K64 WeakPolarHBondContact O-CG 3.42Å; M60-K64 PolarHBondContact O-N 2.88Å
61	E	92.7	Very high	91.5	Very high	99 Å²	99	104.4 Å²	104.4	46%	0.463	51%	0.512	S	S	.	.	H	α-helix	trans	-66.4	-43	176.3	-168.5	-178.1	166.1	0	0	111.6	D57 D58 L59 C63 K64 K65	D57-E61 PolarHBondContact O-N 3.5Å; D58-E61 PolarHBondContact O-N 3.37Å; L59-E61 VanDerWaalsContact C-N 3.33Å; L59-E61 PolarHBondContact O-N 3.46Å; E61-C63 PolarHBondContact O-N 2.97Å; E61-K64 PolarHBondContact O-N 2.64Å; E61-K65 HydrophobicContact CG-CD 4.34Å; E61-K65 WeakPolarHBondContact O-CG 3.48Å; E61-K65 PolarHBondContact O-N 2.95Å; E61-K65 WeakPolarHBondContact OE1-CE 3.48Å; E61-K65 IonicContact OE1-NZ 2.65Å; E61-K65 PolarHBondContact OE1-NZ 3.33Å
62	L	92.1	Very high	92.1	Very high	44 Å²	44	99.8 Å²	99.8	23%	0.23	50%	0.496	C	S	.	.	H	α-helix	trans	-59.1	-46.2	175.2	-179.6	62.7	0	0	0	111.7	D58 L59 K64 K65 M66	D58-L62 WeakPolarHBondContact O-CB 3.22Å; D58-L62 PolarHBondContact O-N 3.19Å; L59-L62 PolarHBondContact O-N 2.64Å; L62-K64 VanDerWaalsContact C-N 3.33Å; L62-K64 PolarHBondContact O-N 2.84Å; L62-K65 PolarHBondContact O-N 3.29Å; L62-M66 HydrophobicContact CD1-CE 3.75Å; L62-M66 HydrophobicContact CD1-CG 4.28Å; L62-M66 WeakPolarHBondContact O-CG 3.45Å; L62-M66 PolarHBondContact O-N 3.36Å
63	C	93	Very high	92.9	Very high	83 Å²	83	98.9 Å²	98.9	56%	0.561	49%	0.493	S	S	*	.	H	α-helix	trans	-59.5	-41.8	177.7	-71.7	0	0	0	0	112.5	L59 E61 M66 Y67	L59-C63 PolarHBondContact O-N 2.96Å; L59-C63 PolarHBondContact O-SG 3.05Å; E61-C63 PolarHBondContact O-N 2.97Å; C63-M66 PolarHBondContact O-N 3.39Å; C63-Y67 PolarHBondContact O-N 2.84Å
64	K	94.9	Very high	93.6	Very high	148 Å²	148	100.8 Å²	100.8	64%	0.643	50%	0.5	S	S	*	.	H	α-helix	trans	-64.1	-48.2	176.2	-71.6	174.5	-178	177	0	111.5	M60 E61 L62 M66 Y67 D68	M60-K64 WeakPolarHBondContact O-CG 3.42Å; M60-K64 PolarHBondContact O-N 2.88Å; E61-K64 PolarHBondContact O-N 2.64Å; L62-K64 VanDerWaalsContact C-N 3.33Å; L62-K64 PolarHBondContact O-N 2.84Å; K64-M66 VanDerWaalsContact C-N 3.29Å; K64-M66 PolarHBondContact O-N 2.86Å; K64-Y67 WeakPolarHBondContact O-CB 3.11Å; K64-Y67 PolarHBondContact O-N 3.49Å; K64-Y67 VanDerWaalsContact O-N 3.15Å; K64-D68 PolarHBondContact O-N 3.45Å
65	K	93.4	Very high	94.3	Very high	105 Å²	105	97.3 Å²	97.3	46%	0.457	48%	0.484	S	S	.	.	H	α-helix	trans	-57.4	-41.4	176.9	-73.8	174.4	-179.3	166.3	0	112.2	E61 L62 K69	E61-K65 HydrophobicContact CG-CD 4.34Å; E61-K65 WeakPolarHBondContact O-CG 3.48Å; E61-K65 PolarHBondContact O-N 2.95Å; E61-K65 WeakPolarHBondContact OE1-CE 3.48Å; E61-K65 IonicContact OE1-NZ 2.65Å; E61-K65 PolarHBondContact OE1-NZ 3.33Å; L62-K65 PolarHBondContact O-N 3.29Å; K65-K69 WeakPolarHBondContact O-CB 3.45Å; K65-K69 VanDerWaalsContact O-CG 3.31Å; K65-K69 WeakPolarHBondContact O-CG 3.5Å; K65-K69 PolarHBondContact O-N 3.45Å
66	M	93.2	Very high	94.5	Very high	71 Å²	71	100.1 Å²	100.1	35%	0.35	49%	0.491	S	S	.	.	H	α-helix	trans	-67.1	-41.7	177.7	-71.4	-64.7	170.7	0	0	111.8	L50 L62 C63 K64 K69 I70	L50-M66 HydrophobicContact CD2-CE 3.66Å; L62-M66 HydrophobicContact CD1-CE 3.75Å; L62-M66 HydrophobicContact CD1-CG 4.28Å; L62-M66 WeakPolarHBondContact O-CG 3.45Å; L62-M66 PolarHBondContact O-N 3.36Å; C63-M66 PolarHBondContact O-N 3.39Å; K64-M66 VanDerWaalsContact C-N 3.29Å; K64-M66 PolarHBondContact O-N 2.86Å; M66-K69 PolarHBondContact O-N 3.32Å; M66-I70 VanDerWaalsContact O-CG1 3.24Å; M66-I70 WeakPolarHBondContact O-CG1 3.45Å; M66-I70 PolarHBondContact O-N 2.91Å
67	Y	95.9	Very high	94.8	Very high	146 Å²	146	98.3 Å²	98.3	57%	0.573	48%	0.48	S	S	*	.	H	α-helix	trans	-60.1	-46.4	176.2	-176.5	-97.1	0	0	0	112.1	C63 K64 K69 I70 N71	C63-Y67 PolarHBondContact O-N 2.84Å; K64-Y67 WeakPolarHBondContact O-CB 3.11Å; K64-Y67 PolarHBondContact O-N 3.49Å; K64-Y67 VanDerWaalsContact O-N 3.15Å; Y67-K69 VanDerWaalsContact C-N 3.34Å; Y67-K69 PolarHBondContact O-N 3.3Å; Y67-I70 PolarHBondContact O-N 2.91Å; Y67-N71 VanDerWaalsContact CE1-ND2 3.34Å; Y67-N71 WeakPolarHBondContact CE1-ND2 3.26Å; Y67-N71 PolarHBondContact O-N 3.19Å; Y67-N71 PolarHBondContact O-ND2 3.22Å
68	D	96.4	Very high	95.1	Very high	99 Å²	99	100.1 Å²	100.1	53%	0.529	48%	0.48	S	S	.	.	H	α-helix	trans	-62.7	-42.4	177.8	-65	-25.7	0	0	0	111.5	K64 I70 N71 V72	K64-D68 PolarHBondContact O-N 3.45Å; D68-I70 PolarHBondContact O-N 2.91Å; D68-N71 PolarHBondContact O-N 3.34Å; D68-V72 PolarHBondContact O-N 2.69Å
69	K	95.4	Very high	95.4	Very high	125 Å²	125	99.4 Å²	99.4	54%	0.543	48%	0.476	S	S	.	.	H	α-helix	trans	-61.6	-41.5	175.2	-77.4	-179.1	178.2	-171.3	0	112.8	K65 M66 Y67 N71 V72 I73	K65-K69 WeakPolarHBondContact O-CB 3.45Å; K65-K69 VanDerWaalsContact O-CG 3.31Å; K65-K69 WeakPolarHBondContact O-CG 3.5Å; K65-K69 PolarHBondContact O-N 3.45Å; M66-K69 PolarHBondContact O-N 3.32Å; Y67-K69 VanDerWaalsContact C-N 3.34Å; Y67-K69 PolarHBondContact O-N 3.3Å; K69-N71 VanDerWaalsContact C-N 3.28Å; K69-N71 PolarHBondContact O-N 3.4Å; K69-V72 PolarHBondContact O-N 3.42Å; K69-I73 WeakPolarHBondContact O-CB 3.41Å; K69-I73 VanDerWaalsContact O-CG1 3.29Å; K69-I73 WeakPolarHBondContact O-CG1 3.45Å; K69-I73 PolarHBondContact O-N 3.47Å
70	I	96.3	Very high	95.7	Very high	103 Å²	103	101.8 Å²	101.8	53%	0.528	49%	0.489	S	S	.	.	H	α-helix	trans	-58.7	-43.7	178.7	-73.5	162.8	0	0	0	110.4	M66 Y67 D68 V72 I73 D74	M66-I70 VanDerWaalsContact O-CG1 3.24Å; M66-I70 WeakPolarHBondContact O-CG1 3.45Å; M66-I70 PolarHBondContact O-N 2.91Å; Y67-I70 PolarHBondContact O-N 2.91Å; D68-I70 PolarHBondContact O-N 2.91Å; I70-V72 PolarHBondContact O-N 3.46Å; I70-I73 PolarHBondContact O-N 3.27Å; I70-D74 WeakPolarHBondContact O-CB 3.48Å; I70-D74 PolarHBondContact O-N 3.08Å
