G4VCS4_SCHMA Loading...

Pre-mRNA-splicing factor SYF2

AlphaFold DB , UniProt , Accession G4VCS4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 296 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	42.1	Very low	46.2	Very low	244 Å²	244	177.6 Å²	177.6	100%	1.202	85%	0.854	S	S	*	*				0	103.5	0	-86.8	163.4	124.1	0	0	108.6
2	T	42.6	Very low	46.6	Very low	141 Å²	141	181.1 Å²	181.1	87%	0.865	86%	0.855	S	S	*	*			trans	21	116.6	160	50.1	0	0	0	0	122.9
3	L	39.7	Very low	46.8	Very low	176 Å²	176	175.5 Å²	175.5	92%	0.921	85%	0.847	S	S	*	*			trans	-79.9	136.4	150	-90	95.9	0	0	0	111.3
4	R	46.5	Very low	46.6	Very low	255 Å²	255	172.5 Å²	172.5	96%	0.962	84%	0.838	S	S	*	*			trans	-179.1	129.7	156.9	-121.4	177.4	173.1	-161.8	-2.9	105.8
5	G	44.2	Very low	46.5	Very low	59 Å²	59	176 Å²	176	61%	0.608	84%	0.841	S	S	*	*			cis	142	119.2	18	0	0	0	0	0	105.3
6	Y	49	Very low	46.5	Very low	212 Å²	212	171.3 Å²	171.3	83%	0.831	84%	0.84	S	S	*	*			trans	-160.7	91.7	167.5	-93	-75.5	0	0	0	108.5
7	T	47.7	Very low	46.7	Very low	131 Å²	131	167.4 Å²	167.4	80%	0.804	83%	0.834	S	S	*	*			trans	-133.2	90.5	158.3	53.7	0	0	0	0	105.6	Y9	T7-Y9 PolarHBondContact O-N 3.19Å
8	D	47.9	Very low	46.9	Very low	129 Å²	129	166.7 Å²	166.7	69%	0.69	83%	0.833	S	S	*	*			trans	-71.2	105.6	172.7	-73.2	-28.5	0	0	0	108.4	Y10	D8-Y10 PolarHBondContact O-N 3.41Å
9	Y	48.1	Very low	47.4	Very low	221 Å²	221	165.3 Å²	165.3	87%	0.867	83%	0.829	S	S	*	*			trans	-86.8	101.9	174.6	-141.5	-95.9	0	0	0	107.3	T7 H11	T7-Y9 PolarHBondContact O-N 3.19Å; Y9-H11 PolarHBondContact O-N 3.1Å
10	Y	52	Low	47.9	Very low	201 Å²	201	163.5 Å²	163.5	79%	0.788	82%	0.822	S	S	*	*			trans	-69.6	110	173.6	-85.8	-88.2	0	0	0	109.8	D8 Y12	D8-Y10 PolarHBondContact O-N 3.41Å; Y10-Y12 PolarHBondContact O-N 3.27Å
11	H	48.3	Very low	48.3	Very low	185 Å²	185	160.1 Å²	160.1	86%	0.856	81%	0.807	S	S	*	*			trans	-66	109.2	164.2	-109.1	-67.1	0	0	0	109.1	Y9 S13	Y9-H11 PolarHBondContact O-N 3.1Å; H11-S13 PolarHBondContact O-N 3.09Å
12	Y	50.5	Low	49.3	Very low	219 Å²	219	153.7 Å²	153.7	86%	0.859	78%	0.777	S	S	*	*			trans	-77.2	112.8	161	-95.6	-92.6	0	0	0	108.2	Y10	Y10-Y12 PolarHBondContact O-N 3.27Å
13	S	49.4	Very low	50.8	Low	109 Å²	109	152.1 Å²	152.1	76%	0.762	76%	0.763	S	S	*	*			trans	-74.6	132	168.1	51.4	0	0	0	0	109.7	H11	H11-S13 PolarHBondContact O-N 3.09Å
14	N	43.5	Very low	52.2	Low	133 Å²	133	150.4 Å²	150.4	71%	0.711	75%	0.751	S	S	*	*			trans	-45.4	166.9	166.5	-75.1	-16.1	0	0	0	113.6
15	Y	45.6	Very low	53.5	Low	225 Å²	225	142.4 Å²	142.4	88%	0.882	73%	0.726	S	S	*	*			trans	103.5	79.5	164.1	-53.2	-70.9	0	0	0	115.7
16	A	47.3	Very low	55	Low	100 Å²	100	144.4 Å²	144.4	83%	0.826	72%	0.719	S	S	*	*	S	Bend		-178.4	118.2	128.8	0	0	0	0	0	112.4
17	S	48.8	Very low	56.4	Low	105 Å²	105	140.4 Å²	140.4	73%	0.734	71%	0.708	S	S	*	*			trans	63	88.9	158.3	-90.6	0	0	0	0	120.4	D19	S17-D19 VanDerWaalsContact C-N 3.3Å; S17-D19 PolarHBondContact O-N 3.17Å; S17-D19 VanDerWaalsContact O-N 3.09Å
18	D	50.6	Low	57.7	Low	155 Å²	155	140.8 Å²	140.8	83%	0.829	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	21.2	179.8	-95.7	-30.2	0	0	0	117.7
19	D	56.1	Low	59.4	Low	141 Å²	141	140.9 Å²	140.9	75%	0.754	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.1	-28.3	-179	-78.1	-39.1	0	0	0	115.3	S17	S17-D19 VanDerWaalsContact C-N 3.3Å; S17-D19 PolarHBondContact O-N 3.17Å; S17-D19 VanDerWaalsContact O-N 3.09Å
20	D	57	Low	61	Low	129 Å²	129	137.8 Å²	137.8	69%	0.69	68%	0.68	S	S	*	*	H	α-helix	trans	-78.9	-28.7	-179.4	-99.7	-28.1	0	0	0	113.1	N22 D23	D20-N22 PolarHBondContact O-N 2.88Å; D20-D23 PolarHBondContact O-N 3.47Å
21	D	58.1	Low	62.6	Low	93 Å²	93	134.8 Å²	134.8	50%	0.497	67%	0.671	S	S	.	*	H	α-helix	trans	-68.1	-24.1	-178.2	-71.5	-18.4	0	0	0	112.5	I25	D21-I25 WeakPolarHBondContact O-CB 3.46Å; D21-I25 WeakPolarHBondContact O-CD1 3.48Å; D21-I25 WeakPolarHBondContact O-CG1 3.43Å; D21-I25 PolarHBondContact O-N 3.42Å
22	N	62.8	Low	64.2	Low	108 Å²	108	129 Å²	129	58%	0.578	65%	0.649	S	S	*	*	H	α-helix	trans	-70.5	-37.8	-178.1	-128.1	-7	0	0	0	111.4	D20 E26	D20-N22 PolarHBondContact O-N 2.88Å; N22-E26 WeakPolarHBondContact O-CB 3.32Å; N22-E26 PolarHBondContact O-N 3.14Å
23	D	72.6	Confident	65.9	Low	108 Å²	108	123.5 Å²	123.5	58%	0.578	63%	0.631	S	S	*	*	H	α-helix	trans	-68.3	-40.7	177.4	-79	-14.4	0	0	0	111.4	D20 E26 E27	D20-D23 PolarHBondContact O-N 3.47Å; D23-E26 PolarHBondContact O-N 2.88Å; D23-E27 PolarHBondContact O-N 3.39Å
24	E	69.6	Low	67.6	Low	141 Å²	141	121.1 Å²	121.1	66%	0.659	62%	0.618	S	S	*	*	H	α-helix	trans	-67.7	-39.8	177.2	-169.7	172.4	-172.7	0	0	111.8	E26 E27 F28	E24-E26 VanDerWaalsContact C-N 3.32Å; E24-E26 PolarHBondContact O-N 3.35Å; E24-E27 PolarHBondContact O-N 2.98Å; E24-F28 WeakPolarHBondContact O-CB 3.35Å; E24-F28 PolarHBondContact O-N 2.95Å
25	I	73.5	Confident	69.5	Low	86 Å²	86	119 Å²	119	44%	0.441	61%	0.607	S	S	.	*	H	α-helix	trans	-64	-39.6	173.6	-68.9	165.9	0	0	0	110.7	D21 F28 K29	D21-I25 WeakPolarHBondContact O-CB 3.46Å; D21-I25 WeakPolarHBondContact O-CD1 3.48Å; D21-I25 WeakPolarHBondContact O-CG1 3.43Å; D21-I25 PolarHBondContact O-N 3.42Å; I25-F28 PolarHBondContact O-N 3.1Å; I25-K29 HydrophobicContact CG2-CD 4.31Å; I25-K29 WeakPolarHBondContact O-CG 3.37Å; I25-K29 PolarHBondContact O-N 3.15Å
26	E	76.5	Confident	71.4	Confident	101 Å²	101	115.1 Å²	115.1	47%	0.472	59%	0.591	S	S	.	*	H	α-helix	trans	-69.1	-38.9	178.4	-139.1	-167	-142.1	0	0	112	N22 D23 E24 K29 R30	N22-E26 WeakPolarHBondContact O-CB 3.32Å; N22-E26 PolarHBondContact O-N 3.14Å; D23-E26 PolarHBondContact O-N 2.88Å; E24-E26 VanDerWaalsContact C-N 3.32Å; E24-E26 PolarHBondContact O-N 3.35Å; E26-K29 PolarHBondContact O-N 3.29Å; E26-R30 WeakPolarHBondContact O-CG 3.4Å; E26-R30 PolarHBondContact O-N 2.95Å; E26-R30 IonicContact OE2-CZ 3.46Å; E26-R30 IonicContact OE2-NE 3.63Å; E26-R30 IonicContact OE2-NH2 2.77Å; E26-R30 PolarHBondContact OE2-NH2 2.88Å
27	E	77.4	Confident	73.4	Confident	128 Å²	128	118 Å²	118	60%	0.598	58%	0.584	S	S	*	*	H	α-helix	trans	-64.5	-42.7	172.9	-166.6	-177.2	173.2	0	0	111.4	D23 E24 K29 R30 K31	D23-E27 PolarHBondContact O-N 3.39Å; E24-E27 PolarHBondContact O-N 2.98Å; E27-K29 VanDerWaalsContact C-N 3.33Å; E27-K29 PolarHBondContact O-N 3.41Å; E27-R30 PolarHBondContact O-N 3.38Å; E27-K31 WeakPolarHBondContact O-CB 3.41Å; E27-K31 PolarHBondContact O-N 2.92Å
28	F	76.7	Confident	75.2	Confident	139 Å²	139	115.7 Å²	115.7	61%	0.61	57%	0.572	S	S	*	*	H	α-helix	trans	-61.2	-41.2	175.6	-171.9	-93.4	0	0	0	111.8	E24 I25 K31 T32	E24-F28 WeakPolarHBondContact O-CB 3.35Å; E24-F28 PolarHBondContact O-N 2.95Å; I25-F28 PolarHBondContact O-N 3.1Å; F28-K31 PolarHBondContact O-N 3.25Å; F28-T32 HydrophobicContact CD1-CG2 4Å; F28-T32 HydrophobicContact CE1-CG2 3.6Å; F28-T32 HydrophobicContact CZ-CG2 3.91Å; F28-T32 WeakPolarHBondContact O-CB 3.34Å; F28-T32 WeakPolarHBondContact O-CG2 3.4Å; F28-T32 PolarHBondContact O-N 3.04Å; F28-T32 PolarHBondContact O-OG1 2.92Å
29	K	82.8	Confident	76.7	Confident	132 Å²	132	117.5 Å²	117.5	57%	0.574	57%	0.567	S	S	*	*	H	α-helix	trans	-61.5	-45.8	172.6	-75.1	172.6	-177.1	170.5	0	111.5	I25 E26 E27 K31 T32 E33	I25-K29 HydrophobicContact CG2-CD 4.31Å; I25-K29 WeakPolarHBondContact O-CG 3.37Å; I25-K29 PolarHBondContact O-N 3.15Å; E26-K29 PolarHBondContact O-N 3.29Å; E27-K29 VanDerWaalsContact C-N 3.33Å; E27-K29 PolarHBondContact O-N 3.41Å; K29-K31 VanDerWaalsContact C-N 3.34Å; K29-K31 PolarHBondContact O-N 3.36Å; K29-T32 WeakPolarHBondContact CA-OG1 3.47Å; K29-T32 PolarHBondContact O-N 3.36Å; K29-T32 PolarHBondContact O-OG1 3.19Å; K29-E33 VanDerWaalsContact O-CB 3.26Å; K29-E33 WeakPolarHBondContact O-CB 3.39Å; K29-E33 PolarHBondContact O-N 2.99Å
30	R	82.1	Confident	78.2	Confident	155 Å²	155	115.4 Å²	115.4	59%	0.585	55%	0.553	S	S	*	*	H	α-helix	trans	-60.7	-41.6	175.5	-73.6	-175.1	-126.9	157	1.1	112.3	E26 E27 E33 A34	E26-R30 WeakPolarHBondContact O-CG 3.4Å; E26-R30 PolarHBondContact O-N 2.95Å; E26-R30 IonicContact OE2-CZ 3.46Å; E26-R30 IonicContact OE2-NE 3.63Å; E26-R30 IonicContact OE2-NH2 2.77Å; E26-R30 PolarHBondContact OE2-NH2 2.88Å; E27-R30 PolarHBondContact O-N 3.38Å; R30-E33 PolarHBondContact O-N 3.39Å; R30-A34 VanDerWaalsContact O-CB 3.3Å; R30-A34 WeakPolarHBondContact O-CB 3.48Å; R30-A34 PolarHBondContact O-N 2.84Å
31	K	84.4	Confident	79.8	Confident	139 Å²	139	115.4 Å²	115.4	60%	0.604	55%	0.547	S	S	*	.	H	α-helix	trans	-69.7	-36.4	-179.8	-170.5	173.4	-176.6	174.6	0	112.8	E27 F28 K29 N35	E27-K31 WeakPolarHBondContact O-CB 3.41Å; E27-K31 PolarHBondContact O-N 2.92Å; F28-K31 PolarHBondContact O-N 3.25Å; K29-K31 VanDerWaalsContact C-N 3.34Å; K29-K31 PolarHBondContact O-N 3.36Å; K31-N35 PolarHBondContact O-N 2.76Å; K31-N35 VanDerWaalsContact O-N 3.1Å; K31-N35 PolarHBondContact O-ND2 3.32Å; K31-N35 VanDerWaalsContact O-ND2 3.1Å
32	T	83.2	Confident	81	Confident	64 Å²	64	113.5 Å²	113.5	39%	0.393	54%	0.544	S	S	.	.	H	α-helix	trans	-71.7	-41.6	174.6	46.8	0	0	0	0	111.5	F28 K29 N35 R36	F28-T32 HydrophobicContact CD1-CG2 4Å; F28-T32 HydrophobicContact CE1-CG2 3.6Å; F28-T32 HydrophobicContact CZ-CG2 3.91Å; F28-T32 WeakPolarHBondContact O-CB 3.34Å; F28-T32 WeakPolarHBondContact O-CG2 3.4Å; F28-T32 PolarHBondContact O-N 3.04Å; F28-T32 PolarHBondContact O-OG1 2.92Å; K29-T32 WeakPolarHBondContact CA-OG1 3.47Å; K29-T32 PolarHBondContact O-N 3.36Å; K29-T32 PolarHBondContact O-OG1 3.19Å; T32-N35 PolarHBondContact O-N 3.17Å; T32-R36 PolarHBondContact O-N 3.35Å
33	E	86.1	Confident	82.1	Confident	103 Å²	103	117.3 Å²	117.3	48%	0.481	55%	0.55	S	S	.	*	H	α-helix	trans	-60.6	-43.8	173	-162.8	77.1	-135.2	0	0	111.7	K29 R30 N35 R36 K37	K29-E33 VanDerWaalsContact O-CB 3.26Å; K29-E33 WeakPolarHBondContact O-CB 3.39Å; K29-E33 PolarHBondContact O-N 2.99Å; R30-E33 PolarHBondContact O-N 3.39Å; E33-N35 PolarHBondContact O-N 3.25Å; E33-R36 WeakPolarHBondContact O-CB 3.47Å; E33-R36 PolarHBondContact O-N 2.81Å; E33-R36 IonicContact OE1-CZ 2.7Å; E33-R36 VanDerWaalsContact OE1-CZ 3.31Å; E33-R36 IonicContact OE1-NE 3.47Å; E33-R36 PolarHBondContact OE1-NE 2.97Å; E33-R36 VanDerWaalsContact OE1-NE 3.1Å; E33-R36 IonicContact OE1-NH2 3.91Å; E33-R36 PolarHBondContact OE1-NH2 2.92Å; E33-K37 PolarHBondContact O-N 2.98Å
34	A	85.4	Confident	82.8	Confident	59 Å²	59	116.4 Å²	116.4	49%	0.488	54%	0.543	S	S	.	.	H	α-helix	trans	-62.7	-42	176.1	0	0	0	0	0	112.2	R30 K37 A38	R30-A34 VanDerWaalsContact O-CB 3.3Å; R30-A34 WeakPolarHBondContact O-CB 3.48Å; R30-A34 PolarHBondContact O-N 2.84Å; A34-K37 PolarHBondContact O-N 3.33Å; A34-A38 WeakPolarHBondContact O-CB 3.34Å; A34-A38 PolarHBondContact O-N 3.41Å