71	N	96.9	Very high	95.9	Very high	79 Å²	79	102 Å²	102	42%	0.422	49%	0.489	S	S	.	.	H	α-helix	trans	-62.1	-44.5	179.8	-66.8	-30.9	0	0	0	111.9	Y67 D68 K69 D74 E75	Y67-N71 VanDerWaalsContact CE1-ND2 3.34Å; Y67-N71 WeakPolarHBondContact CE1-ND2 3.26Å; Y67-N71 PolarHBondContact O-N 3.19Å; Y67-N71 PolarHBondContact O-ND2 3.22Å; D68-N71 PolarHBondContact O-N 3.34Å; K69-N71 VanDerWaalsContact C-N 3.28Å; K69-N71 PolarHBondContact O-N 3.4Å; N71-D74 PolarHBondContact O-N 2.99Å; N71-E75 PolarHBondContact O-N 3.33Å; N71-E75 VanDerWaalsContact O-N 3.15Å
72	V	96.9	Very high	96.2	Very high	80 Å²	80	103.5 Å²	103.5	49%	0.485	49%	0.491	S	S	.	.	H	α-helix	trans	-63.7	-47.1	177.3	176.9	0	0	0	0	111.1	D68 K69 I70 D74 E75 E76	D68-V72 PolarHBondContact O-N 2.69Å; K69-V72 PolarHBondContact O-N 3.42Å; I70-V72 PolarHBondContact O-N 3.46Å; V72-D74 VanDerWaalsContact C-N 3.31Å; V72-D74 PolarHBondContact O-N 2.77Å; V72-E75 PolarHBondContact O-N 3.46Å; V72-E76 WeakPolarHBondContact O-CG 3.28Å; V72-E76 PolarHBondContact O-N 3.22Å
73	I	96.8	Very high	96.5	Very high	102 Å²	102	107.6 Å²	107.6	52%	0.523	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-37.3	-179.3	-68	168.5	0	0	0	111.1	K69 I70 E76 R77	K69-I73 WeakPolarHBondContact O-CB 3.41Å; K69-I73 VanDerWaalsContact O-CG1 3.29Å; K69-I73 WeakPolarHBondContact O-CG1 3.45Å; K69-I73 PolarHBondContact O-N 3.47Å; I70-I73 PolarHBondContact O-N 3.27Å; I73-E76 PolarHBondContact O-N 3.49Å; I73-R77 VanDerWaalsContact O-CB 3.29Å; I73-R77 WeakPolarHBondContact O-CB 3.28Å; I73-R77 PolarHBondContact O-N 2.98Å
74	D	97.5	Very high	96.7	Very high	79 Å²	79	107.9 Å²	107.9	42%	0.422	51%	0.506	S	S	.	.	H	α-helix	trans	-68.3	-37.2	178.4	-165.4	53.5	0	0	0	112	I70 N71 V72 R77 Y78	I70-D74 WeakPolarHBondContact O-CB 3.48Å; I70-D74 PolarHBondContact O-N 3.08Å; N71-D74 PolarHBondContact O-N 2.99Å; V72-D74 VanDerWaalsContact C-N 3.31Å; V72-D74 PolarHBondContact O-N 2.77Å; D74-R77 PolarHBondContact O-N 3.44Å; D74-R77 IonicContact OD1-CZ 3.94Å; D74-R77 VanDerWaalsContact OD1-CZ 3.23Å; D74-R77 IonicContact OD1-NE 3.81Å; D74-R77 PolarHBondContact OD1-NE 2.86Å; D74-R77 IonicContact OD1-NH2 3.87Å; D74-R77 PolarHBondContact OD1-NH2 3.22Å; D74-R77 IonicContact OD2-NH2 2.64Å; D74-Y78 WeakPolarHBondContact O-CB 3.13Å; D74-Y78 PolarHBondContact O-N 3.37Å
75	E	97.3	Very high	96.9	Very high	129 Å²	129	104.7 Å²	104.7	60%	0.603	50%	0.495	S	S	*	.	H	α-helix	trans	-62.4	-46	171.7	-173.6	-179	166.6	0	0	111.5	N71 V72 R77 Y78 N79	N71-E75 PolarHBondContact O-N 3.33Å; N71-E75 VanDerWaalsContact O-N 3.15Å; V72-E75 PolarHBondContact O-N 3.46Å; E75-R77 PolarHBondContact O-N 2.93Å; E75-Y78 PolarHBondContact O-N 3.33Å; E75-N79 WeakPolarHBondContact O-CB 3.38Å; E75-N79 VanDerWaalsContact O-CG 3.3Å; E75-N79 PolarHBondContact O-N 3.11Å; E75-N79 PolarHBondContact O-ND2 3.34Å; E75-N79 VanDerWaalsContact O-ND2 3.14Å
76	E	97.2	Very high	97.1	Very high	112 Å²	112	104.5 Å²	104.5	52%	0.523	50%	0.497	S	S	.	.	H	α-helix	trans	-60.7	-44.3	175.3	-71.1	178.5	172.5	0	0	111.9	V72 I73 Y78 N79 L80	V72-E76 WeakPolarHBondContact O-CG 3.28Å; V72-E76 PolarHBondContact O-N 3.22Å; I73-E76 PolarHBondContact O-N 3.49Å; E76-Y78 PolarHBondContact O-N 2.85Å; E76-N79 PolarHBondContact O-N 2.98Å; E76-L80 WeakPolarHBondContact O-CB 3.44Å; E76-L80 VanDerWaalsContact O-CG 3.31Å; E76-L80 WeakPolarHBondContact O-CG 3.49Å; E76-L80 PolarHBondContact O-N 2.85Å
77	R	97.9	Very high	97.3	Very high	121 Å²	121	105 Å²	105	46%	0.457	50%	0.504	S	S	.	.	H	α-helix	trans	-58	-47.6	175.7	-176.5	-168.4	67.3	71.8	2.7	110.8	I73 D74 E75 N79 L80 E81	I73-R77 VanDerWaalsContact O-CB 3.29Å; I73-R77 WeakPolarHBondContact O-CB 3.28Å; I73-R77 PolarHBondContact O-N 2.98Å; D74-R77 PolarHBondContact O-N 3.44Å; D74-R77 IonicContact OD1-CZ 3.94Å; D74-R77 VanDerWaalsContact OD1-CZ 3.23Å; D74-R77 IonicContact OD1-NE 3.81Å; D74-R77 PolarHBondContact OD1-NE 2.86Å; D74-R77 IonicContact OD1-NH2 3.87Å; D74-R77 PolarHBondContact OD1-NH2 3.22Å; D74-R77 IonicContact OD2-NH2 2.64Å; E75-R77 PolarHBondContact O-N 2.93Å; R77-N79 PolarHBondContact O-N 3.49Å; R77-L80 PolarHBondContact O-N 3.37Å; R77-E81 IonicContact NH1-OE2 2.69Å; R77-E81 PolarHBondContact NH1-OE2 2.95Å; R77-E81 WeakPolarHBondContact O-CB 3.19Å; R77-E81 PolarHBondContact O-N 3.22Å
78	Y	97.8	Very high	97.4	Very high	144 Å²	144	101.2 Å²	101.2	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-59.8	-46	177.7	178.7	-95	0	0	0	111.7	D74 E75 E76 L80 E81 Y82	D74-Y78 WeakPolarHBondContact O-CB 3.13Å; D74-Y78 PolarHBondContact O-N 3.37Å; E75-Y78 PolarHBondContact O-N 3.33Å; E76-Y78 PolarHBondContact O-N 2.85Å; Y78-L80 PolarHBondContact O-N 2.9Å; Y78-E81 PolarHBondContact O-N 2.91Å; Y78-Y82 WeakPolarHBondContact O-CB 3.26Å; Y78-Y82 PolarHBondContact O-N 3.02Å
79	N	97.7	Very high	97.4	Very high	69 Å²	69	101 Å²	101	37%	0.369	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-40.8	178.3	-73.6	-35.4	0	0	0	112.5	E75 E76 R77 K83	E75-N79 WeakPolarHBondContact O-CB 3.38Å; E75-N79 VanDerWaalsContact O-CG 3.3Å; E75-N79 PolarHBondContact O-N 3.11Å; E75-N79 PolarHBondContact O-ND2 3.34Å; E75-N79 VanDerWaalsContact O-ND2 3.14Å; E76-N79 PolarHBondContact O-N 2.98Å; R77-N79 PolarHBondContact O-N 3.49Å; N79-K83 WeakPolarHBondContact O-CG 3.38Å; N79-K83 PolarHBondContact O-N 3.21Å; N79-K83 VanDerWaalsContact O-N 3.15Å
80	L	97.4	Very high	97.6	Very high	109 Å²	109	100.7 Å²	100.7	57%	0.571	50%	0.497	S	S	*	.	H	α-helix	trans	-67.1	-44.7	175.8	-71.5	172.4	0	0	0	111.6	E76 R77 Y78 Y82 K83 V84	E76-L80 WeakPolarHBondContact O-CB 3.44Å; E76-L80 VanDerWaalsContact O-CG 3.31Å; E76-L80 WeakPolarHBondContact O-CG 3.49Å; E76-L80 PolarHBondContact O-N 2.85Å; R77-L80 PolarHBondContact O-N 3.37Å; Y78-L80 PolarHBondContact O-N 2.9Å; L80-Y82 VanDerWaalsContact C-N 3.33Å; L80-Y82 PolarHBondContact O-N 3.05Å; L80-K83 PolarHBondContact O-N 2.89Å; L80-V84 WeakPolarHBondContact O-CG2 3.49Å; L80-V84 PolarHBondContact O-N 2.92Å