35	N	82.9	Confident	83.5	Confident	89 Å²	89	114 Å²	114	48%	0.476	53%	0.531	S	S	.	.	H	α-helix	trans	-64.1	-39.9	173.9	-94.2	-66	0	0	0	112.4	K31 T32 E33 A38 R39	K31-N35 PolarHBondContact O-N 2.76Å; K31-N35 VanDerWaalsContact O-N 3.1Å; K31-N35 PolarHBondContact O-ND2 3.32Å; K31-N35 VanDerWaalsContact O-ND2 3.1Å; T32-N35 PolarHBondContact O-N 3.17Å; E33-N35 PolarHBondContact O-N 3.25Å; N35-A38 PolarHBondContact O-N 2.94Å; N35-R39 WeakPolarHBondContact O-CG 3.48Å; N35-R39 PolarHBondContact O-N 3.26Å
36	R	86	Confident	83.8	Confident	143 Å²	143	116.2 Å²	116.2	54%	0.54	54%	0.538	S	S	.	.	H	α-helix	trans	-59.3	-48.6	174.8	-171.5	-179.5	76.9	93.8	-5.1	110.6	T32 E33 A38 R39 E40	T32-R36 PolarHBondContact O-N 3.35Å; E33-R36 WeakPolarHBondContact O-CB 3.47Å; E33-R36 PolarHBondContact O-N 2.81Å; E33-R36 IonicContact OE1-CZ 2.7Å; E33-R36 VanDerWaalsContact OE1-CZ 3.31Å; E33-R36 IonicContact OE1-NE 3.47Å; E33-R36 PolarHBondContact OE1-NE 2.97Å; E33-R36 VanDerWaalsContact OE1-NE 3.1Å; E33-R36 IonicContact OE1-NH2 3.91Å; E33-R36 PolarHBondContact OE1-NH2 2.92Å; R36-A38 PolarHBondContact O-N 2.95Å; R36-R39 PolarHBondContact O-N 3.05Å; R36-E40 PolarHBondContact O-N 3.15Å
37	K	89.1	Confident	83.9	Confident	159 Å²	159	116.6 Å²	116.6	69%	0.691	54%	0.54	S	S	*	.	H	α-helix	trans	-64.5	-38	178.7	-166.8	173.9	-177.5	176.7	0	112.7	E33 A34 E40 K41	E33-K37 PolarHBondContact O-N 2.98Å; A34-K37 PolarHBondContact O-N 3.33Å; K37-E40 PolarHBondContact O-N 2.96Å; K37-K41 WeakPolarHBondContact O-CB 3.33Å; K37-K41 PolarHBondContact O-N 2.97Å
38	A	85.8	Confident	84	Confident	57 Å²	57	116.8 Å²	116.8	47%	0.471	54%	0.535	S	S	.	.	H	α-helix	trans	-64.6	-42.3	175.3	0	0	0	0	0	112.1	A34 N35 R36 K41 A42	A34-A38 WeakPolarHBondContact O-CB 3.34Å; A34-A38 PolarHBondContact O-N 3.41Å; N35-A38 PolarHBondContact O-N 2.94Å; R36-A38 PolarHBondContact O-N 2.95Å; A38-K41 PolarHBondContact O-N 3.46Å; A38-A42 PolarHBondContact O-N 2.94Å
39	R	83	Confident	83.9	Confident	193 Å²	193	114.7 Å²	114.7	73%	0.728	53%	0.53	S	S	*	.	H	α-helix	trans	-63.8	-40.8	175	-74.4	179	179.6	-172.4	0.4	112.3	N35 R36 A42 R43	N35-R39 WeakPolarHBondContact O-CG 3.48Å; N35-R39 PolarHBondContact O-N 3.26Å; R36-R39 PolarHBondContact O-N 3.05Å; R39-A42 PolarHBondContact O-N 2.9Å; R39-R43 PolarHBondContact O-N 3.1Å
40	E	87.4	Confident	83.3	Confident	97 Å²	97	112.7 Å²	112.7	45%	0.453	53%	0.525	S	S	.	.	H	α-helix	trans	-67.1	-40.2	178.6	-167.4	164.2	-162.7	0	0	112	R36 K37 R43 Q44	R36-E40 PolarHBondContact O-N 3.15Å; K37-E40 PolarHBondContact O-N 2.96Å; E40-R43 PolarHBondContact O-N 3.43Å; E40-Q44 WeakPolarHBondContact O-CG 3.39Å; E40-Q44 PolarHBondContact O-N 3.25Å
41	K	90.1	Very high	82.7	Confident	129 Å²	129	111.1 Å²	111.1	56%	0.561	52%	0.524	S	S	*	.	H	α-helix	trans	-61.4	-45.4	172.8	-172.3	-176.8	176.4	-167.4	0	112.2	K37 A38 R43 Q44 E45	K37-K41 WeakPolarHBondContact O-CB 3.33Å; K37-K41 PolarHBondContact O-N 2.97Å; A38-K41 PolarHBondContact O-N 3.46Å; K41-R43 VanDerWaalsContact C-N 3.28Å; K41-R43 PolarHBondContact O-N 2.73Å; K41-Q44 PolarHBondContact O-N 3.37Å; K41-E45 WeakPolarHBondContact CE-OE1 3.37Å; K41-E45 IonicContact NZ-OE1 3.64Å; K41-E45 PolarHBondContact O-N 2.91Å
42	A	84.6	Confident	81.8	Confident	54 Å²	54	111 Å²	111	45%	0.446	52%	0.524	S	S	.	.	H	α-helix	trans	-62.2	-36.4	177	0	0	0	0	0	112.1	A38 R39 E45 F46	A38-A42 PolarHBondContact O-N 2.94Å; R39-A42 PolarHBondContact O-N 2.9Å; A42-E45 PolarHBondContact O-N 3.29Å; A42-F46 WeakPolarHBondContact O-CB 3.43Å; A42-F46 PolarHBondContact O-N 3.28Å
43	R	84.8	Confident	80.8	Confident	187 Å²	187	111.5 Å²	111.5	71%	0.706	53%	0.53	S	S	*	.	H	α-helix	trans	-66	-43	175.1	-168.6	178.7	178.6	-140.3	-3.5	112	R39 E40 K41 F46 E47	R39-R43 PolarHBondContact O-N 3.1Å; E40-R43 PolarHBondContact O-N 3.43Å; K41-R43 VanDerWaalsContact C-N 3.28Å; K41-R43 PolarHBondContact O-N 2.73Å; R43-F46 PolarHBondContact O-N 2.96Å; R43-E47 PolarHBondContact O-N 3.23Å
44	Q	87.4	Confident	79.5	Confident	89 Å²	89	110.1 Å²	110.1	42%	0.416	54%	0.536	S	S	.	.	H	α-helix	trans	-66.1	-37.7	176.1	-71.3	180	10.2	0	0	112.6	E40 K41 E47 R48	E40-Q44 WeakPolarHBondContact O-CG 3.39Å; E40-Q44 PolarHBondContact O-N 3.25Å; K41-Q44 PolarHBondContact O-N 3.37Å; Q44-E47 PolarHBondContact O-N 3.19Å; Q44-R48 WeakPolarHBondContact O-CG 3.26Å; Q44-R48 PolarHBondContact O-N 2.9Å; Q44-R48 VanDerWaalsContact O-N 3.08Å
45	E	84.2	Confident	78.2	Confident	91 Å²	91	115.3 Å²	115.3	43%	0.425	55%	0.55	S	S	.	*	H	α-helix	trans	-62.9	-44.1	173.8	-77.7	174.5	-174.9	0	0	111.1	K41 A42 E47 R48 D49	K41-E45 WeakPolarHBondContact CE-OE1 3.37Å; K41-E45 IonicContact NZ-OE1 3.64Å; K41-E45 PolarHBondContact O-N 2.91Å; A42-E45 PolarHBondContact O-N 3.29Å; E45-E47 PolarHBondContact O-N 3Å; E45-R48 PolarHBondContact O-N 3.42Å; E45-D49 PolarHBondContact O-N 3.42Å
46	F	79.2	Confident	77.1	Confident	133 Å²	133	114.8 Å²	114.8	58%	0.583	55%	0.553	S	S	*	*	H	α-helix	trans	-62.6	-39.5	176.2	-175.2	-106.2	0	0	0	113.2	A42 R43 D49 I50	A42-F46 WeakPolarHBondContact O-CB 3.43Å; A42-F46 PolarHBondContact O-N 3.28Å; R43-F46 PolarHBondContact O-N 2.96Å; F46-D49 PolarHBondContact O-N 3.34Å; F46-I50 HydrophobicContact CD1-CD1 3.66Å; F46-I50 HydrophobicContact CD1-CG1 4.46Å; F46-I50 HydrophobicContact CE1-CD1 3.25Å; F46-I50 HydrophobicContact CE1-CG1 4.18Å; F46-I50 HydrophobicContact CG-CD1 4.5Å; F46-I50 HydrophobicContact CZ-CD1 3.78Å; F46-I50 HydrophobicContact CZ-CG1 4.31Å; F46-I50 WeakPolarHBondContact O-CG1 3.34Å; F46-I50 PolarHBondContact O-N 3.47Å
47	E	80.2	Confident	75.9	Confident	109 Å²	109	111 Å²	111	51%	0.509	54%	0.543	S	S	.	.	H	α-helix	trans	-66	-40.9	177.4	-166.6	162	-151.5	0	0	111.8	R43 Q44 E45 D49 I50 E51	R43-E47 PolarHBondContact O-N 3.23Å; Q44-E47 PolarHBondContact O-N 3.19Å; E45-E47 PolarHBondContact O-N 3Å; E47-D49 VanDerWaalsContact C-N 3.32Å; E47-D49 PolarHBondContact O-N 2.98Å; E47-I50 PolarHBondContact O-N 2.91Å; E47-E51 PolarHBondContact O-N 2.96Å
48	R	78.7	Confident	74.6	Confident	131 Å²	131	107.4 Å²	107.4	49%	0.494	54%	0.544	S	S	.	.	H	α-helix	trans	-64.1	-35.8	172.2	-70.3	-174.8	-157.2	122.7	6.3	112.8	Q44 E45 I50 E51 K52	Q44-R48 WeakPolarHBondContact O-CG 3.26Å; Q44-R48 PolarHBondContact O-N 2.9Å; Q44-R48 VanDerWaalsContact O-N 3.08Å; E45-R48 PolarHBondContact O-N 3.42Å; R48-I50 VanDerWaalsContact C-N 3.35Å; R48-E51 PolarHBondContact O-N 2.91Å; R48-K52 WeakPolarHBondContact O-CB 3.44Å; R48-K52 WeakPolarHBondContact O-CG 3.27Å; R48-K52 PolarHBondContact O-N 3.28Å
49	D	75	Confident	73.4	Confident	95 Å²	95	112.8 Å²	112.8	51%	0.508	55%	0.552	S	S	.	*	H	α-helix	trans	-69.6	-34.7	176.5	-74.3	-13.5	0	0	0	111.6	E45 F46 E47 S53	E45-D49 PolarHBondContact O-N 3.42Å; F46-D49 PolarHBondContact O-N 3.34Å; E47-D49 VanDerWaalsContact C-N 3.32Å; E47-D49 PolarHBondContact O-N 2.98Å; D49-S53 WeakPolarHBondContact O-CB 3.41Å; D49-S53 PolarHBondContact O-N 3.3Å
50	I	69.3	Low	72.9	Confident	90 Å²	90	107.7 Å²	107.7	46%	0.462	54%	0.537	S	S	.	.	H	α-helix	trans	-65.5	-45	170.7	-69.8	168.5	0	0	0	110.7	F46 E47 R48 S53 A54	F46-I50 HydrophobicContact CD1-CD1 3.66Å; F46-I50 HydrophobicContact CD1-CG1 4.46Å; F46-I50 HydrophobicContact CE1-CD1 3.25Å; F46-I50 HydrophobicContact CE1-CG1 4.18Å; F46-I50 HydrophobicContact CG-CD1 4.5Å; F46-I50 HydrophobicContact CZ-CD1 3.78Å; F46-I50 HydrophobicContact CZ-CG1 4.31Å; F46-I50 WeakPolarHBondContact O-CG1 3.34Å; F46-I50 PolarHBondContact O-N 3.47Å; E47-I50 PolarHBondContact O-N 2.91Å; R48-I50 VanDerWaalsContact C-N 3.35Å; I50-S53 CarbonylContact O-C 3.22Å; I50-S53 PolarHBondContact O-N 3.39Å; I50-A54 WeakPolarHBondContact O-CB 3.46Å; I50-A54 PolarHBondContact O-N 3.48Å
51	E	69.1	Low	72.1	Confident	122 Å²	122	107.2 Å²	107.2	57%	0.57	54%	0.542	S	S	*	.	H	α-helix	trans	-61.4	-45	177.7	-76	179.2	164.6	0	0	111.7	E47 R48 S53 A54 E55	E47-E51 PolarHBondContact O-N 2.96Å; R48-E51 PolarHBondContact O-N 2.91Å; E51-S53 VanDerWaalsContact C-N 3.31Å; E51-S53 PolarHBondContact O-N 2.96Å; E51-A54 PolarHBondContact O-N 2.9Å; E51-E55 PolarHBondContact O-N 3.46Å
52	K	67.4	Low	71.4	Confident	137 Å²	137	103.6 Å²	103.6	60%	0.596	54%	0.536	S	S	*	.	H	α-helix	trans	-61.2	-38.7	173.5	-74.6	175.7	-177.6	174	0	112.7	R48 S56	R48-K52 WeakPolarHBondContact O-CB 3.44Å; R48-K52 WeakPolarHBondContact O-CG 3.27Å; R48-K52 PolarHBondContact O-N 3.28Å; K52-S56 PolarHBondContact O-N 3.3Å; K52-S56 VanDerWaalsContact O-N 3.11Å; K52-S56 PolarHBondContact O-OG 2.92Å
53	S	60.9	Low	71	Confident	75 Å²	75	108 Å²	108	52%	0.524	54%	0.541	S	S	.	.	H	α-helix	trans	-69.9	-35.5	177.2	-175.1	0	0	0	0	112.1	D49 I50 E51 S56	D49-S53 WeakPolarHBondContact O-CB 3.41Å; D49-S53 PolarHBondContact O-N 3.3Å; I50-S53 CarbonylContact O-C 3.22Å; I50-S53 PolarHBondContact O-N 3.39Å; E51-S53 VanDerWaalsContact C-N 3.31Å; E51-S53 PolarHBondContact O-N 2.96Å; S53-S56 WeakPolarHBondContact CA-OG 3.41Å; S53-S56 CarbonylContact O-C 3.58Å; S53-S56 PolarHBondContact O-N 3.26Å; S53-S56 VanDerWaalsContact O-O 3.04Å; S53-S56 PolarHBondContact O-OG 3.46Å
54	A	60.1	Low	70.8	Confident	73 Å²	73	107.8 Å²	107.8	60%	0.603	54%	0.54	S	S	*	.	H	α-helix	trans	-69.8	-34.7	175.6	0	0	0	0	0	112.2	I50 E51 S56	I50-A54 WeakPolarHBondContact O-CB 3.46Å; I50-A54 PolarHBondContact O-N 3.48Å; E51-A54 PolarHBondContact O-N 2.9Å; A54-S56 VanDerWaalsContact C-N 3.34Å
55	E	58.2	Low	70.4	Confident	169 Å²	169	106.2 Å²	106.2	79%	0.79	54%	0.543	S	S	*	.	H	α-helix	trans	-67.8	-33.1	170.2	-74.8	-179.6	166.2	0	0	112.1	E51 D57	E51-E55 PolarHBondContact O-N 3.46Å; E55-D57 PolarHBondContact O-N 3.31Å; E55-D57 VanDerWaalsContact O-N 3.08Å
56	S	58.9	Low	70.3	Confident	77 Å²	77	105.1 Å²	105.1	54%	0.538	55%	0.545	S	S	.	.	S	Bend	trans	-83.8	62.2	167.3	73	0	0	0	0	111.3	K52 S53 A54 A58	K52-S56 PolarHBondContact O-N 3.3Å; K52-S56 VanDerWaalsContact O-N 3.11Å; K52-S56 PolarHBondContact O-OG 2.92Å; S53-S56 WeakPolarHBondContact CA-OG 3.41Å; S53-S56 CarbonylContact O-C 3.58Å; S53-S56 PolarHBondContact O-N 3.26Å; S53-S56 VanDerWaalsContact O-O 3.04Å; S53-S56 PolarHBondContact O-OG 3.46Å; A54-S56 VanDerWaalsContact C-N 3.34Å; S56-A58 PolarHBondContact O-N 2.99Å
57	D	60.7	Low	70.6	Confident	63 Å²	63	103 Å²	103	34%	0.337	54%	0.54	S	S	.	.			trans	-48	108.8	175.9	-177.6	10.8	0	0	0	109	E55 R59 Q60 P61	E55-D57 PolarHBondContact O-N 3.31Å; E55-D57 VanDerWaalsContact O-N 3.08Å; D57-R59 PolarHBondContact O-N 3.48Å; D57-R59 WeakPolarHBondContact OD1-CB 3.41Å; D57-R59 WeakPolarHBondContact OD1-CG 3.42Å; D57-R59 PolarHBondContact OD1-N 3.39Å; D57-Q60 HydrophobicContact CB-CG 4.01Å; D57-Q60 WeakPolarHBondContact O-CB 3.48Å; D57-Q60 PolarHBondContact O-N 3.08Å; D57-P61 WeakPolarHBondContact O-CD 3.38Å
58	A	61	Low	70.9	Confident	85 Å²	85	100.4 Å²	100.4	70%	0.702	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-13.4	-176.3	0	0	0	0	0	112.5	S56	S56-A58 PolarHBondContact O-N 2.99Å