81	E	97.7	Very high	97.6	Very high	95 Å²	95	99.3 Å²	99.3	44%	0.444	49%	0.493	S	S	.	.	H	α-helix	trans	-58.6	-46.2	176.9	-177.4	173.2	-173	0	0	111	R77 Y78 K83 V84 I85	R77-E81 IonicContact NH1-OE2 2.69Å; R77-E81 PolarHBondContact NH1-OE2 2.95Å; R77-E81 WeakPolarHBondContact O-CB 3.19Å; R77-E81 PolarHBondContact O-N 3.22Å; Y78-E81 PolarHBondContact O-N 2.91Å; E81-K83 PolarHBondContact O-N 3.47Å; E81-V84 PolarHBondContact O-N 3.27Å; E81-I85 HydrophobicContact CG-CD1 4.05Å; E81-I85 WeakPolarHBondContact O-CG1 3.25Å; E81-I85 PolarHBondContact O-N 2.99Å
82	Y	97.9	Very high	97.6	Very high	130 Å²	130	100.4 Å²	100.4	51%	0.51	50%	0.499	S	S	.	.	H	α-helix	trans	-59.3	-45.1	176.5	-176.9	-103.2	0	0	0	112.4	Y78 L80 V84 I85 M86	Y78-Y82 WeakPolarHBondContact O-CB 3.26Å; Y78-Y82 PolarHBondContact O-N 3.02Å; L80-Y82 VanDerWaalsContact C-N 3.33Å; L80-Y82 PolarHBondContact O-N 3.05Å; Y82-V84 VanDerWaalsContact C-N 3.34Å; Y82-V84 PolarHBondContact O-N 2.94Å; Y82-I85 PolarHBondContact O-N 3.21Å; Y82-M86 HydrophobicContact CD1-CG 4.31Å; Y82-M86 HydrophobicContact CD1-SD 3.88Å; Y82-M86 HydrophobicContact CE1-CG 3.93Å; Y82-M86 HydrophobicContact CE1-SD 3.27Å; Y82-M86 WeakPolarHBondContact CE1-SD 3.33Å; Y82-M86 WeakPolarHBondContact O-CG 3.49Å; Y82-M86 PolarHBondContact O-N 2.98Å
83	K	98.1	Very high	97.5	Very high	130 Å²	130	100.1 Å²	100.1	57%	0.565	49%	0.494	S	S	*	.	H	α-helix	trans	-60.4	-42.4	175.5	-72.9	171.8	-175.9	175.2	0	112	N79 L80 E81 M86 V87	N79-K83 WeakPolarHBondContact O-CG 3.38Å; N79-K83 PolarHBondContact O-N 3.21Å; N79-K83 VanDerWaalsContact O-N 3.15Å; L80-K83 PolarHBondContact O-N 2.89Å; E81-K83 PolarHBondContact O-N 3.47Å; K83-M86 PolarHBondContact O-N 3.38Å; K83-V87 WeakPolarHBondContact O-CG2 3.4Å; K83-V87 PolarHBondContact O-N 3.49Å
84	V	98.3	Very high	97.5	Very high	90 Å²	90	99 Å²	99	55%	0.545	49%	0.49	S	S	.	.	H	α-helix	trans	-61.9	-45.6	176.5	171.1	0	0	0	0	110.5	L80 E81 Y82 M86 V87 C88	L80-V84 WeakPolarHBondContact O-CG2 3.49Å; L80-V84 PolarHBondContact O-N 2.92Å; E81-V84 PolarHBondContact O-N 3.27Å; Y82-V84 VanDerWaalsContact C-N 3.34Å; Y82-V84 PolarHBondContact O-N 2.94Å; V84-M86 VanDerWaalsContact C-N 3.34Å; V84-M86 PolarHBondContact O-N 2.88Å; V84-V87 PolarHBondContact O-N 3.34Å; V84-C88 WeakPolarHBondContact O-CB 3.49Å; V84-C88 PolarHBondContact O-N 3.06Å; V84-C88 PolarHBondContact O-SG 3.35Å; V84-C88 VanDerWaalsContact O-SG 3.33Å
85	I	97.9	Very high	97.3	Very high	80 Å²	80	99.3 Å²	99.3	41%	0.41	49%	0.491	S	S	.	.	H	α-helix	trans	-59.3	-45	177.5	-68.3	167.4	0	0	0	111	E81 Y82 V87 C88 N89	E81-I85 HydrophobicContact CG-CD1 4.05Å; E81-I85 WeakPolarHBondContact O-CG1 3.25Å; E81-I85 PolarHBondContact O-N 2.99Å; Y82-I85 PolarHBondContact O-N 3.21Å; I85-V87 PolarHBondContact O-N 3.43Å; I85-C88 PolarHBondContact O-N 2.98Å; I85-N89 WeakPolarHBondContact O-CB 3.36Å; I85-N89 VanDerWaalsContact O-CG 3.28Å; I85-N89 PolarHBondContact O-N 3.31Å; I85-N89 PolarHBondContact O-ND2 2.86Å
86	M	97.6	Very high	97	Very high	101 Å²	101	97.9 Å²	97.9	50%	0.498	49%	0.486	S	S	.	.	H	α-helix	trans	-57.8	-49.9	176.6	-72.9	-175	69.6	0	0	111.8	Y82 K83 V84 C88 N89 E90	Y82-M86 HydrophobicContact CD1-CG 4.31Å; Y82-M86 HydrophobicContact CD1-SD 3.88Å; Y82-M86 HydrophobicContact CE1-CG 3.93Å; Y82-M86 HydrophobicContact CE1-SD 3.27Å; Y82-M86 WeakPolarHBondContact CE1-SD 3.33Å; Y82-M86 WeakPolarHBondContact O-CG 3.49Å; Y82-M86 PolarHBondContact O-N 2.98Å; K83-M86 PolarHBondContact O-N 3.38Å; V84-M86 VanDerWaalsContact C-N 3.34Å; V84-M86 PolarHBondContact O-N 2.88Å; M86-C88 PolarHBondContact O-N 3.44Å; M86-N89 PolarHBondContact O-N 2.94Å; M86-E90 PolarHBondContact O-N 3.23Å
87	V	98.2	Very high	96.7	Very high	82 Å²	82	97.2 Å²	97.2	50%	0.497	48%	0.482	S	S	.	.	H	α-helix	trans	-64.3	-41.2	179.3	174.3	0	0	0	0	111	K83 V84 I85 N89 E90 V91	K83-V87 WeakPolarHBondContact O-CG2 3.4Å; K83-V87 PolarHBondContact O-N 3.49Å; V84-V87 PolarHBondContact O-N 3.34Å; I85-V87 PolarHBondContact O-N 3.43Å; V87-N89 VanDerWaalsContact C-N 3.34Å; V87-N89 PolarHBondContact O-N 3.06Å; V87-E90 PolarHBondContact O-N 3.25Å; V87-V91 HydrophobicContact CG1-CG2 4.32Å; V87-V91 WeakPolarHBondContact O-CB 3.42Å; V87-V91 VanDerWaalsContact O-CG2 3.28Å; V87-V91 WeakPolarHBondContact O-CG2 3.48Å; V87-V91 PolarHBondContact O-N 3.15Å
88	C	97.9	Very high	96.3	Very high	66 Å²	66	95.7 Å²	95.7	45%	0.446	48%	0.482	S	S	.	.	H	α-helix	trans	-59	-44.8	174.9	-77.9	0	0	0	0	111.8	V84 I85 M86 V91 L92	V84-C88 WeakPolarHBondContact O-CB 3.49Å; V84-C88 PolarHBondContact O-N 3.06Å; V84-C88 PolarHBondContact O-SG 3.35Å; V84-C88 VanDerWaalsContact O-SG 3.33Å; I85-C88 PolarHBondContact O-N 2.98Å; M86-C88 PolarHBondContact O-N 3.44Å; C88-V91 PolarHBondContact O-N 3.02Å; C88-L92 WeakPolarHBondContact O-CB 3.47Å; C88-L92 VanDerWaalsContact O-CG 3.28Å; C88-L92 WeakPolarHBondContact O-CG 3.38Å; C88-L92 PolarHBondContact O-N 2.63Å
89	N	97.7	Very high	95.8	Very high	95 Å²	95	92.9 Å²	92.9	51%	0.508	48%	0.479	S	S	.	.	H	α-helix	trans	-64.7	-41.2	177.4	-72.9	-24.8	0	0	0	111.9	I85 M86 V87 L92 D93	I85-N89 WeakPolarHBondContact O-CB 3.36Å; I85-N89 VanDerWaalsContact O-CG 3.28Å; I85-N89 PolarHBondContact O-N 3.31Å; I85-N89 PolarHBondContact O-ND2 2.86Å; M86-N89 PolarHBondContact O-N 2.94Å; V87-N89 VanDerWaalsContact C-N 3.34Å; V87-N89 PolarHBondContact O-N 3.06Å; N89-L92 WeakPolarHBondContact O-CB 3.46Å; N89-L92 PolarHBondContact O-N 2.94Å; N89-D93 PolarHBondContact O-N 3.47Å