59	R	62.5	Low	71.2	Confident	170 Å²	170	97.5 Å²	97.5	64%	0.642	53%	0.534	S	S	*	.	H	α-helix	trans	-74.6	-25.2	172	-59	177.5	176.7	-150.9	-2.1	113.4	D57 A62 R63	D57-R59 PolarHBondContact O-N 3.48Å; D57-R59 WeakPolarHBondContact OD1-CB 3.41Å; D57-R59 WeakPolarHBondContact OD1-CG 3.42Å; D57-R59 PolarHBondContact OD1-N 3.39Å; R59-A62 PolarHBondContact O-N 2.7Å; R59-R63 WeakPolarHBondContact O-CB 3.36Å; R59-R63 VanDerWaalsContact O-CG 3.28Å; R59-R63 WeakPolarHBondContact O-CG 3.19Å; R59-R63 PolarHBondContact O-N 3.5Å
60	Q	71.2	Confident	71.7	Confident	86 Å²	86	97.9 Å²	97.9	40%	0.402	54%	0.536	S	S	.	.	H	α-helix	trans	-65.4	-47.6	-179.2	-68.4	-70.8	-19.4	0	0	112.6	D57 A62 R63 R64	D57-Q60 HydrophobicContact CB-CG 4.01Å; D57-Q60 WeakPolarHBondContact O-CB 3.48Å; D57-Q60 PolarHBondContact O-N 3.08Å; Q60-A62 VanDerWaalsContact C-N 3.3Å; Q60-A62 PolarHBondContact O-N 2.78Å; Q60-R63 PolarHBondContact O-N 2.88Å; Q60-R64 WeakPolarHBondContact O-CB 3.28Å; Q60-R64 WeakPolarHBondContact O-CG 3.25Å; Q60-R64 PolarHBondContact O-N 2.79Å
61	P	71.9	Confident	72.6	Confident	86 Å²	86	98.3 Å²	98.3	56%	0.558	54%	0.539	S	S	*	.	H	α-helix	trans	-59.8	-39.5	172.1	-23.5	33.4	0	0	0	112.7	D57 R64 A65	D57-P61 WeakPolarHBondContact O-CD 3.38Å; P61-R64 PolarHBondContact O-N 3.12Å; P61-A65 VanDerWaalsContact O-CB 3.3Å; P61-A65 WeakPolarHBondContact O-CB 3.47Å; P61-A65 PolarHBondContact O-N 3.39Å
62	A	73.9	Confident	73.5	Confident	54 Å²	54	98.8 Å²	98.8	45%	0.446	54%	0.541	S	S	.	.	H	α-helix	trans	-67.6	-37.9	178.8	0	0	0	0	0	112.6	R59 Q60 S66	R59-A62 PolarHBondContact O-N 2.7Å; Q60-A62 VanDerWaalsContact C-N 3.3Å; Q60-A62 PolarHBondContact O-N 2.78Å; A62-S66 WeakPolarHBondContact O-CB 3.48Å; A62-S66 PolarHBondContact O-N 2.89Å; A62-S66 PolarHBondContact O-OG 3.11Å
63	R	75.7	Confident	74.4	Confident	145 Å²	145	99.2 Å²	99.2	55%	0.547	54%	0.543	S	S	.	.	H	α-helix	trans	-64.6	-50.8	172.3	-75.7	176.8	-176.5	-147.2	2.7	110.7	R59 Q60 A65 S66 D67	R59-R63 WeakPolarHBondContact O-CB 3.36Å; R59-R63 VanDerWaalsContact O-CG 3.28Å; R59-R63 WeakPolarHBondContact O-CG 3.19Å; R59-R63 PolarHBondContact O-N 3.5Å; Q60-R63 PolarHBondContact O-N 2.88Å; R63-A65 VanDerWaalsContact C-N 3.28Å; R63-A65 PolarHBondContact O-N 2.89Å; R63-S66 CarbonylContact O-C 3.6Å; R63-S66 WeakPolarHBondContact O-CB 3.42Å; R63-S66 PolarHBondContact O-N 3.48Å; R63-D67 WeakPolarHBondContact O-CB 3.31Å; R63-D67 PolarHBondContact O-N 2.83Å
64	R	81.1	Confident	75.7	Confident	183 Å²	183	99 Å²	99	69%	0.691	54%	0.536	S	S	*	.	H	α-helix	trans	-57.8	-39.4	176.4	-71.3	-179.5	-177.3	-176	1.3	112.6	Q60 P61 A68	Q60-R64 WeakPolarHBondContact O-CB 3.28Å; Q60-R64 WeakPolarHBondContact O-CG 3.25Å; Q60-R64 PolarHBondContact O-N 2.79Å; P61-R64 PolarHBondContact O-N 3.12Å; R64-A68 WeakPolarHBondContact O-CB 3.49Å; R64-A68 PolarHBondContact O-N 3.25Å
65	A	79.5	Confident	77.2	Confident	57 Å²	57	99.9 Å²	99.9	47%	0.471	53%	0.528	S	S	.	.	H	α-helix	trans	-66.8	-42.6	175.4	0	0	0	0	0	111.9	P61 R63 A68 V69	P61-A65 VanDerWaalsContact O-CB 3.3Å; P61-A65 WeakPolarHBondContact O-CB 3.47Å; P61-A65 PolarHBondContact O-N 3.39Å; R63-A65 VanDerWaalsContact C-N 3.28Å; R63-A65 PolarHBondContact O-N 2.89Å; A65-A68 PolarHBondContact O-N 2.77Å; A65-V69 WeakPolarHBondContact O-CG2 3.49Å; A65-V69 PolarHBondContact O-N 3.41Å; A65-V69 VanDerWaalsContact O-N 3.08Å
66	S	82.4	Confident	78.7	Confident	68 Å²	68	94.3 Å²	94.3	48%	0.476	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-44	175.6	-55.9	0	0	0	0	111.6	A62 R63 A68 V69 L70	A62-S66 WeakPolarHBondContact O-CB 3.48Å; A62-S66 PolarHBondContact O-N 2.89Å; A62-S66 PolarHBondContact O-OG 3.11Å; R63-S66 CarbonylContact O-C 3.6Å; R63-S66 WeakPolarHBondContact O-CB 3.42Å; R63-S66 PolarHBondContact O-N 3.48Å; S66-A68 VanDerWaalsContact C-N 3.35Å; S66-A68 PolarHBondContact O-N 3.32Å; S66-V69 PolarHBondContact O-N 3.01Å; S66-L70 WeakPolarHBondContact O-CG 3.48Å; S66-L70 PolarHBondContact O-N 3.36Å
67	D	84.5	Confident	80.1	Confident	87 Å²	87	99.2 Å²	99.2	47%	0.465	52%	0.517	S	S	.	.	H	α-helix	trans	-64.3	-39.8	178.3	-65	-21.9	0	0	0	111.3	R63 L70 N71	R63-D67 WeakPolarHBondContact O-CB 3.31Å; R63-D67 PolarHBondContact O-N 2.83Å; D67-L70 PolarHBondContact O-N 3.07Å; D67-N71 WeakPolarHBondContact O-CB 3.3Å; D67-N71 PolarHBondContact O-N 2.96Å; D67-N71 PolarHBondContact O-ND2 3.43Å
68	A	86.5	Confident	81.6	Confident	56 Å²	56	102.5 Å²	102.5	46%	0.463	53%	0.531	S	S	.	.	H	α-helix	trans	-62.9	-43.3	175.4	0	0	0	0	0	112.2	R64 A65 S66 N71 E72	R64-A68 WeakPolarHBondContact O-CB 3.49Å; R64-A68 PolarHBondContact O-N 3.25Å; A65-A68 PolarHBondContact O-N 2.77Å; S66-A68 VanDerWaalsContact C-N 3.35Å; S66-A68 PolarHBondContact O-N 3.32Å; A68-N71 PolarHBondContact O-N 3.3Å; A68-E72 PolarHBondContact O-N 2.92Å
69	V	85.5	Confident	83.1	Confident	70 Å²	70	104.5 Å²	104.5	42%	0.424	52%	0.52	S	S	.	.	H	α-helix	trans	-65	-42.8	176.9	171	0	0	0	0	111	A65 S66 N71 E72 F73	A65-V69 WeakPolarHBondContact O-CG2 3.49Å; A65-V69 PolarHBondContact O-N 3.41Å; A65-V69 VanDerWaalsContact O-N 3.08Å; S66-V69 PolarHBondContact O-N 3.01Å; V69-N71 VanDerWaalsContact C-N 3.35Å; V69-N71 PolarHBondContact O-N 3.08Å; V69-E72 PolarHBondContact O-N 2.8Å; V69-F73 HydrophobicContact CG1-CD2 3.69Å; V69-F73 HydrophobicContact CG1-CE2 3.51Å; V69-F73 WeakPolarHBondContact O-CD2 3.45Å; V69-F73 PolarHBondContact O-N 2.95Å
70	L	85.5	Confident	84.4	Confident	103 Å²	103	99.1 Å²	99.1	54%	0.539	51%	0.512	S	S	.	.	H	α-helix	trans	-61.1	-43.3	176.4	-73.3	170.8	0	0	0	111.8	S66 D67 E72 F73 D74	S66-L70 WeakPolarHBondContact O-CG 3.48Å; S66-L70 PolarHBondContact O-N 3.36Å; D67-L70 PolarHBondContact O-N 3.07Å; L70-E72 PolarHBondContact O-N 3.04Å; L70-F73 PolarHBondContact O-N 3.28Å; L70-D74 PolarHBondContact O-N 3.06Å
71	N	88.7	Confident	85.4	Confident	99 Å²	99	103 Å²	103	53%	0.529	52%	0.523	S	S	.	.	H	α-helix	trans	-62	-42.2	175.8	-69.7	-20.3	0	0	0	111.9	D67 A68 V69 F73 D74 E75	D67-N71 WeakPolarHBondContact O-CB 3.3Å; D67-N71 PolarHBondContact O-N 2.96Å; D67-N71 PolarHBondContact O-ND2 3.43Å; A68-N71 PolarHBondContact O-N 3.3Å; V69-N71 VanDerWaalsContact C-N 3.35Å; V69-N71 PolarHBondContact O-N 3.08Å; N71-F73 VanDerWaalsContact C-N 3.35Å; N71-F73 PolarHBondContact O-N 3.49Å; N71-D74 PolarHBondContact O-N 2.91Å; N71-E75 WeakPolarHBondContact O-CG 3.19Å; N71-E75 PolarHBondContact O-N 3.32Å
72	E	87.4	Confident	86.5	Confident	132 Å²	132	102 Å²	102	62%	0.617	52%	0.515	S	S	*	.	H	α-helix	trans	-62.9	-40.6	177.4	-170.2	-179.8	179.4	0	0	112	A68 V69 L70 E75 A76	A68-E72 PolarHBondContact O-N 2.92Å; V69-E72 PolarHBondContact O-N 2.8Å; L70-E72 PolarHBondContact O-N 3.04Å; E72-E75 PolarHBondContact O-N 3.4Å; E72-A76 WeakPolarHBondContact O-CB 3.48Å; E72-A76 PolarHBondContact O-N 2.82Å
73	F	86.4	Confident	87.3	Confident	145 Å²	145	106.9 Å²	106.9	64%	0.636	52%	0.522	S	S	*	.	H	α-helix	trans	-64.4	-41.4	174.5	-84.5	-68.1	0	0	0	112.5	V69 L70 N71 A76 R77	V69-F73 HydrophobicContact CG1-CD2 3.69Å; V69-F73 HydrophobicContact CG1-CE2 3.51Å; V69-F73 WeakPolarHBondContact O-CD2 3.45Å; V69-F73 PolarHBondContact O-N 2.95Å; L70-F73 PolarHBondContact O-N 3.28Å; N71-F73 VanDerWaalsContact C-N 3.35Å; N71-F73 PolarHBondContact O-N 3.49Å; F73-A76 PolarHBondContact O-N 2.75Å; F73-R77 WeakPolarHBondContact O-CB 3.44Å; F73-R77 PolarHBondContact O-N 2.95Å
74	D	88.4	Confident	88.1	Confident	72 Å²	72	104.6 Å²	104.6	39%	0.385	52%	0.521	S	S	.	.	H	α-helix	trans	-67.1	-40.2	177.3	-81.9	-26.6	0	0	0	111.8	L70 N71 R77 Q78	L70-D74 PolarHBondContact O-N 3.06Å; N71-D74 PolarHBondContact O-N 2.91Å; D74-R77 WeakPolarHBondContact O-CB 3.4Å; D74-R77 PolarHBondContact O-N 3.33Å; D74-R77 IonicContact OD1-CZ 3.9Å; D74-R77 IonicContact OD1-NH1 3.32Å; D74-R77 PolarHBondContact OD1-NH1 3.11Å; D74-Q78 WeakPolarHBondContact O-CG 3.37Å; D74-Q78 PolarHBondContact O-N 3.08Å
75	E	90.9	Very high	88.7	Confident	91 Å²	91	99.3 Å²	99.3	43%	0.425	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-44.5	172.7	-73.6	-175	-166.2	0	0	112.2	N71 E72 R77 Q78 R79	N71-E75 WeakPolarHBondContact O-CG 3.19Å; N71-E75 PolarHBondContact O-N 3.32Å; E72-E75 PolarHBondContact O-N 3.4Å; E75-R77 VanDerWaalsContact C-N 3.28Å; E75-R77 PolarHBondContact O-N 3.28Å; E75-Q78 PolarHBondContact O-N 2.86Å; E75-R79 WeakPolarHBondContact O-CG 3.49Å; E75-R79 PolarHBondContact O-N 3.44Å; E75-R79 IonicContact OE2-CZ 2.76Å; E75-R79 IonicContact OE2-NH1 2.66Å; E75-R79 PolarHBondContact OE2-NH1 3.05Å; E75-R79 IonicContact OE2-NH2 2.79Å; E75-R79 PolarHBondContact OE2-NH2 2.94Å
76	A	89.4	Confident	89.3	Confident	51 Å²	51	102.6 Å²	102.6	42%	0.421	51%	0.509	S	S	.	.	H	α-helix	trans	-61.6	-38.9	176.3	0	0	0	0	0	111.5	E72 F73 R79 A80	E72-A76 WeakPolarHBondContact O-CB 3.48Å; E72-A76 PolarHBondContact O-N 2.82Å; F73-A76 PolarHBondContact O-N 2.75Å; A76-R79 PolarHBondContact O-N 2.84Å; A76-A80 WeakPolarHBondContact O-CB 3.35Å; A76-A80 PolarHBondContact O-N 3.4Å
77	R	89.8	Confident	89.7	Confident	180 Å²	180	102.9 Å²	102.9	68%	0.679	51%	0.508	S	S	*	.	H	α-helix	trans	-64.4	-44.4	175	-166	177.7	92.9	-156.9	7.8	111.8	F73 D74 E75 A80 W81	F73-R77 WeakPolarHBondContact O-CB 3.44Å; F73-R77 PolarHBondContact O-N 2.95Å; D74-R77 WeakPolarHBondContact O-CB 3.4Å; D74-R77 PolarHBondContact O-N 3.33Å; D74-R77 IonicContact OD1-CZ 3.9Å; D74-R77 IonicContact OD1-NH1 3.32Å; D74-R77 PolarHBondContact OD1-NH1 3.11Å; E75-R77 VanDerWaalsContact C-N 3.28Å; E75-R77 PolarHBondContact O-N 3.28Å; R77-A80 PolarHBondContact O-N 2.96Å; R77-W81 WeakPolarHBondContact O-CB 3.34Å; R77-W81 PolarHBondContact O-N 3.5Å
78	Q	92.6	Very high	90	Very high	133 Å²	133	102.6 Å²	102.6	62%	0.621	51%	0.506	S	S	*	.	H	α-helix	trans	-62.9	-45.3	176.1	-73.2	-179.4	5.4	0	0	111.5	D74 E75 A80 W81 T82	D74-Q78 WeakPolarHBondContact O-CG 3.37Å; D74-Q78 PolarHBondContact O-N 3.08Å; E75-Q78 PolarHBondContact O-N 2.86Å; Q78-A80 VanDerWaalsContact C-N 3.3Å; Q78-A80 PolarHBondContact O-N 2.87Å; Q78-W81 PolarHBondContact O-N 3.26Å; Q78-T82 WeakPolarHBondContact O-CG2 3.19Å; Q78-T82 PolarHBondContact O-N 2.77Å; Q78-T82 PolarHBondContact O-OG1 3.22Å
79	R	91.8	Very high	90.2	Very high	127 Å²	127	104.6 Å²	104.6	48%	0.479	51%	0.506	S	S	.	.	H	α-helix	trans	-61.5	-36.2	176.3	-70.2	179.5	-169.9	110.4	6.4	112.7	E75 A76 T82 R83	E75-R79 WeakPolarHBondContact O-CG 3.49Å; E75-R79 PolarHBondContact O-N 3.44Å; E75-R79 IonicContact OE2-CZ 2.76Å; E75-R79 IonicContact OE2-NH1 2.66Å; E75-R79 PolarHBondContact OE2-NH1 3.05Å; E75-R79 IonicContact OE2-NH2 2.79Å; E75-R79 PolarHBondContact OE2-NH2 2.94Å; A76-R79 PolarHBondContact O-N 2.84Å; R79-T82 WeakPolarHBondContact CA-OG1 3.36Å; R79-T82 PolarHBondContact O-OG1 2.78Å; R79-R83 WeakPolarHBondContact O-CG 3.33Å; R79-R83 PolarHBondContact O-N 3.4Å
80	A	90.3	Very high	90.4	Very high	57 Å²	57	108.6 Å²	108.6	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-68.2	-44.6	175	0	0	0	0	0	111.2	A76 R77 Q78 R83 D84	A76-A80 WeakPolarHBondContact O-CB 3.35Å; A76-A80 PolarHBondContact O-N 3.4Å; R77-A80 PolarHBondContact O-N 2.96Å; Q78-A80 VanDerWaalsContact C-N 3.3Å; Q78-A80 PolarHBondContact O-N 2.87Å; A80-R83 PolarHBondContact O-N 3.4Å; A80-D84 PolarHBondContact O-N 3.22Å
81	W	92.5	Very high	90.4	Very high	168 Å²	168	107.3 Å²	107.3	64%	0.636	51%	0.508	S	S	*	.	H	α-helix	trans	-61.9	-43.4	177.3	-175.9	77.5	0	0	0	112.4	R77 Q78 R83 D84 Q85	R77-W81 WeakPolarHBondContact O-CB 3.34Å; R77-W81 PolarHBondContact O-N 3.5Å; Q78-W81 PolarHBondContact O-N 3.26Å; W81-R83 VanDerWaalsContact C-N 3.33Å; W81-R83 PolarHBondContact O-N 3.2Å; W81-D84 PolarHBondContact O-N 2.94Å; W81-Q85 WeakPolarHBondContact O-CB 3.38Å; W81-Q85 PolarHBondContact O-N 3.27Å
82	T	93.3	Very high	90.3	Very high	63 Å²	63	106.5 Å²	106.5	39%	0.387	50%	0.503	S	S	.	.	H	α-helix	trans	-64	-36.6	176.6	52.3	0	0	0	0	112.7	Q78 R79 Q86	Q78-T82 WeakPolarHBondContact O-CG2 3.19Å; Q78-T82 PolarHBondContact O-N 2.77Å; Q78-T82 PolarHBondContact O-OG1 3.22Å; R79-T82 WeakPolarHBondContact CA-OG1 3.36Å; R79-T82 PolarHBondContact O-OG1 2.78Å; T82-Q86 WeakPolarHBondContact O-CB 3.45Å; T82-Q86 VanDerWaalsContact O-CG 3.26Å; T82-Q86 WeakPolarHBondContact O-CG 3.42Å; T82-Q86 PolarHBondContact O-N 2.85Å
83	R	91.5	Very high	90.3	Very high	157 Å²	157	105.7 Å²	105.7	59%	0.592	50%	0.499	S	S	*	.	H	α-helix	trans	-68.4	-40.8	175.6	-77.1	-171.1	-172	102.6	-4.7	112	R79 A80 W81 Q85 Q86 T87	R79-R83 WeakPolarHBondContact O-CG 3.33Å; R79-R83 PolarHBondContact O-N 3.4Å; A80-R83 PolarHBondContact O-N 3.4Å; W81-R83 VanDerWaalsContact C-N 3.33Å; W81-R83 PolarHBondContact O-N 3.2Å; R83-Q85 VanDerWaalsContact C-N 3.35Å; R83-Q86 PolarHBondContact O-N 2.83Å; R83-T87 WeakPolarHBondContact O-CB 3.4Å; R83-T87 PolarHBondContact O-N 2.93Å; R83-T87 PolarHBondContact O-OG1 2.94Å
84	D	91.9	Very high	90.2	Very high	98 Å²	98	102.7 Å²	102.7	52%	0.524	49%	0.489	S	S	.	.	H	α-helix	trans	-62.8	-45.5	176.7	-162.4	49.3	0	0	0	110.2	A80 W81 Q86 T87 L88	A80-D84 PolarHBondContact O-N 3.22Å; W81-D84 PolarHBondContact O-N 2.94Å; D84-Q86 PolarHBondContact O-N 3.07Å; D84-T87 WeakPolarHBondContact O-CB 3.3Å; D84-T87 PolarHBondContact O-N 3Å; D84-T87 VanDerWaalsContact O-N 3.1Å; D84-L88 WeakPolarHBondContact O-CG 3.5Å; D84-L88 PolarHBondContact O-N 2.98Å
85	Q	93.5	Very high	90	Very high	72 Å²	72	103.8 Å²	103.8	34%	0.336	49%	0.494	S	S	.	.	H	α-helix	trans	-58.7	-47.4	174.8	-174.8	62.3	22.4	0	0	112.5	W81 R83 T87 L88 E89	W81-Q85 WeakPolarHBondContact O-CB 3.38Å; W81-Q85 PolarHBondContact O-N 3.27Å; R83-Q85 VanDerWaalsContact C-N 3.35Å; Q85-T87 VanDerWaalsContact C-N 3.26Å; Q85-T87 PolarHBondContact O-N 2.84Å; Q85-L88 PolarHBondContact O-N 3.01Å; Q85-E89 PolarHBondContact NE2-OE1 3.35Å; Q85-E89 VanDerWaalsContact NE2-OE1 3.09Å; Q85-E89 WeakPolarHBondContact O-CG 3.42Å; Q85-E89 PolarHBondContact O-N 3.28Å
86	Q	93	Very high	89.5	Confident	126 Å²	126	106.9 Å²	106.9	59%	0.589	50%	0.502	S	S	*	.	H	α-helix	trans	-60.7	-36.1	174.8	-75.9	173.6	-13.2	0	0	112.6	T82 R83 D84 Y90	T82-Q86 WeakPolarHBondContact O-CB 3.45Å; T82-Q86 VanDerWaalsContact O-CG 3.26Å; T82-Q86 WeakPolarHBondContact O-CG 3.42Å; T82-Q86 PolarHBondContact O-N 2.85Å; R83-Q86 PolarHBondContact O-N 2.83Å; D84-Q86 PolarHBondContact O-N 3.07Å; Q86-Y90 WeakPolarHBondContact O-CB 3.42Å; Q86-Y90 PolarHBondContact O-N 3.45Å
87	T	90.2	Very high	89.1	Confident	73 Å²	73	108.8 Å²	108.8	45%	0.448	51%	0.505	S	S	.	.	H	α-helix	trans	-69	-41.2	178	-54.7	0	0	0	0	110.8	R83 D84 Q85 Y90 I91	R83-T87 WeakPolarHBondContact O-CB 3.4Å; R83-T87 PolarHBondContact O-N 2.93Å; R83-T87 PolarHBondContact O-OG1 2.94Å; D84-T87 WeakPolarHBondContact O-CB 3.3Å; D84-T87 PolarHBondContact O-N 3Å; D84-T87 VanDerWaalsContact O-N 3.1Å; Q85-T87 VanDerWaalsContact C-N 3.26Å; Q85-T87 PolarHBondContact O-N 2.84Å; T87-Y90 PolarHBondContact O-N 2.96Å; T87-I91 HydrophobicContact CG2-CD1 4.18Å; T87-I91 VanDerWaalsContact O-CG1 3.27Å; T87-I91 WeakPolarHBondContact O-CG1 3.36Å; T87-I91 PolarHBondContact O-N 2.95Å
88	L	90.6	Very high	88.3	Confident	81 Å²	81	103.5 Å²	103.5	42%	0.424	50%	0.5	S	S	.	.	H	α-helix	trans	-64.6	-43.9	174.9	-68.4	174.1	0	0	0	111.5	D84 Q85 Y90 I91 D92	D84-L88 WeakPolarHBondContact O-CG 3.5Å; D84-L88 PolarHBondContact O-N 2.98Å; Q85-L88 PolarHBondContact O-N 3.01Å; L88-Y90 VanDerWaalsContact C-N 3.31Å; L88-Y90 PolarHBondContact O-N 3.25Å; L88-I91 PolarHBondContact O-N 3.49Å; L88-I91 VanDerWaalsContact O-N 3.15Å; L88-D92 PolarHBondContact O-N 3.45Å
89	E	90.9	Very high	87.1	Confident	98 Å²	98	105.2 Å²	105.2	46%	0.458	51%	0.508	S	S	.	.	H	α-helix	trans	-60	-41.5	175.3	-74.3	170.2	-168.7	0	0	111.9	Q85 D92 E93	Q85-E89 PolarHBondContact NE2-OE1 3.35Å; Q85-E89 VanDerWaalsContact NE2-OE1 3.09Å; Q85-E89 WeakPolarHBondContact O-CG 3.42Å; Q85-E89 PolarHBondContact O-N 3.28Å; E89-D92 PolarHBondContact O-N 3.44Å; E89-E93 WeakPolarHBondContact O-CB 3.4Å; E89-E93 PolarHBondContact O-N 3.32Å
90	Y	89.4	Confident	85.7	Confident	154 Å²	154	108.6 Å²	108.6	60%	0.604	52%	0.521	S	S	*	.	H	α-helix	trans	-62.9	-41.9	174	177.5	-109.6	0	0	0	112.4	Q86 T87 L88 E93 I94	Q86-Y90 WeakPolarHBondContact O-CB 3.42Å; Q86-Y90 PolarHBondContact O-N 3.45Å; T87-Y90 PolarHBondContact O-N 2.96Å; L88-Y90 VanDerWaalsContact C-N 3.31Å; L88-Y90 PolarHBondContact O-N 3.25Å; Y90-E93 PolarHBondContact O-N 3.25Å; Y90-I94 HydrophobicContact CD1-CD1 3.76Å; Y90-I94 HydrophobicContact CE1-CD1 3.3Å; Y90-I94 HydrophobicContact CE1-CG1 4.39Å; Y90-I94 HydrophobicContact CE2-CD1 4.13Å; Y90-I94 HydrophobicContact CE2-CG1 4.43Å; Y90-I94 HydrophobicContact CG-CD1 4.35Å; Y90-I94 WeakPolarHBondContact O-CG1 3.48Å; Y90-I94 PolarHBondContact O-N 3.03Å
91	I	86.8	Confident	84	Confident	77 Å²	77	115.5 Å²	115.5	40%	0.395	53%	0.534	S	S	.	.	H	α-helix	trans	-63.9	-45.4	175.3	-68.8	165.2	0	0	0	110.5	T87 L88 E93 I94 L95	T87-I91 HydrophobicContact CG2-CD1 4.18Å; T87-I91 VanDerWaalsContact O-CG1 3.27Å; T87-I91 WeakPolarHBondContact O-CG1 3.36Å; T87-I91 PolarHBondContact O-N 2.95Å; L88-I91 PolarHBondContact O-N 3.49Å; L88-I91 VanDerWaalsContact O-N 3.15Å; I91-E93 VanDerWaalsContact C-N 3.29Å; I91-E93 PolarHBondContact O-N 3.01Å; I91-I94 WeakPolarHBondContact O-CB 3.32Å; I91-I94 PolarHBondContact O-N 3.27Å; I91-L95 HydrophobicContact CG2-CD1 4.01Å; I91-L95 HydrophobicContact CG2-CG 4.35Å; I91-L95 WeakPolarHBondContact O-CG 3.38Å; I91-L95 PolarHBondContact O-N 3.08Å
92	D	86.4	Confident	82	Confident	81 Å²	81	113.7 Å²	113.7	43%	0.433	54%	0.544	S	S	.	.	H	α-helix	trans	-63.7	-33.7	178.2	-76.7	-13.4	0	0	0	112.4	L88 E89 R96	L88-D92 PolarHBondContact O-N 3.45Å; E89-D92 PolarHBondContact O-N 3.44Å; D92-R96 WeakPolarHBondContact O-CB 3.5Å; D92-R96 VanDerWaalsContact O-CG 3.32Å; D92-R96 WeakPolarHBondContact O-CG 3.48Å; D92-R96 PolarHBondContact O-N 2.68Å; D92-R96 PolarHBondContact O-NE 2.91Å
93	E	87.9	Confident	80.1	Confident	115 Å²	115	119.2 Å²	119.2	54%	0.537	56%	0.564	S	S	.	*	H	α-helix	trans	-69.2	-42.3	173.1	-176.8	157.7	-157.5	0	0	111.8	E89 Y90 I91 L95 R96 N97	E89-E93 WeakPolarHBondContact O-CB 3.4Å; E89-E93 PolarHBondContact O-N 3.32Å; Y90-E93 PolarHBondContact O-N 3.25Å; I91-E93 VanDerWaalsContact C-N 3.29Å; I91-E93 PolarHBondContact O-N 3.01Å; E93-L95 VanDerWaalsContact C-N 3.33Å; E93-L95 PolarHBondContact O-N 2.99Å; E93-R96 PolarHBondContact O-N 3.36Å; E93-N97 WeakPolarHBondContact O-CB 3.19Å; E93-N97 VanDerWaalsContact O-CG 3.24Å; E93-N97 PolarHBondContact O-N 3.39Å; E93-N97 PolarHBondContact O-ND2 3.41Å; E93-N97 VanDerWaalsContact O-ND2 3.14Å
94	I	84.1	Confident	78	Confident	82 Å²	82	121.5 Å²	121.5	42%	0.421	57%	0.573	S	S	.	*	H	α-helix	trans	-59	-45.8	172.3	-69.3	164.7	0	0	0	110.7	Y90 I91 N97 A98	Y90-I94 HydrophobicContact CD1-CD1 3.76Å; Y90-I94 HydrophobicContact CE1-CD1 3.3Å; Y90-I94 HydrophobicContact CE1-CG1 4.39Å; Y90-I94 HydrophobicContact CE2-CD1 4.13Å; Y90-I94 HydrophobicContact CE2-CG1 4.43Å; Y90-I94 HydrophobicContact CG-CD1 4.35Å; Y90-I94 WeakPolarHBondContact O-CG1 3.48Å; Y90-I94 PolarHBondContact O-N 3.03Å; I91-I94 WeakPolarHBondContact O-CB 3.32Å; I91-I94 PolarHBondContact O-N 3.27Å; I94-N97 PolarHBondContact O-N 2.88Å; I94-A98 WeakPolarHBondContact O-CB 3.48Å; I94-A98 PolarHBondContact O-N 3.03Å
95	L	82.5	Confident	76.1	Confident	95 Å²	95	122.7 Å²	122.7	50%	0.497	58%	0.584	S	S	.	*	H	α-helix	trans	-64.6	-44.8	-179.9	-69.7	175	0	0	0	111.6	I91 E93 N97 A98 E99	I91-L95 HydrophobicContact CG2-CD1 4.01Å; I91-L95 HydrophobicContact CG2-CG 4.35Å; I91-L95 WeakPolarHBondContact O-CG 3.38Å; I91-L95 PolarHBondContact O-N 3.08Å; E93-L95 VanDerWaalsContact C-N 3.33Å; E93-L95 PolarHBondContact O-N 2.99Å; L95-N97 VanDerWaalsContact C-N 3.28Å; L95-N97 PolarHBondContact O-N 2.72Å; L95-A98 PolarHBondContact O-N 3.38Å; L95-A98 VanDerWaalsContact O-N 3.15Å; L95-E99 PolarHBondContact O-N 2.94Å; L95-E99 VanDerWaalsContact O-N 3.1Å
96	R	82.2	Confident	74	Confident	156 Å²	156	123.3 Å²	123.3	59%	0.589	60%	0.595	S	S	*	*	H	α-helix	trans	-60.6	-36.1	174.4	-80.5	-177.5	-91.1	-168.9	-7.4	112.8	D92 E93	D92-R96 WeakPolarHBondContact O-CB 3.5Å; D92-R96 VanDerWaalsContact O-CG 3.32Å; D92-R96 WeakPolarHBondContact O-CG 3.48Å; D92-R96 PolarHBondContact O-N 2.68Å; D92-R96 PolarHBondContact O-NE 2.91Å; E93-R96 PolarHBondContact O-N 3.36Å
97	N	80.3	Confident	71.5	Confident	92 Å²	92	122.4 Å²	122.4	49%	0.492	60%	0.602	S	S	.	*	H	α-helix	trans	-74.1	-33.1	176	-72	-30.3	0	0	0	112.3	E93 I94 L95 R100	E93-N97 WeakPolarHBondContact O-CB 3.19Å; E93-N97 VanDerWaalsContact O-CG 3.24Å; E93-N97 PolarHBondContact O-N 3.39Å; E93-N97 PolarHBondContact O-ND2 3.41Å; E93-N97 VanDerWaalsContact O-ND2 3.14Å; I94-N97 PolarHBondContact O-N 2.88Å; L95-N97 VanDerWaalsContact C-N 3.28Å; L95-N97 PolarHBondContact O-N 2.72Å; N97-R100 PolarHBondContact O-N 2.99Å
98	A	72.7	Confident	69.3	Low	68 Å²	68	124.3 Å²	124.3	56%	0.562	61%	0.614	S	S	*	*	H	α-helix	trans	-68.8	-32.3	176.2	0	0	0	0	0	113	I94 L95 R100	I94-A98 WeakPolarHBondContact O-CB 3.48Å; I94-A98 PolarHBondContact O-N 3.03Å; L95-A98 PolarHBondContact O-N 3.38Å; L95-A98 VanDerWaalsContact O-N 3.15Å; A98-R100 PolarHBondContact O-N 3.42Å
99	E	67.1	Low	67.1	Low	170 Å²	170	129.2 Å²	129.2	79%	0.794	64%	0.635	S	S	*	*	H	α-helix	trans	-68.9	-21.8	172.9	-70.1	178.8	178.2	0	0	112.4	L95 R101	L95-E99 PolarHBondContact O-N 2.94Å; L95-E99 VanDerWaalsContact O-N 3.1Å; E99-R101 VanDerWaalsContact C-N 3.33Å; E99-R101 PolarHBondContact O-N 3.45Å; E99-R101 VanDerWaalsContact O-N 3.1Å
100	R	62	Low	64.8	Low	198 Å²	198	133 Å²	133	75%	0.747	66%	0.657	S	S	*	*	S	Bend	trans	-87.2	73	174.6	-69.9	-175.9	174.6	-170.3	0.1	111	N97 A98	N97-R100 PolarHBondContact O-N 2.99Å; A98-R100 PolarHBondContact O-N 3.42Å
101	R	55.5	Low	62.7	Low	201 Å²	201	130.1 Å²	130.1	76%	0.758	66%	0.66	S	S	*	*			trans	74.5	135.8	174.8	-53.4	-177.7	172.9	-156.3	-2.7	114.2	E99 F103	E99-R101 VanDerWaalsContact C-N 3.33Å; E99-R101 PolarHBondContact O-N 3.45Å; E99-R101 VanDerWaalsContact O-N 3.1Å; R101-F103 PolarHBondContact O-N 3.02Å