90	E	97.6	Very high	95.3	Very high	119 Å²	119	94.9 Å²	94.9	56%	0.556	49%	0.49	S	S	*	.	H	α-helix	trans	-62.6	-46.3	174.9	-174.9	178	-178.5	0	0	111.4	M86 V87 L92 D93 L94	M86-E90 PolarHBondContact O-N 3.23Å; V87-E90 PolarHBondContact O-N 3.25Å; E90-L92 VanDerWaalsContact C-N 3.28Å; E90-L92 PolarHBondContact O-N 2.92Å; E90-D93 PolarHBondContact O-N 3.32Å; E90-L94 HydrophobicContact CG-CD1 4.11Å; E90-L94 HydrophobicContact CG-CG 4.42Å; E90-L94 WeakPolarHBondContact O-CB 3.34Å; E90-L94 VanDerWaalsContact O-CG 3.26Å; E90-L94 WeakPolarHBondContact O-CG 3.26Å; E90-L94 PolarHBondContact O-N 3.48Å
91	V	97.3	Very high	94.6	Very high	73 Å²	73	96.9 Å²	96.9	44%	0.442	50%	0.5	S	S	.	.	H	α-helix	trans	-60.9	-37.5	175.8	169.4	0	0	0	0	111.3	V87 C88 N95	V87-V91 HydrophobicContact CG1-CG2 4.32Å; V87-V91 WeakPolarHBondContact O-CB 3.42Å; V87-V91 VanDerWaalsContact O-CG2 3.28Å; V87-V91 WeakPolarHBondContact O-CG2 3.48Å; V87-V91 PolarHBondContact O-N 3.15Å; C88-V91 PolarHBondContact O-N 3.02Å; V91-N95 WeakPolarHBondContact CG1-ND2 3.27Å; V91-N95 WeakPolarHBondContact O-CB 3.39Å; V91-N95 VanDerWaalsContact O-CG 3.32Å; V91-N95 PolarHBondContact O-N 2.86Å; V91-N95 PolarHBondContact O-ND2 3.44Å
92	L	96.4	Very high	93.7	Very high	103 Å²	103	100.9 Å²	100.9	54%	0.539	51%	0.511	S	S	.	.	H	α-helix	trans	-64.4	-47.8	174.6	-75.5	170.8	0	0	0	111.7	C88 N89 E90 L94 N95 I96	C88-L92 WeakPolarHBondContact O-CB 3.47Å; C88-L92 VanDerWaalsContact O-CG 3.28Å; C88-L92 WeakPolarHBondContact O-CG 3.38Å; C88-L92 PolarHBondContact O-N 2.63Å; N89-L92 WeakPolarHBondContact O-CB 3.46Å; N89-L92 PolarHBondContact O-N 2.94Å; E90-L92 VanDerWaalsContact C-N 3.28Å; E90-L92 PolarHBondContact O-N 2.92Å; L92-L94 PolarHBondContact O-N 3.36Å; L92-N95 WeakPolarHBondContact O-CB 3.26Å; L92-N95 PolarHBondContact O-N 2.98Å; L92-I96 WeakPolarHBondContact O-CG1 3.36Å; L92-I96 PolarHBondContact O-N 2.77Å
93	D	95.9	Very high	92.2	Very high	73 Å²	73	96.4 Å²	96.4	39%	0.39	51%	0.505	S	S	.	.	H	α-helix	trans	-61.5	-43.8	177.2	-176.9	42	0	0	0	111.5	N89 E90 N95 I96 K97	N89-D93 PolarHBondContact O-N 3.47Å; E90-D93 PolarHBondContact O-N 3.32Å; D93-N95 VanDerWaalsContact C-N 3.34Å; D93-N95 PolarHBondContact O-N 2.96Å; D93-I96 PolarHBondContact O-N 2.99Å; D93-K97 WeakPolarHBondContact O-CG 3.43Å; D93-K97 PolarHBondContact O-N 2.97Å; D93-K97 WeakPolarHBondContact OD1-CE 3.4Å; D93-K97 IonicContact OD1-NZ 3.19Å; D93-K97 WeakPolarHBondContact OD2-CE 3.27Å; D93-K97 IonicContact OD2-NZ 2.76Å; D93-K97 PolarHBondContact OD2-NZ 2.93Å
94	L	96.1	Very high	90.3	Very high	80 Å²	80	99.2 Å²	99.2	42%	0.419	52%	0.517	S	S	.	.	H	α-helix	trans	-61.4	-41.2	174.3	-69.9	174.8	0	0	0	112	E90 L92 I96 K97 I98	E90-L94 HydrophobicContact CG-CD1 4.11Å; E90-L94 HydrophobicContact CG-CG 4.42Å; E90-L94 WeakPolarHBondContact O-CB 3.34Å; E90-L94 VanDerWaalsContact O-CG 3.26Å; E90-L94 WeakPolarHBondContact O-CG 3.26Å; E90-L94 PolarHBondContact O-N 3.48Å; L92-L94 PolarHBondContact O-N 3.36Å; L94-I96 VanDerWaalsContact C-N 3.35Å; L94-I96 PolarHBondContact O-N 3.32Å; L94-K97 PolarHBondContact O-N 3.49Å; L94-I98 WeakPolarHBondContact O-CB 3.48Å; L94-I98 VanDerWaalsContact O-CG1 3.25Å; L94-I98 WeakPolarHBondContact O-CG1 3.49Å; L94-I98 PolarHBondContact O-N 3.18Å
95	N	92.9	Very high	88.2	Confident	84 Å²	84	102.8 Å²	102.8	45%	0.449	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-40.5	175.4	-84.2	-49.9	0	0	0	112.1	V91 L92 D93 I98 V99	V91-N95 WeakPolarHBondContact CG1-ND2 3.27Å; V91-N95 WeakPolarHBondContact O-CB 3.39Å; V91-N95 VanDerWaalsContact O-CG 3.32Å; V91-N95 PolarHBondContact O-N 2.86Å; V91-N95 PolarHBondContact O-ND2 3.44Å; L92-N95 WeakPolarHBondContact O-CB 3.26Å; L92-N95 PolarHBondContact O-N 2.98Å; D93-N95 VanDerWaalsContact C-N 3.34Å; D93-N95 PolarHBondContact O-N 2.96Å; N95-I98 PolarHBondContact O-N 3.43Å; N95-V99 WeakPolarHBondContact O-CG2 3.44Å; N95-V99 PolarHBondContact O-N 3.22Å
96	I	91.1	Very high	86.4	Confident	99 Å²	99	108.2 Å²	108.2	51%	0.508	55%	0.546	S	S	.	.	H	α-helix	trans	-61.7	-49.3	174.7	-67.2	165.7	0	0	0	109.9	L92 D93 L94 I98 V99 D100	L92-I96 WeakPolarHBondContact O-CG1 3.36Å; L92-I96 PolarHBondContact O-N 2.77Å; D93-I96 PolarHBondContact O-N 2.99Å; L94-I96 VanDerWaalsContact C-N 3.35Å; L94-I96 PolarHBondContact O-N 3.32Å; I96-I98 VanDerWaalsContact C-N 3.32Å; I96-I98 PolarHBondContact O-N 3.18Å; I96-V99 WeakPolarHBondContact O-CB 3.37Å; I96-V99 PolarHBondContact O-N 2.95Å; I96-D100 PolarHBondContact O-N 3.28Å
97	K	91.4	Very high	84.4	Confident	98 Å²	98	110.4 Å²	110.4	43%	0.426	55%	0.553	S	S	.	*	H	α-helix	trans	-57.6	-42.9	176.3	-70.5	172.3	-171.7	163.9	0	112.1	D93 L94 V99 D100 L101	D93-K97 WeakPolarHBondContact O-CG 3.43Å; D93-K97 PolarHBondContact O-N 2.97Å; D93-K97 WeakPolarHBondContact OD1-CE 3.4Å; D93-K97 IonicContact OD1-NZ 3.19Å; D93-K97 WeakPolarHBondContact OD2-CE 3.27Å; D93-K97 IonicContact OD2-NZ 2.76Å; D93-K97 PolarHBondContact OD2-NZ 2.93Å; L94-K97 PolarHBondContact O-N 3.49Å; K97-V99 VanDerWaalsContact C-N 3.32Å; K97-V99 PolarHBondContact O-N 2.97Å; K97-D100 PolarHBondContact O-N 3.34Å; K97-L101 VanDerWaalsContact O-CB 3.26Å; K97-L101 WeakPolarHBondContact O-CB 2.87Å; K97-L101 WeakPolarHBondContact O-CG 3.13Å; K97-L101 PolarHBondContact O-N 3.44Å
98	I	90.2	Very high	82.8	Confident	89 Å²	89	111.8 Å²	111.8	46%	0.456	56%	0.564	S	S	.	*	H	α-helix	trans	-59.6	-45.1	175.5	-72.4	165.5	0	0	0	110.3	L94 N95 I96 L101 R102	L94-I98 WeakPolarHBondContact O-CB 3.48Å; L94-I98 VanDerWaalsContact O-CG1 3.25Å; L94-I98 WeakPolarHBondContact O-CG1 3.49Å; L94-I98 PolarHBondContact O-N 3.18Å; N95-I98 PolarHBondContact O-N 3.43Å; I96-I98 VanDerWaalsContact C-N 3.32Å; I96-I98 PolarHBondContact O-N 3.18Å; I98-L101 PolarHBondContact O-N 2.89Å; I98-R102 VanDerWaalsContact O-CB 3.26Å; I98-R102 WeakPolarHBondContact O-CB 3.19Å; I98-R102 PolarHBondContact O-N 3.28Å
99	V	87.1	Confident	81.3	Confident	85 Å²	85	112.6 Å²	112.6	52%	0.515	58%	0.576	S	S	.	*	H	α-helix	trans	-62.8	-43.2	178.6	169.7	0	0	0	0	111.6	N95 I96 K97	N95-V99 WeakPolarHBondContact O-CG2 3.44Å; N95-V99 PolarHBondContact O-N 3.22Å; I96-V99 WeakPolarHBondContact O-CB 3.37Å; I96-V99 PolarHBondContact O-N 2.95Å; K97-V99 VanDerWaalsContact C-N 3.32Å; K97-V99 PolarHBondContact O-N 2.97Å
100	D	85.7	Confident	79.7	Confident	112 Å²	112	115.2 Å²	115.2	60%	0.599	59%	0.589	S	S	*	*	H	α-helix	trans	-66.7	-43	178.7	-71.9	-22.2	0	0	0	111.9	I96 K97 G103	I96-D100 PolarHBondContact O-N 3.28Å; K97-D100 PolarHBondContact O-N 3.34Å; D100-G103 PolarHBondContact O-N 2.93Å
101	L	84.6	Confident	78.2	Confident	150 Å²	150	118.3 Å²	118.3	79%	0.785	60%	0.6	S	S	*	*	H	α-helix	trans	-69.4	-35.7	178.6	-73.1	174.3	0	0	0	113.5	K97 I98 G103	K97-L101 VanDerWaalsContact O-CB 3.26Å; K97-L101 WeakPolarHBondContact O-CB 2.87Å; K97-L101 WeakPolarHBondContact O-CG 3.13Å; K97-L101 PolarHBondContact O-N 3.44Å; I98-L101 PolarHBondContact O-N 2.89Å; L101-G103 PolarHBondContact O-N 3.09Å
102	R	77.3	Confident	76.9	Confident	179 Å²	179	124 Å²	124	68%	0.675	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-1.2	175.1	-145.1	167.5	69.5	-171	1.6	112.1	I98	I98-R102 VanDerWaalsContact O-CB 3.26Å; I98-R102 WeakPolarHBondContact O-CB 3.19Å; I98-R102 PolarHBondContact O-N 3.28Å
103	G	66.1	Low	75.4	Confident	37 Å²	37	125.3 Å²	125.3	38%	0.381	63%	0.631	S	S	.	*			trans	77.7	135.7	-174.8	0	0	0	0	0	108.7	D100 L101 F105	D100-G103 PolarHBondContact O-N 2.93Å; L101-G103 PolarHBondContact O-N 3.09Å; G103-F105 PolarHBondContact O-N 2.65Å
104	K	59	Low	74.3	Confident	188 Å²	188	132 Å²	132	82%	0.817	65%	0.651	S	S	*	*			trans	-54.5	79.4	162.9	-164.6	-175.9	-159.7	175.4	0	108.5	K106	K104-K106 PolarHBondContact O-N 3.47Å
105	F	55.1	Low	73	Confident	165 Å²	165	134 Å²	134	72%	0.724	66%	0.659	S	S	*	*			trans	-42.9	112.7	159.4	-99	-94	0	0	0	103.5	G103 K107	G103-F105 PolarHBondContact O-N 2.65Å; F105-K107 PolarHBondContact O-N 2.93Å
106	K	58.7	Low	72.1	Confident	194 Å²	194	133.3 Å²	133.3	84%	0.843	66%	0.661	S	S	*	*			trans	-35	108.3	-173.7	-80.6	-179	177.4	-179.5	0	106.8	K104 P108	K104-K106 PolarHBondContact O-N 3.47Å; K106-P108 WeakPolarHBondContact O-CD 3.5Å
107	K	56.6	Low	71	Confident	148 Å²	148	132 Å²	132	64%	0.643	67%	0.665	S	S	*	*			trans	-43.1	110.4	-178.8	-177.4	179.5	-174.1	176.4	0	104.4	F105 A109	F105-K107 PolarHBondContact O-N 2.93Å; K107-A109 PolarHBondContact O-N 3.23Å
108	P	63	Low	69.8	Low	111 Å²	111	131.5 Å²	131.5	72%	0.721	67%	0.667	S	S	*	*			trans	-52.3	122.1	-177.6	-26	33.1	0	0	0	104.7	K106 L110	K106-P108 WeakPolarHBondContact O-CD 3.5Å; P108-L110 PolarHBondContact O-N 3.09Å; P108-L110 VanDerWaalsContact O-N 3.09Å
109	A	67.8	Low	68.9	Low	83 Å²	83	128.9 Å²	128.9	69%	0.686	66%	0.659	S	S	*	*			trans	-45.8	128.1	-173.1	0	0	0	0	0	107.4	K107 K111	K107-A109 PolarHBondContact O-N 3.23Å; A109-K111 VanDerWaalsContact C-N 3.26Å; A109-K111 PolarHBondContact O-N 3.42Å
110	L	63	Low	68.2	Low	150 Å²	150	129.3 Å²	129.3	79%	0.785	66%	0.657	S	S	*	*			trans	-52.1	95	-173.5	-71.9	170.4	0	0	0	108.3	P108 K112	P108-L110 PolarHBondContact O-N 3.09Å; P108-L110 VanDerWaalsContact O-N 3.09Å; L110-K112 PolarHBondContact O-N 3.46Å
111	K	67.4	Low	67.3	Low	184 Å²	184	127.9 Å²	127.9	80%	0.8	65%	0.649	S	S	*	*			trans	-73.3	129.9	175.5	-80	-174.5	177.8	-179.4	0	104.8	A109 V113	A109-K111 VanDerWaalsContact C-N 3.26Å; A109-K111 PolarHBondContact O-N 3.42Å; K111-V113 WeakPolarHBondContact O-CG2 3.45Å; K111-V113 PolarHBondContact O-N 3.13Å
112	K	68.5	Low	66.6	Low	192 Å²	192	127.2 Å²	127.2	84%	0.835	64%	0.641	S	S	*	*			trans	-64.9	89.4	171.6	-163.4	172.9	-173.2	173.2	0	107.5	L110 R114	L110-K112 PolarHBondContact O-N 3.46Å; K112-R114 PolarHBondContact O-N 2.78Å; K112-R114 VanDerWaalsContact O-N 3.13Å
113	V	66.6	Low	66.4	Low	131 Å²	131	122.7 Å²	122.7	79%	0.794	64%	0.642	S	S	*	*			trans	-72.7	105.3	176.4	-176.7	0	0	0	0	106.2	K111	K111-V113 WeakPolarHBondContact O-CG2 3.45Å; K111-V113 PolarHBondContact O-N 3.13Å
114	R	72.6	Confident	66.7	Low	213 Å²	213	127 Å²	127	80%	0.804	66%	0.656	S	S	*	*			trans	-71.8	153.2	166	-69.4	179	168.2	175.4	-4	108	K112 S116	K112-R114 PolarHBondContact O-N 2.78Å; K112-R114 VanDerWaalsContact O-N 3.13Å; R114-S116 PolarHBondContact O-N 3.28Å
115	M	68	Low	67.2	Low	122 Å²	122	121.8 Å²	121.8	60%	0.601	64%	0.636	S	S	*	*			trans	-45.7	132.4	174.7	-73.7	-162.3	68.9	0	0	110.1	A119 M120	M115-A119 HydrophobicContact CE-CB 3.79Å; M115-M120 HydrophobicContact CB-CE 4.33Å
116	S	73.8	Confident	67.8	Low	70 Å²	70	115.9 Å²	115.9	49%	0.49	62%	0.622	S	S	.	*			trans	-60.1	146.8	176.1	62.2	0	0	0	0	109	R114 D118 A119 M120	R114-S116 PolarHBondContact O-N 3.28Å; S116-D118 PolarHBondContact O-N 3.16Å; S116-D118 VanDerWaalsContact O-N 3.15Å; S116-A119 PolarHBondContact O-N 2.87Å; S116-A119 VanDerWaalsContact O-N 3.11Å; S116-A119 VanDerWaalsContact OG-CB 3.26Å; S116-A119 WeakPolarHBondContact OG-CB 3.26Å; S116-A119 PolarHBondContact OG-N 3.11Å; S116-A119 VanDerWaalsContact OG-N 3.16Å; S116-M120 PolarHBondContact O-N 3.09Å
117	A	67.5	Low	68	Low	71 Å²	71	112.3 Å²	112.3	59%	0.587	62%	0.622	S	S	*	*	H	α-helix	trans	-53.7	-36.3	176.7	0	0	0	0	0	111	M120 L121	A117-M120 PolarHBondContact O-N 3.03Å; A117-L121 VanDerWaalsContact O-CB 3.23Å; A117-L121 WeakPolarHBondContact O-CB 3.33Å; A117-L121 WeakPolarHBondContact O-CD1 3.38Å; A117-L121 WeakPolarHBondContact O-CG 3.33Å; A117-L121 PolarHBondContact O-N 3.43Å
118	D	66.3	Low	68.2	Low	87 Å²	87	114.4 Å²	114.4	47%	0.465	63%	0.63	S	S	.	*	H	α-helix	trans	-65.5	-45.6	177.7	-161.3	39.6	0	0	0	112.9	S116 M120 L121 Q122	S116-D118 PolarHBondContact O-N 3.16Å; S116-D118 VanDerWaalsContact O-N 3.15Å; D118-M120 VanDerWaalsContact C-N 3.34Å; D118-M120 PolarHBondContact O-N 2.82Å; D118-L121 PolarHBondContact O-N 2.95Å; D118-Q122 WeakPolarHBondContact O-CB 3.32Å; D118-Q122 PolarHBondContact O-N 3.16Å