102	P	50.8	Low	60.6	Low	130 Å²	130	132.7 Å²	132.7	84%	0.844	68%	0.679	S	S	*	*			trans	-70.3	97.1	174.4	29.4	-31.3	0	0	0	108.9	Y104	P102-Y104 PolarHBondContact O-N 3.02Å
103	F	51.7	Low	58.3	Low	180 Å²	180	141 Å²	141	79%	0.789	70%	0.704	S	S	*	*			trans	-74.5	108	159.9	-97.4	-85.6	0	0	0	107.8	R101 V105	R101-F103 PolarHBondContact O-N 3.02Å; F103-V105 PolarHBondContact O-N 3.29Å
104	Y	47.7	Very low	56.1	Low	204 Å²	204	147.5 Å²	147.5	80%	0.8	72%	0.723	S	S	*	*			trans	-54.1	105.2	166.6	-174.8	-93.7	0	0	0	108.9	P102 P106	P102-Y104 PolarHBondContact O-N 3.02Å; Y104-P106 HydrophobicContact CD1-CG 4.34Å; Y104-P106 HydrophobicContact CE1-CG 4.33Å; Y104-P106 WeakPolarHBondContact O-CD 3.41Å
105	V	53.4	Low	54	Low	124 Å²	124	146.3 Å²	146.3	75%	0.752	73%	0.731	S	S	*	*			trans	-87.9	117.7	166.6	-176.5	0	0	0	0	106.8	F103 S107	F103-V105 PolarHBondContact O-N 3.29Å; V105-S107 PolarHBondContact O-N 3.47Å; V105-S107 VanDerWaalsContact O-N 3.07Å
106	P	47.7	Very low	52	Low	85 Å²	85	146.9 Å²	146.9	55%	0.552	74%	0.743	S	S	*	*			trans	-57.9	116.4	177.4	-23.9	34	0	0	0	110.6	Y104 T108	Y104-P106 HydrophobicContact CD1-CG 4.34Å; Y104-P106 HydrophobicContact CE1-CG 4.33Å; Y104-P106 WeakPolarHBondContact O-CD 3.41Å; P106-T108 PolarHBondContact O-N 3.4Å
107	S	42.2	Very low	50	Low	107 Å²	107	150.2 Å²	150.2	75%	0.748	76%	0.757	S	S	*	*			trans	-72	71.6	174.3	178.9	0	0	0	0	110.1	V105	V105-S107 PolarHBondContact O-N 3.47Å; V105-S107 VanDerWaalsContact O-N 3.07Å
108	T	42.5	Very low	48.1	Very low	113 Å²	113	153.2 Å²	153.2	69%	0.693	77%	0.773	S	S	*	*			trans	-134.7	94.4	168.8	52.2	0	0	0	0	107.8	P106	P106-T108 PolarHBondContact O-N 3.4Å
109	Q	44.7	Very low	46.5	Very low	184 Å²	184	161.3 Å²	161.3	86%	0.86	79%	0.789	S	S	*	*			trans	171	-0.7	153	-76.5	-121.8	1	0	0	112.6	S111	Q109-S111 PolarHBondContact O-N 2.93Å
110	L	42.3	Very low	45.1	Very low	176 Å²	176	164 Å²	164	92%	0.921	79%	0.794	S	S	*	*			trans	-78.3	60.1	170.5	-71.8	169.6	0	0	0	111.9
111	S	46.2	Very low	44	Very low	95 Å²	95	159.6 Å²	159.6	66%	0.664	79%	0.793	S	S	*	*			trans	-104.7	103.9	164.4	59.1	0	0	0	0	109.9	Q109	Q109-S111 PolarHBondContact O-N 2.93Å
112	V	42.2	Very low	43.5	Very low	131 Å²	131	158 Å²	158	79%	0.794	80%	0.8	S	S	*	*			trans	59.5	88.5	139.7	-163.7	0	0	0	0	116.9
113	R	39.3	Very low	43	Very low	255 Å²	255	159.5 Å²	159.5	96%	0.962	80%	0.799	S	S	*	*			trans	-131.7	67.3	138.2	-135.3	-179.4	-169.1	-137.5	3.9	109.5	G115	R113-G115 PolarHBondContact O-N 3Å
114	R	41	Very low	42.4	Very low	252 Å²	252	162 Å²	162	95%	0.951	80%	0.803	S	S	*	*			trans	-74.5	77	172.5	-133.3	-178.3	-165.7	-138.5	4.2	108.2
115	G	40.5	Very low	42	Very low	57 Å²	57	159.9 Å²	159.9	59%	0.588	81%	0.805	S	S	*	*			trans	-89.3	108.4	171.6	0	0	0	0	0	110	R113 Y117	R113-G115 PolarHBondContact O-N 3Å; G115-Y117 PolarHBondContact O-N 3.1Å
116	S	40	Very low	41.3	Very low	106 Å²	106	157.6 Å²	157.6	74%	0.741	81%	0.807	S	S	*	*			trans	-40.3	114.4	-179.7	-178.7	0	0	0	0	115.9
117	Y	41.1	Very low	40.9	Very low	227 Å²	227	160 Å²	160	89%	0.89	82%	0.816	S	S	*	*			trans	-124.7	79.6	151.5	-73.6	-82	0	0	0	108.1	G115	G115-Y117 PolarHBondContact O-N 3.1Å
118	N	39.7	Very low	41	Very low	154 Å²	154	162.8 Å²	162.8	82%	0.824	82%	0.816	S	S	*	*			trans	-131.8	96.8	162.5	-94.2	-7.4	0	0	0	107.7
119	R	39.6	Very low	41	Very low	238 Å²	238	162.5 Å²	162.5	90%	0.898	82%	0.819	S	S	*	*			trans	-155.4	81.3	162.3	-122.3	-163	-74.6	-165.5	-2.4	108.2
120	Y	37.3	Very low	40.8	Very low	228 Å²	228	161 Å²	161	89%	0.894	82%	0.817	S	S	*	*			trans	-175.1	79.6	150.2	-90.8	-64.8	0	0	0	108.7
121	S	38.5	Very low	40.8	Very low	105 Å²	105	162.4 Å²	162.4	73%	0.734	82%	0.816	S	S	*	*			trans	-170.3	103.6	155.9	53.5	0	0	0	0	106
122	D	46	Very low	40.4	Very low	168 Å²	168	162.9 Å²	162.9	90%	0.898	82%	0.819	S	S	*	*			trans	-171.9	94.5	142.4	-86.5	-23.3	0	0	0	108.6
123	I	38.9	Very low	40.4	Very low	160 Å²	160	163.5 Å²	163.5	82%	0.821	82%	0.824	S	S	*	*			trans	-83.5	116.1	158.8	-64.6	165.5	0	0	0	105
124	R	40.7	Very low	40.4	Very low	233 Å²	233	159.1 Å²	159.1	88%	0.879	82%	0.816	S	S	*	*			trans	-170.2	105.5	152.6	-109.8	166.6	-169.5	-166.6	2.8	112.4
125	N	38.9	Very low	40.2	Very low	159 Å²	159	152.8 Å²	152.8	85%	0.85	80%	0.801	S	S	*	*			trans	11.5	128.2	138.7	-51.7	-23.4	0	0	0	118.2
126	G	38.1	Very low	40.3	Very low	76 Å²	76	157.2 Å²	157.2	78%	0.784	81%	0.811	S	S	*	*			trans	158.7	84.8	165.6	0	0	0	0	0	109.7
127	D	40.2	Very low	40.2	Very low	137 Å²	137	158.3 Å²	158.3	73%	0.733	80%	0.804	S	S	*	*				87.7	107.8	90.1	-157	26.8	0	0	0	112.9
128	Q	42.5	Very low	40.2	Very low	164 Å²	164	155.1 Å²	155.1	77%	0.766	80%	0.802	S	S	*	*			trans	48.7	118.2	147.2	-70.9	178.5	60.6	0	0	122
129	S	42.3	Very low	40.4	Very low	107 Å²	107	153 Å²	153	75%	0.748	80%	0.799	S	S	*	*				152.2	124.4	98.5	53.8	0	0	0	0	112.7
130	D	41.8	Very low	40.3	Very low	154 Å²	154	152.1 Å²	152.1	82%	0.824	80%	0.802	S	S	*	*			trans	22.3	118.8	145.7	-55.6	-25.1	0	0	0	120.4
131	K	42.5	Very low	40.3	Very low	205 Å²	205	146.1 Å²	146.1	89%	0.891	79%	0.793	S	S	*	*				-169.6	126.3	114	-104.8	164	-176.1	171.6	0	113.3
132	S	37.9	Very low	40.4	Very low	105 Å²	105	150 Å²	150	73%	0.734	80%	0.8	S	S	*	*			trans	-45.3	144.7	164.4	53.6	0	0	0	0	114.7
133	T	41.1	Very low	39.9	Very low	144 Å²	144	150.4 Å²	150.4	88%	0.883	80%	0.798	S	S	*	*				-161.9	132.9	125.7	-61.8	0	0	0	0	108.6
134	M	39.2	Very low	39.8	Very low	162 Å²	162	151.6 Å²	151.6	80%	0.798	80%	0.8	S	S	*	*			trans	-68.6	165.2	-179.4	-71	-75.7	-149.3	0	0	113
135	D	37.4	Very low	39.8	Very low	120 Å²	120	144.6 Å²	144.6	64%	0.642	78%	0.783	S	S	*	*			trans	70.9	97.4	161.6	-57.6	-29.6	0	0	0	116.5	H137	D135-H137 IonicContact OD1-CE1 3.31Å; D135-H137 PolarHBondContact OD1-CE1 3.24Å
136	D	42	Very low	39.8	Very low	149 Å²	149	145.3 Å²	145.3	80%	0.797	79%	0.785	S	S	*	*				-166.9	138.8	99.4	-113.3	-31.3	0	0	0	112.4
137	H	39.1	Very low	39.9	Very low	129 Å²	129	150.9 Å²	150.9	60%	0.597	78%	0.782	S	S	*	*			trans	-84.1	133.8	-169	-23.2	-76.1	0	0	0	107.7	D135	D135-H137 IonicContact OD1-CE1 3.31Å; D135-H137 PolarHBondContact OD1-CE1 3.24Å
138	L	41.4	Very low	39.9	Very low	160 Å²	160	149.2 Å²	149.2	84%	0.838	78%	0.781	S	S	*	*			trans	149	98.1	149.6	-78	157.3	0	0	0	111	K140	L138-K140 PolarHBondContact O-N 3.32Å; L138-K140 VanDerWaalsContact O-N 3.14Å
139	S	43.6	Very low	39.9	Very low	109 Å²	109	148 Å²	148	76%	0.762	79%	0.785	S	S	*	*			trans	43.8	59.1	134.4	-57	0	0	0	0	118	S141	S139-S141 PolarHBondContact O-N 2.91Å; S139-S141 VanDerWaalsContact O-N 3.1Å
140	K	37.9	Very low	39.8	Very low	221 Å²	221	149.9 Å²	149.9	96%	0.961	79%	0.787	S	S	*	*			trans	-77.9	68.1	148.6	-82.8	171.9	177.2	167.1	0	109.2	L138	L138-K140 PolarHBondContact O-N 3.32Å; L138-K140 VanDerWaalsContact O-N 3.14Å
141	S	36.8	Very low	39.7	Very low	101 Å²	101	153 Å²	153	71%	0.706	79%	0.787	S	S	*	*			trans	-138.3	56.2	174.2	172.4	0	0	0	0	108.3	S139	S139-S141 PolarHBondContact O-N 2.91Å; S139-S141 VanDerWaalsContact O-N 3.1Å
142	Q	39.9	Very low	39.8	Very low	188 Å²	188	152.8 Å²	152.8	88%	0.879	79%	0.786	S	S	*	*	S	Bend	trans	-162.4	44.5	175.2	-115	178.9	36.5	0	0	111.5
143	M	36.3	Very low	40.2	Very low	176 Å²	176	154.9 Å²	154.9	87%	0.867	79%	0.788	S	S	*	*			trans	-151.9	51.5	165.5	-81.7	-141.7	77.6	0	0	111
144	E	37	Very low	40.5	Very low	184 Å²	184	157.1 Å²	157.1	86%	0.86	79%	0.785	S	S	*	*			trans	-104.3	92.7	149	-92.1	-176.2	144.2	0	0	105.6
145	V	39.4	Very low	41	Very low	87 Å²	87	155.2 Å²	155.2	53%	0.527	78%	0.778	S	S	.	*				51.4	81.5	98.3	-177	0	0	0	0	108.7	R147	V145-R147 HydrophobicContact CG1-CB 3.88Å; V145-R147 HydrophobicContact CG1-CG 3.4Å; V145-R147 PolarHBondContact O-N 3.02Å
146	I	38.9	Very low	41.7	Very low	174 Å²	174	152.9 Å²	152.9	89%	0.892	77%	0.769	S	S	*	*			trans	-62.1	75.4	155.7	-57.6	171.7	0	0	0	105.9
147	R	40.6	Very low	42.1	Very low	192 Å²	192	150 Å²	150	73%	0.725	76%	0.761	S	S	*	*			trans	-81	116	162.3	-99.6	170.5	-157.4	-167.2	9.7	105	V145 V149	V145-R147 HydrophobicContact CG1-CB 3.88Å; V145-R147 HydrophobicContact CG1-CG 3.4Å; V145-R147 PolarHBondContact O-N 3.02Å; R147-V149 PolarHBondContact O-N 2.86Å; R147-V149 VanDerWaalsContact O-N 3.07Å
148	S	40.3	Very low	43	Very low	102 Å²	102	149.4 Å²	149.4	71%	0.713	77%	0.771	S	S	*	*			trans	-37.6	115.1	171.7	-47.4	0	0	0	0	110.6	N150	S148-N150 PolarHBondContact O-N 2.9Å
149	V	42.8	Very low	43.9	Very low	138 Å²	138	147.9 Å²	147.9	84%	0.836	77%	0.769	S	S	*	*			trans	-75.9	59.6	167.2	-166.9	0	0	0	0	107.7	R147 R151	R147-V149 PolarHBondContact O-N 2.86Å; R147-V149 VanDerWaalsContact O-N 3.07Å; V149-R151 VanDerWaalsContact C-N 3.33Å
150	N	39.2	Very low	44.9	Very low	148 Å²	148	144.2 Å²	144.2	79%	0.791	74%	0.739	S	S	*	*			trans	-104.8	54.8	158.4	-96.6	-30.3	0	0	0	106.9	S148 K152	S148-N150 PolarHBondContact O-N 2.9Å; N150-K152 VanDerWaalsContact C-N 3.28Å; N150-K152 PolarHBondContact O-N 3.25Å
151	R	41.5	Very low	46.9	Very low	220 Å²	220	137.9 Å²	137.9	83%	0.83	72%	0.719	S	S	*	*			trans	-71.6	99	157.2	-72.3	-173.2	-167.9	176.9	5.7	104.9	V149 I153	V149-R151 VanDerWaalsContact C-N 3.33Å; R151-I153 VanDerWaalsContact C-N 3.32Å; R151-I153 PolarHBondContact O-N 2.95Å
152	K	42.9	Very low	48.9	Very low	200 Å²	200	136.8 Å²	136.8	87%	0.87	72%	0.717	S	S	*	*			trans	-44.7	109.8	152	-70.9	-170.2	176	-174.7	0	105.3	N150 K154	N150-K152 VanDerWaalsContact C-N 3.28Å; N150-K152 PolarHBondContact O-N 3.25Å; K152-K154 PolarHBondContact O-N 3.37Å
153	I	48.2	Very low	50.9	Low	149 Å²	149	137.9 Å²	137.9	76%	0.764	71%	0.713	S	S	*	*			trans	-61.5	95.3	170.2	-64.4	170.2	0	0	0	103.5	R151 D155	R151-I153 VanDerWaalsContact C-N 3.32Å; R151-I153 PolarHBondContact O-N 2.95Å; I153-D155 PolarHBondContact O-N 2.82Å; I153-D155 VanDerWaalsContact O-N 3.08Å
154	K	46.6	Very low	53	Low	191 Å²	191	134.9 Å²	134.9	83%	0.83	70%	0.697	S	S	*	*			trans	-69.6	102.9	171.4	-177.7	172.6	-179.4	177.7	0	104.4	K152 P156	K152-K154 PolarHBondContact O-N 3.37Å; K154-P156 WeakPolarHBondContact O-CD 3.38Å; K154-P156 VanDerWaalsContact O-N 3.09Å
155	D	50.3	Low	55.2	Low	122 Å²	122	131.3 Å²	131.3	65%	0.652	68%	0.678	S	S	*	*			trans	-48.1	114.4	175	-71.6	-43.9	0	0	0	109.7	I153 S157	I153-D155 PolarHBondContact O-N 2.82Å; I153-D155 VanDerWaalsContact O-N 3.08Å; D155-S157 PolarHBondContact O-N 2.76Å
156	P	50.8	Low	57.2	Low	70 Å²	70	132.6 Å²	132.6	46%	0.455	68%	0.68	S	S	.	*			trans	-83.8	62.4	169.7	33.6	-28	0	0	0	107.6	K154	K154-P156 WeakPolarHBondContact O-CD 3.38Å; K154-P156 VanDerWaalsContact O-N 3.09Å
157	S	50.5	Low	59.4	Low	90 Å²	90	130.2 Å²	130.2	63%	0.629	66%	0.663	S	S	*	*			trans	-114.3	17.9	-163.5	80.3	0	0	0	0	116.8	D155	D155-S157 PolarHBondContact O-N 2.76Å