119	A	71.2	Confident	67.8	Low	35 Å²	35	114.3 Å²	114.3	29%	0.289	62%	0.62	S	S	.	*	H	α-helix	trans	-67	-36.6	176.4	0	0	0	0	0	112.1	M115 S116 A123	M115-A119 HydrophobicContact CE-CB 3.79Å; S116-A119 PolarHBondContact O-N 2.87Å; S116-A119 VanDerWaalsContact O-N 3.11Å; S116-A119 VanDerWaalsContact OG-CB 3.26Å; S116-A119 WeakPolarHBondContact OG-CB 3.26Å; S116-A119 PolarHBondContact OG-N 3.11Å; S116-A119 VanDerWaalsContact OG-N 3.16Å; A119-A123 WeakPolarHBondContact O-CB 3.23Å; A119-A123 PolarHBondContact O-N 3.47Å; A119-A123 VanDerWaalsContact O-N 3.16Å
120	M	73	Confident	67.2	Low	94 Å²	94	119.2 Å²	119.2	46%	0.463	63%	0.626	S	S	.	*	H	α-helix	trans	-68.7	-42.4	175.5	-171.8	-179.5	-70.1	0	0	111.4	M115 S116 A117 D118 A123 L124	M115-M120 HydrophobicContact CB-CE 4.33Å; S116-M120 PolarHBondContact O-N 3.09Å; A117-M120 PolarHBondContact O-N 3.03Å; D118-M120 VanDerWaalsContact C-N 3.34Å; D118-M120 PolarHBondContact O-N 2.82Å; M120-A123 PolarHBondContact O-N 3.36Å; M120-L124 HydrophobicContact CG-CD1 3.79Å; M120-L124 HydrophobicContact CG-CG 4.46Å; M120-L124 WeakPolarHBondContact O-CB 3.25Å; M120-L124 VanDerWaalsContact O-CG 3.25Å; M120-L124 WeakPolarHBondContact O-CG 3.36Å; M120-L124 PolarHBondContact O-N 3.37Å
121	L	67.4	Low	66.9	Low	82 Å²	82	116.2 Å²	116.2	43%	0.429	61%	0.614	S	S	.	*	H	α-helix	trans	-69.9	-39.4	179.2	-74.2	167.4	0	0	0	112.1	A117 D118 A123 L124 L125	A117-L121 VanDerWaalsContact O-CB 3.23Å; A117-L121 WeakPolarHBondContact O-CB 3.33Å; A117-L121 WeakPolarHBondContact O-CD1 3.38Å; A117-L121 WeakPolarHBondContact O-CG 3.33Å; A117-L121 PolarHBondContact O-N 3.43Å; D118-L121 PolarHBondContact O-N 2.95Å; L121-A123 VanDerWaalsContact C-N 3.32Å; L121-A123 PolarHBondContact O-N 2.96Å; L121-L124 PolarHBondContact O-N 3.43Å; L121-L125 HydrophobicContact CD2-CD1 3.64Å; L121-L125 HydrophobicContact CD2-CG 4.48Å; L121-L125 WeakPolarHBondContact O-CA 3.42Å; L121-L125 VanDerWaalsContact O-CB 3.29Å; L121-L125 WeakPolarHBondContact O-CB 3.29Å; L121-L125 PolarHBondContact O-N 3.46Å
122	Q	70.3	Confident	66.2	Low	136 Å²	136	110.9 Å²	110.9	64%	0.636	60%	0.597	S	S	*	*	H	α-helix	trans	-63.4	-39.4	174.4	-172.4	176.8	1.9	0	0	111.7	D118 G126	D118-Q122 WeakPolarHBondContact O-CB 3.32Å; D118-Q122 PolarHBondContact O-N 3.16Å; Q122-G126 WeakPolarHBondContact O-CA 3.13Å; Q122-G126 PolarHBondContact O-N 3.15Å; Q122-G126 VanDerWaalsContact O-N 3.09Å
123	A	72.2	Confident	65.6	Low	83 Å²	83	109 Å²	109	69%	0.686	59%	0.593	S	S	*	*	H	α-helix	trans	-70.2	-37.1	176.8	0	0	0	0	0	113	A119 M120 L121	A119-A123 WeakPolarHBondContact O-CB 3.23Å; A119-A123 PolarHBondContact O-N 3.47Å; A119-A123 VanDerWaalsContact O-N 3.16Å; M120-A123 PolarHBondContact O-N 3.36Å; L121-A123 VanDerWaalsContact C-N 3.32Å; L121-A123 PolarHBondContact O-N 2.96Å
124	L	72.5	Confident	65.2	Low	129 Å²	129	107.3 Å²	107.3	68%	0.675	58%	0.579	S	S	*	*	H	α-helix	trans	-85.1	-32.2	-177.7	-69.9	173.7	0	0	0	114	M120 L121	M120-L124 HydrophobicContact CG-CD1 3.79Å; M120-L124 HydrophobicContact CG-CG 4.46Å; M120-L124 WeakPolarHBondContact O-CB 3.25Å; M120-L124 VanDerWaalsContact O-CG 3.25Å; M120-L124 WeakPolarHBondContact O-CG 3.36Å; M120-L124 PolarHBondContact O-N 3.37Å; L121-L124 PolarHBondContact O-N 3.43Å
125	L	69.1	Low	64.5	Low	78 Å²	78	105 Å²	105	41%	0.408	58%	0.582	S	S	.	*	H	α-helix	trans	-116.7	-2.4	-169.9	-56.4	176.8	0	0	0	113.7	L121 K128 H129	L121-L125 HydrophobicContact CD2-CD1 3.64Å; L121-L125 HydrophobicContact CD2-CG 4.48Å; L121-L125 WeakPolarHBondContact O-CA 3.42Å; L121-L125 VanDerWaalsContact O-CB 3.29Å; L121-L125 WeakPolarHBondContact O-CB 3.29Å; L121-L125 PolarHBondContact O-N 3.46Å; L125-K128 PolarHBondContact O-N 2.78Å; L125-H129 HydrophobicContact CB-CB 4.3Å; L125-H129 HydrophobicContact CD1-CB 4.19Å
126	G	68.9	Low	64.1	Low	41 Å²	41	109.6 Å²	109.6	42%	0.423	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	55.9	-141.9	176.8	0	0	0	0	0	113	Q122 K128	Q122-G126 WeakPolarHBondContact O-CA 3.13Å; Q122-G126 PolarHBondContact O-N 3.15Å; Q122-G126 VanDerWaalsContact O-N 3.09Å; G126-K128 VanDerWaalsContact C-N 3.26Å; G126-K128 PolarHBondContact O-N 2.82Å
127	S	62.5	Low	63.5	Low	119 Å²	119	109.5 Å²	109.5	83%	0.832	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-73.1	-10.4	-175	72.5	0	0	0	0	115.1	H129	S127-H129 VanDerWaalsContact C-N 3.34Å; S127-H129 PolarHBondContact O-N 3.34Å
128	K	60.2	Low	63.2	Low	191 Å²	191	112.7 Å²	112.7	83%	0.83	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-73.6	-21.5	-173.3	-104.3	-178.5	177.8	180	0	113.9	L125 G126	L125-K128 PolarHBondContact O-N 2.78Å; G126-K128 VanDerWaalsContact C-N 3.26Å; G126-K128 PolarHBondContact O-N 2.82Å
129	H	55.5	Low	63.3	Low	109 Å²	109	114.6 Å²	114.6	51%	0.505	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-124.2	63.1	-179.9	-78.3	69.2	0	0	0	111.2	L125 S127 V131	L125-H129 HydrophobicContact CB-CB 4.3Å; L125-H129 HydrophobicContact CD1-CB 4.19Å; S127-H129 VanDerWaalsContact C-N 3.34Å; S127-H129 PolarHBondContact O-N 3.34Å; H129-V131 PolarHBondContact O-N 3.02Å
130	K	55.2	Low	62.9	Low	187 Å²	187	123 Å²	123	81%	0.813	64%	0.638	S	S	*	*			trans	-83.1	62	167.3	-158.2	178.2	-177.9	-177.8	0	109.8	T132	K130-T132 PolarHBondContact O-N 3.21Å
131	V	56.3	Low	62.4	Low	87 Å²	87	127.2 Å²	127.2	53%	0.527	66%	0.657	S	S	.	*			trans	-79.8	95.5	168.8	-179.4	0	0	0	0	105.8	H129 M133	H129-V131 PolarHBondContact O-N 3.02Å; V131-M133 PolarHBondContact O-N 3.07Å
132	T	53.4	Low	62.1	Low	71 Å²	71	129.8 Å²	129.8	44%	0.436	68%	0.676	S	S	.	*			trans	-59.7	116	166	54.5	0	0	0	0	106.2	K130 D134 S137	K130-T132 PolarHBondContact O-N 3.21Å; T132-D134 VanDerWaalsContact CB-OD2 3.32Å; T132-D134 WeakPolarHBondContact CB-OD2 3.49Å; T132-D134 PolarHBondContact O-N 3.27Å; T132-D134 PolarHBondContact OG1-OD2 2.95Å; T132-S137 PolarHBondContact O-OG 2.83Å