158	S	57.6	Low	61.4	Low	116 Å²	116	125.8 Å²	125.8	81%	0.811	65%	0.646	S	S	*	*	S	Bend	trans	-117.5	-12.3	179	56.6	0	0	0	0	117.1
159	T	62.1	Low	63.4	Low	127 Å²	127	124.8 Å²	124.8	78%	0.779	64%	0.636	S	S	*	*	S	Bend	trans	-142	8.9	-179.4	52.2	0	0	0	0	115.3	T161	T159-T161 PolarHBondContact O-N 3.39Å; T159-T161 VanDerWaalsContact O-N 3.17Å
160	E	64.5	Low	65.2	Low	32 Å²	32	123.1 Å²	123.1	15%	0.15	62%	0.619	C	S	.	*			trans	-75.3	110.4	-178.3	-169.1	178.6	-161.3	0	0	111.8	Q164 K165 R168	E160-Q164 HydrophobicContact CG-CB 3.51Å; E160-K165 HydrophobicContact CB-CG 4.32Å; E160-K165 HydrophobicContact CG-CG 3.7Å; E160-K165 WeakPolarHBondContact OE1-CA 3.46Å; E160-K165 PolarHBondContact OE1-N 2.63Å; E160-K165 VanDerWaalsContact OE1-N 3.17Å; E160-K165 WeakPolarHBondContact OE2-CG 3.22Å; E160-R168 VanDerWaalsContact CD-CZ 3.43Å; E160-R168 IonicContact OE1-CZ 3.76Å; E160-R168 IonicContact OE1-NE 3.89Å; E160-R168 PolarHBondContact OE1-NE 2.78Å; E160-R168 IonicContact OE1-NH2 3.82Å; E160-R168 PolarHBondContact OE1-NH2 3.38Å; E160-R168 IonicContact OE2-CZ 3.1Å; E160-R168 VanDerWaalsContact OE2-CZ 3.3Å; E160-R168 IonicContact OE2-NE 2.8Å; E160-R168 IonicContact OE2-NH1 2.98Å; E160-R168 IonicContact OE2-NH2 3.3Å; E160-R168 PolarHBondContact OE2-NH2 2.89Å
161	T	77.9	Confident	67.2	Low	88 Å²	88	121.1 Å²	121.1	54%	0.54	61%	0.605	S	S	.	*			trans	-57.2	142.4	173.1	-47.6	0	0	0	0	110.1	T159 R163 Q164 K165	T159-T161 PolarHBondContact O-N 3.39Å; T159-T161 VanDerWaalsContact O-N 3.17Å; T161-R163 PolarHBondContact O-N 3.09Å; T161-Q164 WeakPolarHBondContact O-CB 3.5Å; T161-Q164 PolarHBondContact O-N 3.41Å; T161-K165 PolarHBondContact O-N 2.83Å
162	A	79.3	Confident	68.8	Low	79 Å²	79	119.9 Å²	119.9	65%	0.653	60%	0.6	S	S	*	*	H	α-helix	trans	-48.9	-34.1	179	0	0	0	0	0	113.6	K165 M166	A162-K165 PolarHBondContact O-N 3.44Å; A162-M166 WeakPolarHBondContact O-CB 3.26Å; A162-M166 PolarHBondContact O-N 3.43Å
163	R	81.5	Confident	70.4	Confident	210 Å²	210	114.5 Å²	114.5	79%	0.792	58%	0.581	S	S	*	*	H	α-helix	trans	-63.1	-37.5	174.4	-69.1	-176.3	178.7	-125.1	1.4	114	T161 K167	T161-R163 PolarHBondContact O-N 3.09Å; R163-K167 WeakPolarHBondContact O-CB 3.22Å; R163-K167 PolarHBondContact O-N 3.26Å
164	Q	81.9	Confident	71.6	Confident	113 Å²	113	114.3 Å²	114.3	53%	0.528	58%	0.576	S	S	.	*	H	α-helix	trans	-71.9	-38.1	175.8	-88.4	176.6	-26.4	0	0	111.7	E160 T161 M166 K167 R168	E160-Q164 HydrophobicContact CG-CB 3.51Å; T161-Q164 WeakPolarHBondContact O-CB 3.5Å; T161-Q164 PolarHBondContact O-N 3.41Å; Q164-M166 VanDerWaalsContact C-N 3.33Å; Q164-K167 PolarHBondContact O-N 2.98Å; Q164-R168 PolarHBondContact O-N 3.39Å
165	K	81.6	Confident	72.5	Confident	110 Å²	110	107.6 Å²	107.6	48%	0.478	56%	0.561	S	S	.	*	H	α-helix	trans	-60.3	-45.9	171.9	-69.9	-175.2	-178.8	-178.2	0	110.8	E160 T161 A162 R168 V169	E160-K165 HydrophobicContact CB-CG 4.32Å; E160-K165 HydrophobicContact CG-CG 3.7Å; E160-K165 WeakPolarHBondContact OE1-CA 3.46Å; E160-K165 PolarHBondContact OE1-N 2.63Å; E160-K165 VanDerWaalsContact OE1-N 3.17Å; E160-K165 WeakPolarHBondContact OE2-CG 3.22Å; T161-K165 PolarHBondContact O-N 2.83Å; A162-K165 PolarHBondContact O-N 3.44Å; K165-R168 PolarHBondContact O-N 2.82Å; K165-V169 WeakPolarHBondContact O-CG2 3.38Å; K165-V169 PolarHBondContact O-N 3.46Å
166	M	82.3	Confident	73.5	Confident	114 Å²	114	106.8 Å²	106.8	56%	0.562	56%	0.556	S	S	*	*	H	α-helix	trans	-62.6	-46.4	178.9	-159.3	170.4	93.7	0	0	111.3	A162 Q164 R168 V169 E170	A162-M166 WeakPolarHBondContact O-CB 3.26Å; A162-M166 PolarHBondContact O-N 3.43Å; Q164-M166 VanDerWaalsContact C-N 3.33Å; M166-R168 VanDerWaalsContact C-N 3.35Å; M166-R168 PolarHBondContact O-N 3.1Å; M166-V169 PolarHBondContact O-N 3.24Å; M166-V169 VanDerWaalsContact O-N 3.12Å; M166-E170 WeakPolarHBondContact O-CG 3.41Å; M166-E170 PolarHBondContact O-N 2.9Å
167	K	85.6	Confident	74.2	Confident	124 Å²	124	111 Å²	111	54%	0.539	57%	0.573	S	S	.	*	H	α-helix	trans	-59	-42.2	175.4	-171.1	178.3	179.9	-172.5	0	112.7	R163 Q164 V169 E170 E171	R163-K167 WeakPolarHBondContact O-CB 3.22Å; R163-K167 PolarHBondContact O-N 3.26Å; Q164-K167 PolarHBondContact O-N 2.98Å; K167-V169 VanDerWaalsContact C-N 3.33Å; K167-V169 PolarHBondContact O-N 3.5Å; K167-E170 PolarHBondContact O-N 3.27Å; K167-E171 WeakPolarHBondContact CE-OE1 3.49Å; K167-E171 IonicContact NZ-OE1 2.68Å; K167-E171 WeakPolarHBondContact O-CB 3.38Å; K167-E171 VanDerWaalsContact O-CG 3.3Å; K167-E171 WeakPolarHBondContact O-CG 3.42Å; K167-E171 PolarHBondContact O-N 3.46Å
168	R	81.9	Confident	75	Confident	98 Å²	98	113 Å²	113	37%	0.37	58%	0.577	S	S	.	*	H	α-helix	trans	-65.5	-35.2	175.4	-95	-163.8	-92	-176.3	-17.9	113.4	E160 Q164 K165 M166 R172	E160-R168 VanDerWaalsContact CD-CZ 3.43Å; E160-R168 IonicContact OE1-CZ 3.76Å; E160-R168 IonicContact OE1-NE 3.89Å; E160-R168 PolarHBondContact OE1-NE 2.78Å; E160-R168 IonicContact OE1-NH2 3.82Å; E160-R168 PolarHBondContact OE1-NH2 3.38Å; E160-R168 IonicContact OE2-CZ 3.1Å; E160-R168 VanDerWaalsContact OE2-CZ 3.3Å; E160-R168 IonicContact OE2-NE 2.8Å; E160-R168 IonicContact OE2-NH1 2.98Å; E160-R168 IonicContact OE2-NH2 3.3Å; E160-R168 PolarHBondContact OE2-NH2 2.89Å; Q164-R168 PolarHBondContact O-N 3.39Å; K165-R168 PolarHBondContact O-N 2.82Å; M166-R168 VanDerWaalsContact C-N 3.35Å; M166-R168 PolarHBondContact O-N 3.1Å; R168-R172 WeakPolarHBondContact O-CB 3.31Å; R168-R172 VanDerWaalsContact O-CG 3.31Å; R168-R172 WeakPolarHBondContact O-CG 3.37Å; R168-R172 PolarHBondContact O-N 3.21Å
169	V	82.1	Confident	75.5	Confident	81 Å²	81	115 Å²	115	49%	0.491	57%	0.568	S	S	.	*	H	α-helix	trans	-69.2	-46.8	174.6	170.8	0	0	0	0	109.5	K165 M166 K167 E171 R172 L173	K165-V169 WeakPolarHBondContact O-CG2 3.38Å; K165-V169 PolarHBondContact O-N 3.46Å; M166-V169 PolarHBondContact O-N 3.24Å; M166-V169 VanDerWaalsContact O-N 3.12Å; K167-V169 VanDerWaalsContact C-N 3.33Å; K167-V169 PolarHBondContact O-N 3.5Å; V169-E171 PolarHBondContact O-N 2.92Å; V169-R172 CarbonylContact O-C 3.6Å; V169-R172 WeakPolarHBondContact O-CB 3.39Å; V169-R172 PolarHBondContact O-N 3.23Å; V169-R172 VanDerWaalsContact O-N 3.11Å; V169-L173 HydrophobicContact CG1-CD1 3.7Å; V169-L173 HydrophobicContact CG1-CG 4.1Å; V169-L173 WeakPolarHBondContact O-CB 3.34Å; V169-L173 VanDerWaalsContact O-CG 3.25Å; V169-L173 WeakPolarHBondContact O-CG 3.44Å; V169-L173 PolarHBondContact O-N 3.27Å
170	E	81.7	Confident	75.9	Confident	103 Å²	103	117.3 Å²	117.3	48%	0.481	57%	0.57	S	S	.	*	H	α-helix	trans	-57.4	-49.4	176.2	-73.5	169	178.7	0	0	112.1	M166 K167 R172 L173 E174	M166-E170 WeakPolarHBondContact O-CG 3.41Å; M166-E170 PolarHBondContact O-N 2.9Å; K167-E170 PolarHBondContact O-N 3.27Å; E170-R172 PolarHBondContact O-N 3.47Å; E170-L173 CarbonylContact O-C 3.53Å; E170-L173 PolarHBondContact O-N 2.93Å; E170-E174 WeakPolarHBondContact O-CB 3.3Å; E170-E174 PolarHBondContact O-N 3.5Å
171	E	79.7	Confident	76.3	Confident	106 Å²	106	122.7 Å²	122.7	50%	0.495	60%	0.599	S	S	.	*	H	α-helix	trans	-58.4	-33.1	175.8	-74.2	170.6	-177.7	0	0	112.5	K167 V169	K167-E171 WeakPolarHBondContact CE-OE1 3.49Å; K167-E171 IonicContact NZ-OE1 2.68Å; K167-E171 WeakPolarHBondContact O-CB 3.38Å; K167-E171 VanDerWaalsContact O-CG 3.3Å; K167-E171 WeakPolarHBondContact O-CG 3.42Å; K167-E171 PolarHBondContact O-N 3.46Å; V169-E171 PolarHBondContact O-N 2.92Å
172	R	75.4	Confident	76.2	Confident	195 Å²	195	120.5 Å²	120.5	74%	0.736	59%	0.586	S	S	*	*	H	α-helix	trans	-77.6	-30.6	175.2	-77.6	179.2	175.8	-170.4	-1.3	113	R168 V169 E170 I176	R168-R172 WeakPolarHBondContact O-CB 3.31Å; R168-R172 VanDerWaalsContact O-CG 3.31Å; R168-R172 WeakPolarHBondContact O-CG 3.37Å; R168-R172 PolarHBondContact O-N 3.21Å; V169-R172 CarbonylContact O-C 3.6Å; V169-R172 WeakPolarHBondContact O-CB 3.39Å; V169-R172 PolarHBondContact O-N 3.23Å; V169-R172 VanDerWaalsContact O-N 3.11Å; E170-R172 PolarHBondContact O-N 3.47Å; R172-I176 WeakPolarHBondContact O-CG1 3.44Å
173	L	78	Confident	76	Confident	87 Å²	87	120.3 Å²	120.3	46%	0.455	58%	0.58	S	S	.	*	H	α-helix	trans	-82.1	-25.8	179.5	-68.9	178.1	0	0	0	112.1	V169 E170 G175 I176	V169-L173 HydrophobicContact CG1-CD1 3.7Å; V169-L173 HydrophobicContact CG1-CG 4.1Å; V169-L173 WeakPolarHBondContact O-CB 3.34Å; V169-L173 VanDerWaalsContact O-CG 3.25Å; V169-L173 WeakPolarHBondContact O-CG 3.44Å; V169-L173 PolarHBondContact O-N 3.27Å; E170-L173 CarbonylContact O-C 3.53Å; E170-L173 PolarHBondContact O-N 2.93Å; L173-G175 PolarHBondContact O-N 2.86Å; L173-I176 HydrophobicContact CD2-CD1 3.7Å; L173-I176 WeakPolarHBondContact O-CB 3.31Å; L173-I176 PolarHBondContact O-N 3.04Å
174	E	72.7	Confident	76	Confident	145 Å²	145	113.6 Å²	113.6	68%	0.678	57%	0.57	S	S	*	*	H	α-helix	trans	-57.2	-37.1	179.8	-165.5	167.9	-159	0	0	111.5	E170	E170-E174 WeakPolarHBondContact O-CB 3.3Å; E170-E174 PolarHBondContact O-N 3.5Å
175	G	66	Low	75.8	Confident	49 Å²	49	112.7 Å²	112.7	51%	0.505	57%	0.568	S	S	.	*	H	α-helix	trans	-86	-2.8	174.5	0	0	0	0	0	116	L173	L173-G175 PolarHBondContact O-N 2.86Å
176	I	70.6	Confident	75.7	Confident	106 Å²	106	109.6 Å²	109.6	54%	0.544	56%	0.561	S	S	.	*	H	α-helix	trans	-87	-34.3	179.3	-63.3	-179.3	0	0	0	110.9	R172 L173 D178 Y179	R172-I176 WeakPolarHBondContact O-CG1 3.44Å; L173-I176 HydrophobicContact CD2-CD1 3.7Å; L173-I176 WeakPolarHBondContact O-CB 3.31Å; L173-I176 PolarHBondContact O-N 3.04Å; I176-D178 VanDerWaalsContact C-N 3.31Å; I176-Y179 WeakPolarHBondContact O-CB 3.42Å; I176-Y179 PolarHBondContact O-N 3.29Å
177	L	64.6	Low	75.6	Confident	157 Å²	157	109.5 Å²	109.5	82%	0.822	56%	0.557	S	S	*	*	H	α-helix	trans	-71.3	-29.1	177.5	-68.8	172.1	0	0	0	112.2	Y179	L177-Y179 VanDerWaalsContact C-N 3.35Å
178	D	67.7	Low	75.5	Confident	134 Å²	134	111.1 Å²	111.1	72%	0.717	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	14.6	175.5	-63.2	-22.1	0	0	0	113	I176 E180	I176-D178 VanDerWaalsContact C-N 3.31Å; D178-E180 PolarHBondContact O-N 3.1Å
179	Y	69	Low	75.5	Confident	158 Å²	158	111.6 Å²	111.6	62%	0.62	57%	0.57	S	S	*	*			trans	-71.5	95	178	-171.7	-95.1	0	0	0	110.4	I176 L177	I176-Y179 WeakPolarHBondContact O-CB 3.42Å; I176-Y179 PolarHBondContact O-N 3.29Å; L177-Y179 VanDerWaalsContact C-N 3.35Å
180	E	70.9	Confident	75.7	Confident	174 Å²	174	112.5 Å²	112.5	81%	0.813	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-69.7	129.5	167.6	-66.9	-171.3	170.1	0	0	109.9	D178	D178-E180 PolarHBondContact O-N 3.1Å
181	L	71.9	Confident	76.1	Confident	146 Å²	146	115.8 Å²	115.8	76%	0.764	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-55	130.5	170.9	-76.8	166.5	0	0	0	108.8	S183	L181-S183 PolarHBondContact O-N 3.49Å
182	P	75.6	Confident	76.4	Confident	42 Å²	42	116.1 Å²	116.1	27%	0.273	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-51.5	136.4	174.6	-26	33.2	0	0	0	110.4	F187	P182-F187 HydrophobicContact CB-CE2 3.96Å; P182-F187 HydrophobicContact CB-CZ 4.12Å; P182-F187 HydrophobicContact CG-CZ 4.24Å; P182-F187 VanDerWaalsContact O-CE2 3.22Å; P182-F187 WeakPolarHBondContact O-CE2 3.31Å
183	S	76.5	Confident	77.1	Confident	74 Å²	74	109.7 Å²	109.7	52%	0.517	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-56.3	152.9	179.5	64.1	0	0	0	0	111.2	L181 D185 S186 F187	L181-S183 PolarHBondContact O-N 3.49Å; S183-D185 PolarHBondContact O-N 3.07Å; S183-S186 WeakPolarHBondContact O-CA 3.48Å; S183-S186 WeakPolarHBondContact O-CB 3.3Å; S183-S186 PolarHBondContact O-N 3.37Å; S183-S186 PolarHBondContact OG-N 3.34Å; S183-F187 PolarHBondContact O-N 3.45Å
184	A	80	Confident	77.8	Confident	70 Å²	70	110.7 Å²	110.7	58%	0.579	57%	0.57	S	S	*	*	H	α-helix	trans	-54.4	-30.7	177.5	0	0	0	0	0	112.5	F187 R188	A184-F187 PolarHBondContact O-N 3.48Å; A184-R188 WeakPolarHBondContact O-CG 3.43Å; A184-R188 PolarHBondContact O-N 3.33Å
185	D	78.4	Confident	78.7	Confident	93 Å²	93	111.2 Å²	111.2	50%	0.497	57%	0.565	S	S	.	*	H	α-helix	trans	-70.1	-32.1	175.5	-65.3	-36.8	0	0	0	112.7	S183 F187 R188 N189	S183-D185 PolarHBondContact O-N 3.07Å; D185-F187 VanDerWaalsContact C-N 3.35Å; D185-R188 PolarHBondContact O-N 2.85Å; D185-N189 WeakPolarHBondContact O-CB 3.3Å; D185-N189 PolarHBondContact O-N 3.27Å; D185-N189 PolarHBondContact O-ND2 3.38Å
186	S	78.8	Confident	79.9	Confident	45 Å²	45	113.8 Å²	113.8	32%	0.315	56%	0.564	S	S	.	*	H	α-helix	trans	-60.5	-45.1	171.5	-174.3	0	0	0	0	111.2	S183 R188 N189 M190	S183-S186 WeakPolarHBondContact O-CA 3.48Å; S183-S186 WeakPolarHBondContact O-CB 3.3Å; S183-S186 PolarHBondContact O-N 3.37Å; S183-S186 PolarHBondContact OG-N 3.34Å; S186-R188 PolarHBondContact O-N 3.06Å; S186-N189 PolarHBondContact O-N 2.86Å; S186-M190 VanDerWaalsContact O-CB 3.31Å; S186-M190 WeakPolarHBondContact O-CB 3.42Å; S186-M190 PolarHBondContact O-N 3.4Å
187	F	80.5	Confident	80.9	Confident	112 Å²	112	113.1 Å²	113.1	49%	0.491	56%	0.561	S	S	.	*	H	α-helix	trans	-65.2	-38.2	175.6	-69	-70.7	0	0	0	112.7	P182 S183 A184 D185 R191	P182-F187 HydrophobicContact CB-CE2 3.96Å; P182-F187 HydrophobicContact CB-CZ 4.12Å; P182-F187 HydrophobicContact CG-CZ 4.24Å; P182-F187 VanDerWaalsContact O-CE2 3.22Å; P182-F187 WeakPolarHBondContact O-CE2 3.31Å; S183-F187 PolarHBondContact O-N 3.45Å; A184-F187 PolarHBondContact O-N 3.48Å; D185-F187 VanDerWaalsContact C-N 3.35Å; F187-R191 VanDerWaalsContact O-CB 3.3Å; F187-R191 WeakPolarHBondContact O-CB 3.48Å; F187-R191 PolarHBondContact O-N 3.37Å
188	R	83.3	Confident	82.3	Confident	159 Å²	159	110.3 Å²	110.3	60%	0.6	55%	0.546	S	S	*	.	H	α-helix	trans	-62.9	-47.2	173.8	-73.7	177.7	176.1	-176.8	-1.2	111.4	A184 D185 S186 M190 R191 H192	A184-R188 WeakPolarHBondContact O-CG 3.43Å; A184-R188 PolarHBondContact O-N 3.33Å; D185-R188 PolarHBondContact O-N 2.85Å; S186-R188 PolarHBondContact O-N 3.06Å; R188-M190 PolarHBondContact O-N 2.89Å; R188-R191 WeakPolarHBondContact O-CB 3.21Å; R188-R191 PolarHBondContact O-N 2.94Å; R188-H192 PolarHBondContact O-CD2 2.8Å; R188-H192 PolarHBondContact O-N 2.86Å
189	N	82.2	Confident	83.5	Confident	107 Å²	107	108 Å²	108	57%	0.572	53%	0.534	S	S	*	.	H	α-helix	trans	-63	-43.1	178.5	-70.4	-18.9	0	0	0	111.7	D185 S186 R191 H192 S193	D185-N189 WeakPolarHBondContact O-CB 3.3Å; D185-N189 PolarHBondContact O-N 3.27Å; D185-N189 PolarHBondContact O-ND2 3.38Å; S186-N189 PolarHBondContact O-N 2.86Å; N189-R191 VanDerWaalsContact C-N 3.34Å; N189-R191 PolarHBondContact O-N 3.41Å; N189-H192 PolarHBondContact O-N 3.36Å; N189-S193 WeakPolarHBondContact O-CB 3.45Å; N189-S193 PolarHBondContact O-N 3.5Å
190	M	86.8	Confident	84.7	Confident	101 Å²	101	106.2 Å²	106.2	50%	0.498	53%	0.53	S	S	.	.	H	α-helix	trans	-62.9	-41.7	176.2	-164.5	-178.9	-57.2	0	0	111.3	S186 R188 H192 S193 L194	S186-M190 VanDerWaalsContact O-CB 3.31Å; S186-M190 WeakPolarHBondContact O-CB 3.42Å; S186-M190 PolarHBondContact O-N 3.4Å; R188-M190 PolarHBondContact O-N 2.89Å; M190-H192 PolarHBondContact O-N 2.89Å; M190-S193 PolarHBondContact O-N 3.18Å; M190-L194 HydrophobicContact CG-CD1 4.42Å; M190-L194 WeakPolarHBondContact O-CB 3.46Å; M190-L194 VanDerWaalsContact O-CG 3.31Å; M190-L194 WeakPolarHBondContact O-CG 3.4Å; M190-L194 PolarHBondContact O-N 2.89Å
191	R	89.5	Confident	85.7	Confident	171 Å²	171	103.7 Å²	103.7	65%	0.645	52%	0.519	S	S	*	.	H	α-helix	trans	-61.9	-42.5	173.8	177.7	179.8	160.6	-178.3	-4.9	112.2	F187 R188 N189 R195	F187-R191 VanDerWaalsContact O-CB 3.3Å; F187-R191 WeakPolarHBondContact O-CB 3.48Å; F187-R191 PolarHBondContact O-N 3.37Å; R188-R191 WeakPolarHBondContact O-CB 3.21Å; R188-R191 PolarHBondContact O-N 2.94Å; N189-R191 VanDerWaalsContact C-N 3.34Å; N189-R191 PolarHBondContact O-N 3.41Å; R191-R195 WeakPolarHBondContact O-CB 3.33Å; R191-R195 PolarHBondContact O-N 3.38Å; R191-R195 VanDerWaalsContact O-N 3.1Å
192	H	86.3	Confident	86.5	Confident	114 Å²	114	99.7 Å²	99.7	53%	0.528	50%	0.504	S	S	.	.	H	α-helix	trans	-64.3	-44.2	175.2	-75.2	-63.2	0	0	0	111.9	R188 N189 M190 R195 E196	R188-H192 PolarHBondContact O-CD2 2.8Å; R188-H192 PolarHBondContact O-N 2.86Å; N189-H192 PolarHBondContact O-N 3.36Å; M190-H192 PolarHBondContact O-N 2.89Å; H192-R195 WeakPolarHBondContact O-CB 3.33Å; H192-R195 PolarHBondContact O-N 2.91Å; H192-E196 PolarHBondContact O-N 2.97Å
193	S	90.9	Very high	87.2	Confident	59 Å²	59	104.7 Å²	104.7	41%	0.413	52%	0.521	S	S	.	.	H	α-helix	trans	-61.3	-45.8	177.4	-175.7	0	0	0	0	112.1	N189 M190 R195 E196 I197	N189-S193 WeakPolarHBondContact O-CB 3.45Å; N189-S193 PolarHBondContact O-N 3.5Å; M190-S193 PolarHBondContact O-N 3.18Å; S193-R195 VanDerWaalsContact C-N 3.29Å; S193-R195 PolarHBondContact O-N 3.1Å; S193-E196 PolarHBondContact O-N 2.92Å; S193-I197 VanDerWaalsContact O-CG1 3.3Å; S193-I197 WeakPolarHBondContact O-CG1 3.39Å; S193-I197 PolarHBondContact O-N 3.48Å
194	L	91.8	Very high	87.8	Confident	109 Å²	109	106.9 Å²	106.9	57%	0.571	52%	0.523	S	S	*	.	H	α-helix	trans	-61.8	-37.3	175.8	-73.3	172.2	0	0	0	112.2	M190 N198	M190-L194 HydrophobicContact CG-CD1 4.42Å; M190-L194 WeakPolarHBondContact O-CB 3.46Å; M190-L194 VanDerWaalsContact O-CG 3.31Å; M190-L194 WeakPolarHBondContact O-CG 3.4Å; M190-L194 PolarHBondContact O-N 2.89Å; L194-N198 WeakPolarHBondContact O-CB 3.45Å; L194-N198 PolarHBondContact O-N 2.97Å
195	R	91.4	Very high	88.2	Confident	155 Å²	155	112 Å²	112	59%	0.585	53%	0.527	S	S	*	.	H	α-helix	trans	-64.9	-45.1	175.9	-153.5	-179.6	-142.4	176.2	1.9	111.4	R191 H192 S193 N198 D199	R191-R195 WeakPolarHBondContact O-CB 3.33Å; R191-R195 PolarHBondContact O-N 3.38Å; R191-R195 VanDerWaalsContact O-N 3.1Å; H192-R195 WeakPolarHBondContact O-CB 3.33Å; H192-R195 PolarHBondContact O-N 2.91Å; S193-R195 VanDerWaalsContact C-N 3.29Å; S193-R195 PolarHBondContact O-N 3.1Å; R195-N198 PolarHBondContact O-N 2.79Å; R195-D199 VanDerWaalsContact O-CG 3.28Å; R195-D199 PolarHBondContact O-N 2.93Å
196	E	90.6	Very high	88.4	Confident	104 Å²	104	114.2 Å²	114.2	49%	0.486	53%	0.532	S	S	.	.	H	α-helix	trans	-64.1	-40.9	178	-165.3	-167.7	153.4	0	0	112.3	H192 S193 N198 D199 K200	H192-E196 PolarHBondContact O-N 2.97Å; S193-E196 PolarHBondContact O-N 2.92Å; E196-N198 VanDerWaalsContact C-N 3.35Å; E196-D199 PolarHBondContact O-N 2.91Å; E196-K200 HydrophobicContact CG-CD 4.5Å; E196-K200 WeakPolarHBondContact O-CB 3.27Å; E196-K200 WeakPolarHBondContact O-CG 3.38Å; E196-K200 PolarHBondContact O-N 3.19Å; E196-K200 WeakPolarHBondContact OE1-CE 3.48Å; E196-K200 IonicContact OE1-NZ 3.32Å; E196-K200 PolarHBondContact OE1-NZ 2.71Å
197	I	92.9	Very high	88.6	Confident	91 Å²	91	115.9 Å²	115.9	47%	0.467	54%	0.538	S	S	.	.	H	α-helix	trans	-62.1	-44.8	174.7	-68.5	165.9	0	0	0	110.1	S193 D199 K200 M201	S193-I197 VanDerWaalsContact O-CG1 3.3Å; S193-I197 WeakPolarHBondContact O-CG1 3.39Å; S193-I197 PolarHBondContact O-N 3.48Å; I197-D199 VanDerWaalsContact C-N 3.34Å; I197-D199 PolarHBondContact O-N 3.29Å; I197-K200 PolarHBondContact O-N 3.45Å; I197-M201 HydrophobicContact CG2-CG 4.35Å; I197-M201 WeakPolarHBondContact O-CB 3.4Å; I197-M201 WeakPolarHBondContact O-CG 3.32Å; I197-M201 PolarHBondContact O-N 3.34Å
198	N	93.7	Very high	88.7	Confident	98 Å²	98	114.9 Å²	114.9	52%	0.524	54%	0.537	S	S	.	.	H	α-helix	trans	-63.2	-39.8	178.3	-171.4	49.9	0	0	0	112.4	L194 R195 E196 M201 S202	L194-N198 WeakPolarHBondContact O-CB 3.45Å; L194-N198 PolarHBondContact O-N 2.97Å; R195-N198 PolarHBondContact O-N 2.79Å; E196-N198 VanDerWaalsContact C-N 3.35Å; N198-M201 PolarHBondContact O-N 3.48Å; N198-S202 WeakPolarHBondContact O-CB 3.48Å; N198-S202 PolarHBondContact O-N 3.04Å; N198-S202 PolarHBondContact O-OG 2.97Å
199	D	92.6	Very high	88.5	Confident	86 Å²	86	111 Å²	111	46%	0.46	53%	0.528	S	S	.	.	H	α-helix	trans	-65.5	-41	175.7	-68.5	-15.4	0	0	0	111.5	R195 E196 I197 S202 K203	R195-D199 VanDerWaalsContact O-CG 3.28Å; R195-D199 PolarHBondContact O-N 2.93Å; E196-D199 PolarHBondContact O-N 2.91Å; I197-D199 VanDerWaalsContact C-N 3.34Å; I197-D199 PolarHBondContact O-N 3.29Å; D199-S202 PolarHBondContact O-N 2.91Å; D199-K203 WeakPolarHBondContact O-CG 3.48Å; D199-K203 PolarHBondContact O-N 3.2Å
200	K	94.2	Very high	88.2	Confident	121 Å²	121	114.2 Å²	114.2	53%	0.526	53%	0.532	S	S	.	.	H	α-helix	trans	-63.2	-45.9	174.2	-78.3	169.3	171.2	165.7	0	111.5	E196 I197 S202 K203 H204	E196-K200 HydrophobicContact CG-CD 4.5Å; E196-K200 WeakPolarHBondContact O-CB 3.27Å; E196-K200 WeakPolarHBondContact O-CG 3.38Å; E196-K200 PolarHBondContact O-N 3.19Å; E196-K200 WeakPolarHBondContact OE1-CE 3.48Å; E196-K200 IonicContact OE1-NZ 3.32Å; E196-K200 PolarHBondContact OE1-NZ 2.71Å; I197-K200 PolarHBondContact O-N 3.45Å; K200-S202 VanDerWaalsContact C-N 3.33Å; K200-S202 PolarHBondContact O-N 3.27Å; K200-K203 PolarHBondContact O-N 2.89Å; K200-H204 WeakPolarHBondContact O-CB 3.39Å; K200-H204 PolarHBondContact O-N 2.91Å
201	M	91.8	Very high	87.2	Confident	121 Å²	121	115 Å²	115	60%	0.596	53%	0.534	S	S	*	.	H	α-helix	trans	-60.8	-41.7	176.3	-76.5	-61.9	-61.6	0	0	111.8	I197 N198 H204 R205	I197-M201 HydrophobicContact CG2-CG 4.35Å; I197-M201 WeakPolarHBondContact O-CB 3.4Å; I197-M201 WeakPolarHBondContact O-CG 3.32Å; I197-M201 PolarHBondContact O-N 3.34Å; N198-M201 PolarHBondContact O-N 3.48Å; M201-H204 PolarHBondContact O-N 3.32Å; M201-R205 WeakPolarHBondContact O-CB 3.47Å; M201-R205 PolarHBondContact O-N 3.36Å
202	S	88.9	Confident	85.9	Confident	62 Å²	62	112.8 Å²	112.8	43%	0.434	54%	0.535	S	S	.	.	H	α-helix	trans	-63.6	-43.1	177	-59.7	0	0	0	0	111.9	N198 D199 K200 R205 F206	N198-S202 WeakPolarHBondContact O-CB 3.48Å; N198-S202 PolarHBondContact O-N 3.04Å; N198-S202 PolarHBondContact O-OG 2.97Å; D199-S202 PolarHBondContact O-N 2.91Å; K200-S202 VanDerWaalsContact C-N 3.33Å; K200-S202 PolarHBondContact O-N 3.27Å; S202-R205 PolarHBondContact O-N 2.91Å; S202-F206 WeakPolarHBondContact O-CB 3.44Å; S202-F206 PolarHBondContact O-N 3.26Å