133	M	55.2	Low	61.4	Low	153 Å²	153	130.8 Å²	130.8	75%	0.754	68%	0.678	S	S	*	*			trans	-69.7	37.9	169.3	-67.2	-138.7	88.3	0	0	110.8	V131 L135	V131-M133 PolarHBondContact O-N 3.07Å; M133-L135 PolarHBondContact O-N 3.43Å
134	D	57.7	Low	60.4	Low	96 Å²	96	136.3 Å²	136.3	51%	0.513	69%	0.687	S	S	.	*			trans	-61.2	126.1	163.1	-73.5	-40.5	0	0	0	106.7	T132 R136 S137	T132-D134 VanDerWaalsContact CB-OD2 3.32Å; T132-D134 WeakPolarHBondContact CB-OD2 3.49Å; T132-D134 PolarHBondContact O-N 3.27Å; T132-D134 PolarHBondContact OG1-OD2 2.95Å; D134-R136 HydrophobicContact CB-CB 4.4Å; D134-R136 PolarHBondContact O-N 2.81Å; D134-S137 PolarHBondContact O-N 2.86Å; D134-S137 PolarHBondContact O-OG 3.47Å
135	L	58	Low	59.1	Low	163 Å²	163	136 Å²	136	85%	0.853	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.5	-18.4	175	-148	82.8	0	0	0	112.6	M133 L139	M133-L135 PolarHBondContact O-N 3.43Å; L135-L139 WeakPolarHBondContact O-CD1 3.5Å
136	R	59.7	Low	57.8	Low	219 Å²	219	141.1 Å²	141.1	83%	0.826	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-30.3	179.6	-130.2	-177.5	-178.3	106.3	0.2	114.4	D134 N138	D134-R136 HydrophobicContact CB-CB 4.4Å; D134-R136 PolarHBondContact O-N 2.81Å; R136-N138 VanDerWaalsContact C-N 3.33Å
137	S	61.5	Low	56.7	Low	69 Å²	69	148.9 Å²	148.9	48%	0.483	73%	0.73	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.2	-19.9	-174.6	58	0	0	0	0	113.1	T132 D134	T132-S137 PolarHBondContact O-OG 2.83Å; D134-S137 PolarHBondContact O-N 2.86Å; D134-S137 PolarHBondContact O-OG 3.47Å
138	N	60.5	Low	55.8	Low	138 Å²	138	152.3 Å²	152.3	74%	0.738	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-2	-179.6	-129.6	-30.9	0	0	0	113.9	R136	R136-N138 VanDerWaalsContact C-N 3.33Å
139	L	68.2	Low	54.9	Low	126 Å²	126	150.1 Å²	150.1	66%	0.66	72%	0.722	S	S	*	*	S	Bend	trans	-89.9	127.5	175.7	-72.4	164	0	0	0	109	L135 Q141	L135-L139 WeakPolarHBondContact O-CD1 3.5Å; L139-Q141 PolarHBondContact O-N 2.95Å
140	K	64.2	Low	54.5	Low	211 Å²	211	152.2 Å²	152.2	92%	0.917	74%	0.738	S	S	*	*			trans	-57.3	108.1	175	-77.9	-172.5	177.1	-176.7	0	109.5	V142	K140-V142 PolarHBondContact O-N 2.95Å
141	Q	62	Low	54.3	Low	183 Å²	183	152 Å²	152	86%	0.855	74%	0.737	S	S	*	*			trans	-71.6	115.2	171.3	-160.8	171.6	-13.7	0	0	107.4	L139 K143	L139-Q141 PolarHBondContact O-N 2.95Å; Q141-K143 PolarHBondContact O-N 3.31Å
142	V	60.8	Low	53.8	Low	136 Å²	136	155 Å²	155	82%	0.824	75%	0.745	S	S	*	*			trans	-65.1	104.1	171.7	177	0	0	0	0	106.3	K140 K144	K140-V142 PolarHBondContact O-N 2.95Å; V142-K144 PolarHBondContact O-N 3.23Å; V142-K144 VanDerWaalsContact O-N 3.1Å
143	K	55.3	Low	53.5	Low	158 Å²	158	158.9 Å²	158.9	69%	0.687	76%	0.762	S	S	*	*			trans	-62.7	112.4	167.8	-67.2	-177.5	179.2	179	0	106.6	Q141 D145	Q141-K143 PolarHBondContact O-N 3.31Å; K143-D145 VanDerWaalsContact CB-OD2 3.23Å; K143-D145 WeakPolarHBondContact CB-OD2 3.47Å; K143-D145 WeakPolarHBondContact CD-OD2 3.23Å; K143-D145 PolarHBondContact O-N 3.1Å
144	K	52.5	Low	53.3	Low	199 Å²	199	161.9 Å²	161.9	87%	0.865	77%	0.765	S	S	*	*			trans	-75.8	77	161.1	-170.4	177.2	-178.8	-178.8	0	105.6	V142 E146	V142-K144 PolarHBondContact O-N 3.23Å; V142-K144 VanDerWaalsContact O-N 3.1Å; K144-E146 PolarHBondContact O-N 3.17Å
145	D	44.1	Very low	53.2	Low	122 Å²	122	164.7 Å²	164.7	65%	0.652	78%	0.78	S	S	*	*			trans	-70.7	111.8	177.2	-74.7	-41.2	0	0	0	108.1	K143 K147	K143-D145 VanDerWaalsContact CB-OD2 3.23Å; K143-D145 WeakPolarHBondContact CB-OD2 3.47Å; K143-D145 WeakPolarHBondContact CD-OD2 3.23Å; K143-D145 PolarHBondContact O-N 3.1Å; D145-K147 VanDerWaalsContact C-N 3.34Å; D145-K147 PolarHBondContact O-N 2.96Å
146	E	42.5	Very low	52.9	Low	186 Å²	186	163.1 Å²	163.1	87%	0.869	78%	0.777	S	S	*	*			trans	-61.8	99.3	162	-70.9	-176.3	153.1	0	0	108.4	K144 K148	K144-E146 PolarHBondContact O-N 3.17Å; E146-K148 PolarHBondContact O-N 2.96Å; E146-K148 VanDerWaalsContact O-N 3.17Å
147	K	44.6	Very low	52.6	Low	204 Å²	204	155 Å²	155	89%	0.887	76%	0.761	S	S	*	*	S	Bend	trans	49.2	55.5	141.9	-128.2	-173	-167.8	-175.4	0	116.3	D145	D145-K147 VanDerWaalsContact C-N 3.34Å; D145-K147 PolarHBondContact O-N 2.96Å
148	K	43.7	Very low	52.3	Low	190 Å²	190	158.9 Å²	158.9	83%	0.826	78%	0.776	S	S	*	*			trans	-146.1	88.4	154.6	-74.7	-169.5	-179.1	173.5	0	109.9	E146	E146-K148 PolarHBondContact O-N 2.96Å; E146-K148 VanDerWaalsContact O-N 3.17Å
149	E	42.4	Very low	52.5	Low	145 Å²	145	163.8 Å²	163.8	68%	0.678	79%	0.785	S	S	*	*			trans	176.3	71.5	146.1	-96.5	161.3	-161	0	0	110	K151	E149-K151 PolarHBondContact O-N 2.99Å
150	D	47.8	Very low	52	Low	154 Å²	154	168.4 Å²	168.4	82%	0.824	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	26.6	170.7	-163.1	35.3	0	0	0	112.4
151	K	49	Very low	51.7	Low	183 Å²	183	167.8 Å²	167.8	80%	0.796	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.1	-19.2	-170.2	-122.5	178.6	-178	-178.6	0	115.7	E149	E149-K151 PolarHBondContact O-N 2.99Å
152	E	46.3	Very low	51.4	Low	149 Å²	149	166.7 Å²	166.7	70%	0.696	79%	0.791	S	S	*	*	S	Bend	trans	-99.4	-11.2	179.2	-67	-163	160.1	0	0	114.3	R154	E152-R154 VanDerWaalsContact C-N 3.34Å; E152-R154 PolarHBondContact O-N 3.47Å
153	L	48	Very low	51	Low	153 Å²	153	166.6 Å²	166.6	80%	0.801	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-80	-8.2	177.7	-96.8	102.8	0	0	0	115	D155	L153-D155 VanDerWaalsContact C-N 3.35Å
154	R	51.3	Low	51	Low	215 Å²	215	165.6 Å²	165.6	81%	0.811	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-77.4	-16.7	-177.3	-80.2	-173.9	-177.1	-162.1	0.5	114.4	E152	E152-R154 VanDerWaalsContact C-N 3.34Å; E152-R154 PolarHBondContact O-N 3.47Å
155	D	54.9	Low	51	Low	155 Å²	155	162.2 Å²	162.2	83%	0.829	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-99.5	5.6	-174.1	-78.7	-23.3	0	0	0	114.8	L153	L153-D155 VanDerWaalsContact C-N 3.35Å
156	V	51.7	Low	51.7	Low	131 Å²	131	164.6 Å²	164.6	79%	0.794	78%	0.782	S	S	*	*	S	Bend	trans	-105.3	77.4	175.6	-163.9	0	0	0	0	111
157	G	53.3	Low	52.2	Low	47 Å²	47	160.3 Å²	160.3	49%	0.485	78%	0.779	S	S	.	*			trans	75.1	75.8	144.1	0	0	0	0	0	118.2	W159	G157-W159 PolarHBondContact O-N 3.18Å
158	D	55.7	Low	52.9	Low	151 Å²	151	154 Å²	154	81%	0.807	77%	0.771	S	S	*	*			trans	-76.2	94.3	155.9	-169.6	1.6	0	0	0	109.5	R160	D158-R160 VanDerWaalsContact C-N 3.32Å; D158-R160 PolarHBondContact O-N 3.39Å; D158-R160 PolarHBondContact OD1-N 3.4Å
159	W	65.3	Low	53.5	Low	241 Å²	241	151.6 Å²	151.6	91%	0.913	77%	0.765	S	S	*	*			trans	-93.1	50.2	175.3	-76.4	-41.9	0	0	0	112.7	G157	G157-W159 PolarHBondContact O-N 3.18Å
160	R	56.7	Low	54.1	Low	223 Å²	223	152.8 Å²	152.8	84%	0.842	78%	0.776	S	S	*	*			trans	-116.3	78	159.5	-83.6	-172.4	170.5	118	-3.6	111.1	D158 N162	D158-R160 VanDerWaalsContact C-N 3.32Å; D158-R160 PolarHBondContact O-N 3.39Å; D158-R160 PolarHBondContact OD1-N 3.4Å; R160-N162 PolarHBondContact O-N 3.16Å; R160-N162 VanDerWaalsContact O-N 3.16Å
161	K	58.5	Low	54.7	Low	199 Å²	199	148 Å²	148	87%	0.865	76%	0.762	S	S	*	*			trans	-67.4	107	150.7	-90.2	-179.8	177.2	175.7	0	106.9	I163	K161-I163 PolarHBondContact O-N 2.93Å
162	N	55.6	Low	55.3	Low	159 Å²	159	150.8 Å²	150.8	85%	0.85	77%	0.768	S	S	*	*			trans	-52.7	101.2	173.3	-145	-10.3	0	0	0	108.6	R160	R160-N162 PolarHBondContact O-N 3.16Å; R160-N162 VanDerWaalsContact O-N 3.16Å
163	I	52.9	Low	56.1	Low	134 Å²	134	150.1 Å²	150.1	69%	0.687	76%	0.763	S	S	*	*			trans	-86	112.6	162.2	-71.4	174.3	0	0	0	104	K161 D165	K161-I163 PolarHBondContact O-N 2.93Å; I163-D165 PolarHBondContact O-N 2.82Å
164	D	55.2	Low	56.6	Low	137 Å²	137	151.2 Å²	151.2	73%	0.733	76%	0.761	S	S	*	*			trans	-69.4	76.8	173.7	-158.4	13.2	0	0	0	107.7	K166	D164-K166 PolarHBondContact O-N 2.99Å
165	D	52.3	Low	56.6	Low	128 Å²	128	148.4 Å²	148.4	68%	0.684	76%	0.759	S	S	*	*			trans	-64	104.3	169.3	-89.8	-20.3	0	0	0	106.4	I163 A167	I163-D165 PolarHBondContact O-N 2.82Å; D165-A167 PolarHBondContact O-N 3.29Å
166	K	57.3	Low	56.7	Low	173 Å²	173	149.4 Å²	149.4	75%	0.752	76%	0.756	S	S	*	*			trans	-64.1	45.5	168.2	-71	-177.9	176.4	166.8	0	112.1	D164 G168	D164-K166 PolarHBondContact O-N 2.99Å; K166-G168 PolarHBondContact O-N 2.72Å
167	A	54.7	Low	56.5	Low	96 Å²	96	151.5 Å²	151.5	79%	0.793	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	86.8	170.9	0	0	0	0	0	108.2	D165	D165-A167 PolarHBondContact O-N 3.29Å
168	G	58.5	Low	56.2	Low	71 Å²	71	152.5 Å²	152.5	73%	0.732	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	151.5	0.1	172.5	0	0	0	0	0	117.6	K166 D170	K166-G168 PolarHBondContact O-N 2.72Å; G168-D170 PolarHBondContact O-N 3.05Å
169	M	55.8	Low	55.6	Low	139 Å²	139	153.8 Å²	153.8	69%	0.685	78%	0.775	S	S	*	*			trans	-83.2	60.3	167.3	-85.9	-167.4	147.1	0	0	111.2	G171 K173	M169-G171 PolarHBondContact O-N 3.18Å; M169-K173 WeakPolarHBondContact SD-CE 3.09Å; M169-K173 PolarHBondContact SD-NZ 2.88Å; M169-K173 VanDerWaalsContact SD-NZ 3.43Å
170	D	55.4	Low	54.4	Low	171 Å²	171	153.6 Å²	153.6	91%	0.914	79%	0.792	S	S	*	*			trans	-85.5	69.6	167.7	-167.6	19.1	0	0	0	109.8	G168	G168-D170 PolarHBondContact O-N 3.05Å
171	G	60.4	Low	54.3	Low	52 Å²	52	150.1 Å²	150.1	54%	0.536	79%	0.789	S	S	.	*	S	Bend	trans	-169.9	128	178.9	0	0	0	0	0	110.9	M169 K173	M169-G171 PolarHBondContact O-N 3.18Å; G171-K173 PolarHBondContact O-N 3Å
172	R	60.9	Low	54.1	Low	243 Å²	243	147.5 Å²	147.5	92%	0.917	79%	0.785	S	S	*	*			trans	-50.5	111	178.3	-171.5	-178.4	-159.9	175.8	5.7	110	K174	R172-K174 PolarHBondContact O-N 3.43Å
173	K	63.8	Low	54	Low	134 Å²	134	146.9 Å²	146.9	58%	0.583	78%	0.781	S	S	*	*			trans	-60.8	112.3	167	-76.5	-178.8	177	175	0	108	M169 G171 M175	M169-K173 WeakPolarHBondContact SD-CE 3.09Å; M169-K173 PolarHBondContact SD-NZ 2.88Å; M169-K173 VanDerWaalsContact SD-NZ 3.43Å; G171-K173 PolarHBondContact O-N 3Å; K173-M175 PolarHBondContact O-N 3.06Å
174	K	58.5	Low	54.1	Low	177 Å²	177	147.6 Å²	147.6	77%	0.77	79%	0.787	S	S	*	*			trans	-65	89	167.7	-95.4	-176.2	173.7	-179.8	0	108	R172 F176	R172-K174 PolarHBondContact O-N 3.43Å; K174-F176 HydrophobicContact CB-CD2 4.47Å; K174-F176 HydrophobicContact CD-CD2 4.42Å; K174-F176 HydrophobicContact CD-CE2 3.89Å; K174-F176 HydrophobicContact CG-CD2 4.37Å; K174-F176 HydrophobicContact CG-CE2 4Å
175	M	52.3	Low	54	Low	156 Å²	156	148.3 Å²	148.3	77%	0.768	79%	0.79	S	S	*	*			trans	-92.5	102.5	155.6	-66.9	-71.3	-132.1	0	0	105.6	K173	K173-M175 PolarHBondContact O-N 3.06Å
176	F	55.3	Low	54.1	Low	176 Å²	176	149.7 Å²	149.7	77%	0.772	80%	0.797	S	S	*	*			trans	-89.4	102.3	159	-81.1	-83.1	0	0	0	106.2	K174	K174-F176 HydrophobicContact CB-CD2 4.47Å; K174-F176 HydrophobicContact CD-CD2 4.42Å; K174-F176 HydrophobicContact CD-CE2 3.89Å; K174-F176 HydrophobicContact CG-CD2 4.37Å; K174-F176 HydrophobicContact CG-CE2 4Å
177	Q	48.3	Very low	53.9	Low	174 Å²	174	148 Å²	148	81%	0.813	80%	0.801	S	S	*	*			trans	-105.6	109.6	155.2	-73.6	178.9	-16.1	0	0	104.5
178	G	47	Very low	53.9	Low	69 Å²	69	152 Å²	152	71%	0.711	80%	0.801	S	S	*	*			trans	-74.4	143.2	179.9	0	0	0	0	0	110.6	N180	G178-N180 PolarHBondContact O-N 3.24Å
179	D	43.3	Very low	53.5	Low	177 Å²	177	158.8 Å²	158.8	95%	0.947	81%	0.807	S	S	*	*			trans	-73.6	98.8	159.2	-70.7	-40.5	0	0	0	108
180	N	40.8	Very low	53.3	Low	237 Å²	237	160.5 Å²	160.5	100%	1.267	82%	0.818	S	S	*	*			trans	-173.2	0	134.8	-140.1	22.7	0	0	0	110.8	G178	G178-N180 PolarHBondContact O-N 3.24Å

Retrieved 180 of 180 residues in 84.5 ms (Link to these results)

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