203	K	90.6	Very high	84.5	Confident	146 Å²	146	112 Å²	112	64%	0.635	54%	0.543	S	S	*	.	H	α-helix	trans	-62.4	-42.6	172.9	-72.3	173.5	-176.6	176.5	0	112	D199 K200 F206 L207	D199-K203 WeakPolarHBondContact O-CG 3.48Å; D199-K203 PolarHBondContact O-N 3.2Å; K200-K203 PolarHBondContact O-N 2.89Å; K203-F206 PolarHBondContact O-N 3.3Å; K203-L207 WeakPolarHBondContact O-CG 3.37Å; K203-L207 PolarHBondContact O-N 3.01Å
204	H	88.3	Confident	82.9	Confident	121 Å²	121	111.2 Å²	111.2	56%	0.56	54%	0.54	S	S	*	.	H	α-helix	trans	-66.1	-41	179.5	-138.3	-77.5	0	0	0	111.5	K200 M201 L207 L208	K200-H204 WeakPolarHBondContact O-CB 3.39Å; K200-H204 PolarHBondContact O-N 2.91Å; M201-H204 PolarHBondContact O-N 3.32Å; H204-L207 PolarHBondContact O-N 3.4Å; H204-L208 WeakPolarHBondContact O-CB 3.37Å; H204-L208 VanDerWaalsContact O-CG 3.31Å; H204-L208 WeakPolarHBondContact O-CG 3.42Å; H204-L208 PolarHBondContact O-N 2.85Å
205	R	88.1	Confident	81	Confident	178 Å²	178	111.4 Å²	111.4	67%	0.672	54%	0.541	S	S	*	.	H	α-helix	trans	-62.4	-45.8	173.3	-175.8	171.1	176.5	148.1	-0.2	111.5	M201 S202 L207 L208 D209	M201-R205 WeakPolarHBondContact O-CB 3.47Å; M201-R205 PolarHBondContact O-N 3.36Å; S202-R205 PolarHBondContact O-N 2.91Å; R205-L207 VanDerWaalsContact C-N 3.31Å; R205-L207 PolarHBondContact O-N 2.89Å; R205-L208 PolarHBondContact O-N 2.96Å; R205-D209 WeakPolarHBondContact O-CB 3.41Å; R205-D209 VanDerWaalsContact O-CG 3.28Å; R205-D209 PolarHBondContact O-N 2.93Å
206	F	83.1	Confident	79.2	Confident	138 Å²	138	110.8 Å²	110.8	61%	0.605	55%	0.549	S	S	*	.	H	α-helix	trans	-59.7	-40.3	174.8	178.3	-97.6	0	0	0	112.7	S202 K203 R210	S202-F206 WeakPolarHBondContact O-CB 3.44Å; S202-F206 PolarHBondContact O-N 3.26Å; K203-F206 PolarHBondContact O-N 3.3Å; F206-R210 WeakPolarHBondContact O-CB 3.35Å; F206-R210 PolarHBondContact O-N 2.85Å
207	L	84	Confident	77.4	Confident	81 Å²	81	110.3 Å²	110.3	42%	0.424	55%	0.55	S	S	.	.	H	α-helix	trans	-65.3	-45.1	174.7	-72.7	171.6	0	0	0	111.5	K203 H204 R205 R210 H211	K203-L207 WeakPolarHBondContact O-CG 3.37Å; K203-L207 PolarHBondContact O-N 3.01Å; H204-L207 PolarHBondContact O-N 3.4Å; R205-L207 VanDerWaalsContact C-N 3.31Å; R205-L207 PolarHBondContact O-N 2.89Å; L207-R210 WeakPolarHBondContact O-CB 3.16Å; L207-R210 PolarHBondContact O-N 3.33Å; L207-H211 PolarHBondContact O-CD2 3.41Å; L207-H211 PolarHBondContact O-N 3.42Å
208	L	81	Confident	75.7	Confident	91 Å²	91	115.4 Å²	115.4	48%	0.476	57%	0.571	S	S	.	*	H	α-helix	trans	-63	-43.2	176.3	-71.6	172.7	0	0	0	111.8	H204 R205 R210 H211 N212	H204-L208 WeakPolarHBondContact O-CB 3.37Å; H204-L208 VanDerWaalsContact O-CG 3.31Å; H204-L208 WeakPolarHBondContact O-CG 3.42Å; H204-L208 PolarHBondContact O-N 2.85Å; R205-L208 PolarHBondContact O-N 2.96Å; L208-R210 VanDerWaalsContact C-N 3.3Å; L208-R210 PolarHBondContact O-N 3.38Å; L208-H211 CarbonylContact O-C 3.34Å; L208-H211 PolarHBondContact O-N 2.95Å; L208-H211 VanDerWaalsContact O-N 3.09Å; L208-N212 WeakPolarHBondContact O-CB 3.44Å; L208-N212 PolarHBondContact O-N 3.28Å
209	D	80.6	Confident	73.7	Confident	76 Å²	76	117.6 Å²	117.6	41%	0.406	58%	0.583	S	S	.	*	H	α-helix	trans	-61.5	-40.3	175.6	-70.9	-20.5	0	0	0	110.5	R205 H211 N212 S213	R205-D209 WeakPolarHBondContact O-CB 3.41Å; R205-D209 VanDerWaalsContact O-CG 3.28Å; R205-D209 PolarHBondContact O-N 2.93Å; D209-H211 VanDerWaalsContact C-N 3.34Å; D209-H211 PolarHBondContact O-N 2.98Å; D209-N212 PolarHBondContact O-N 3.05Å; D209-S213 VanDerWaalsContact O-CB 3.27Å; D209-S213 WeakPolarHBondContact O-CB 3.34Å; D209-S213 PolarHBondContact O-N 2.9Å; D209-S213 PolarHBondContact O-OG 3.09Å
210	R	75.4	Confident	72	Confident	175 Å²	175	117.7 Å²	117.7	66%	0.66	58%	0.584	S	S	*	*	H	α-helix	trans	-64.1	-36.9	173	180	178.7	171.9	173.3	-1.4	112.8	F206 L207 L208 A214	F206-R210 WeakPolarHBondContact O-CB 3.35Å; F206-R210 PolarHBondContact O-N 2.85Å; L207-R210 WeakPolarHBondContact O-CB 3.16Å; L207-R210 PolarHBondContact O-N 3.33Å; L208-R210 VanDerWaalsContact C-N 3.3Å; L208-R210 PolarHBondContact O-N 3.38Å; R210-A214 PolarHBondContact O-N 2.76Å
211	H	65.5	Low	70.1	Confident	119 Å²	119	121.6 Å²	121.6	55%	0.551	60%	0.6	S	S	*	*	H	α-helix	trans	-75.9	-31.6	177.1	-78.6	-67.8	0	0	0	112.8	L207 L208 D209 A214	L207-H211 PolarHBondContact O-CD2 3.41Å; L207-H211 PolarHBondContact O-N 3.42Å; L208-H211 CarbonylContact O-C 3.34Å; L208-H211 PolarHBondContact O-N 2.95Å; L208-H211 VanDerWaalsContact O-N 3.09Å; D209-H211 VanDerWaalsContact C-N 3.34Å; D209-H211 PolarHBondContact O-N 2.98Å; H211-A214 VanDerWaalsContact O-O 3.13Å
212	N	63.1	Low	68.5	Low	124 Å²	124	123.2 Å²	123.2	66%	0.663	60%	0.601	S	S	*	*	H	α-helix	trans	-80.8	-31.3	176.4	-76.6	1.9	0	0	0	112.5	L208 D209	L208-N212 WeakPolarHBondContact O-CB 3.44Å; L208-N212 PolarHBondContact O-N 3.28Å; D209-N212 PolarHBondContact O-N 3.05Å
213	S	56.8	Low	67.6	Low	98 Å²	98	127.4 Å²	127.4	69%	0.685	61%	0.611	S	S	*	*	S	Bend	trans	-75.5	-16.7	173.6	-49.5	0	0	0	0	112.4	D209 D215	D209-S213 VanDerWaalsContact O-CB 3.27Å; D209-S213 WeakPolarHBondContact O-CB 3.34Å; D209-S213 PolarHBondContact O-N 2.9Å; D209-S213 PolarHBondContact O-OG 3.09Å; S213-D215 VanDerWaalsContact C-N 3.29Å; S213-D215 PolarHBondContact O-N 2.89Å
214	A	56.3	Low	66.7	Low	42 Å²	42	125.2 Å²	125.2	35%	0.347	61%	0.61	S	S	.	*	S	Bend	trans	-80.7	89.9	162.9	0	0	0	0	0	105.6	R210 H211 L216	R210-A214 PolarHBondContact O-N 2.76Å; H211-A214 VanDerWaalsContact O-O 3.13Å; A214-L216 VanDerWaalsContact C-N 3.3Å; A214-L216 PolarHBondContact O-N 3.09Å
215	D	51.4	Low	65.9	Low	112 Å²	112	122 Å²	122	60%	0.599	60%	0.601	S	S	*	*			trans	-41.2	99	171.7	-77.4	-40.1	0	0	0	109	S213 D217	S213-D215 VanDerWaalsContact C-N 3.29Å; S213-D215 PolarHBondContact O-N 2.89Å; D215-D217 PolarHBondContact O-N 3.3Å
216	L	54.5	Low	65.5	Low	142 Å²	142	117 Å²	117	74%	0.743	59%	0.588	S	S	*	*			trans	-86	60	157.8	-68.5	173.6	0	0	0	104.5	A214 E218	A214-L216 VanDerWaalsContact C-N 3.3Å; A214-L216 PolarHBondContact O-N 3.09Å; L216-E218 VanDerWaalsContact C-N 3.28Å; L216-E218 PolarHBondContact O-N 2.66Å
217	D	52.5	Low	65.3	Low	95 Å²	95	116 Å²	116	51%	0.508	58%	0.58	S	S	.	*			trans	-59.3	105.7	160.3	-92.4	-20.4	0	0	0	105	D215 N219 D220	D215-D217 PolarHBondContact O-N 3.3Å; D217-N219 PolarHBondContact O-N 3.1Å; D217-D220 HydrophobicContact CB-CB 4.14Å; D217-D220 PolarHBondContact O-N 3.46Å
218	E	56.4	Low	65.2	Low	198 Å²	198	117 Å²	117	93%	0.925	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-4	171.3	-68.8	-163.8	155	0	0	111.9	L216	L216-E218 VanDerWaalsContact C-N 3.28Å; L216-E218 PolarHBondContact O-N 2.66Å
219	N	53.4	Low	65.3	Low	144 Å²	144	117.1 Å²	117.1	77%	0.77	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-4.3	175.2	-70.7	-38.9	0	0	0	114.9	D217 K221	D217-N219 PolarHBondContact O-N 3.1Å; N219-K221 PolarHBondContact O-N 3.14Å
220	D	55.5	Low	65.5	Low	88 Å²	88	120.1 Å²	120.1	47%	0.471	60%	0.597	S	S	.	*			trans	-83.3	87.8	-178	-131.6	10.3	0	0	0	110.1	D217 Y222	D217-D220 HydrophobicContact CB-CB 4.14Å; D217-D220 PolarHBondContact O-N 3.46Å; D220-Y222 PolarHBondContact O-N 3.24Å
221	K	55.4	Low	65.9	Low	202 Å²	202	117.6 Å²	117.6	88%	0.878	59%	0.591	S	S	*	*			trans	-62	3.3	176.9	-75.8	179.1	179.9	176	0	114.2	N219 K223	N219-K221 PolarHBondContact O-N 3.14Å; K221-K223 PolarHBondContact O-N 2.98Å; K221-K223 VanDerWaalsContact O-N 3.09Å
222	Y	58.4	Low	66.7	Low	155 Å²	155	117.1 Å²	117.1	61%	0.608	59%	0.585	S	S	*	*			trans	-65.4	110.1	168.9	-83.4	-79.7	0	0	0	109	D220 V224 D226	D220-Y222 PolarHBondContact O-N 3.24Å; Y222-V224 PolarHBondContact O-N 3.42Å; Y222-D226 HydrophobicContact CD1-CB 4.16Å
223	K	70	Confident	67.6	Low	150 Å²	150	118.2 Å²	118.2	65%	0.652	58%	0.584	S	S	*	*			trans	-54.2	136.7	173.4	-75.4	177.2	176.6	174.6	0	107.3	K221 S225 D226	K221-K223 PolarHBondContact O-N 2.98Å; K221-K223 VanDerWaalsContact O-N 3.09Å; K223-S225 WeakPolarHBondContact CB-OG 3.45Å; K223-S225 PolarHBondContact O-N 2.89Å; K223-D226 PolarHBondContact O-N 3.47Å
224	V	70.2	Confident	69	Low	100 Å²	100	117 Å²	117	61%	0.606	57%	0.567	S	S	*	*	H	α-helix	trans	-45.1	-32	172.9	174	0	0	0	0	111.6	Y222 D226 R227 I228	Y222-V224 PolarHBondContact O-N 3.42Å; V224-D226 PolarHBondContact O-N 3.48Å; V224-R227 PolarHBondContact O-N 3.07Å; V224-I228 HydrophobicContact CG1-CD1 3.72Å; V224-I228 HydrophobicContact CG1-CG1 4.29Å; V224-I228 WeakPolarHBondContact O-CB 3.49Å; V224-I228 VanDerWaalsContact O-CG1 3.23Å; V224-I228 WeakPolarHBondContact O-CG1 3.45Å; V224-I228 PolarHBondContact O-N 2.88Å
225	S	73.4	Confident	70.2	Confident	53 Å²	53	119.2 Å²	119.2	37%	0.371	57%	0.573	S	S	.	*	H	α-helix	trans	-56.9	-42	172.8	55.9	0	0	0	0	114.5	K223 I228 N229	K223-S225 WeakPolarHBondContact CB-OG 3.45Å; K223-S225 PolarHBondContact O-N 2.89Å; S225-I228 PolarHBondContact O-N 2.68Å; S225-N229 WeakPolarHBondContact O-CB 3.14Å; S225-N229 PolarHBondContact O-N 3.23Å; S225-N229 PolarHBondContact O-ND2 3.19Å
226	D	78.9	Confident	71.4	Confident	73 Å²	73	117.2 Å²	117.2	39%	0.39	56%	0.56	S	S	.	*	H	α-helix	trans	-72.1	-40.6	-176.4	-59.6	-26.3	0	0	0	110.3	Y222 K223 V224 I228 N229 E230	Y222-D226 HydrophobicContact CD1-CB 4.16Å; K223-D226 PolarHBondContact O-N 3.47Å; V224-D226 PolarHBondContact O-N 3.48Å; D226-I228 VanDerWaalsContact C-N 3.35Å; D226-I228 PolarHBondContact O-N 3.38Å; D226-N229 PolarHBondContact O-N 2.97Å; D226-E230 WeakPolarHBondContact O-CB 3.38Å; D226-E230 PolarHBondContact O-N 3.17Å
227	R	78.8	Confident	72.6	Confident	119 Å²	119	118.3 Å²	118.3	45%	0.449	56%	0.562	S	S	.	*	H	α-helix	trans	-61.8	-40.7	171.8	-72.6	172.7	57.1	-173.1	2	112.3	V224 K231	V224-R227 PolarHBondContact O-N 3.07Å; R227-K231 WeakPolarHBondContact O-CG 3.23Å; R227-K231 PolarHBondContact O-N 3.48Å; R227-K231 VanDerWaalsContact O-N 3.07Å
228	I	81.9	Confident	73.8	Confident	102 Å²	102	122.6 Å²	122.6	52%	0.523	57%	0.571	S	S	.	*	H	α-helix	trans	-64.4	-45.1	174.7	-71.2	168.4	0	0	0	110.3	V224 S225 D226 E230 K231 Y232	V224-I228 HydrophobicContact CG1-CD1 3.72Å; V224-I228 HydrophobicContact CG1-CG1 4.29Å; V224-I228 WeakPolarHBondContact O-CB 3.49Å; V224-I228 VanDerWaalsContact O-CG1 3.23Å; V224-I228 WeakPolarHBondContact O-CG1 3.45Å; V224-I228 PolarHBondContact O-N 2.88Å; S225-I228 PolarHBondContact O-N 2.68Å; D226-I228 VanDerWaalsContact C-N 3.35Å; D226-I228 PolarHBondContact O-N 3.38Å; I228-E230 VanDerWaalsContact C-N 3.34Å; I228-E230 PolarHBondContact O-N 3.21Å; I228-K231 PolarHBondContact O-N 3.44Å; I228-Y232 WeakPolarHBondContact O-CB 3.49Å; I228-Y232 PolarHBondContact O-N 3.31Å
229	N	83.2	Confident	74.4	Confident	92 Å²	92	117.3 Å²	117.3	49%	0.492	55%	0.547	S	S	.	.	H	α-helix	trans	-64.2	-38.9	-179.9	-72	-21.9	0	0	0	112.2	S225 D226 Y232 K233	S225-N229 WeakPolarHBondContact O-CB 3.14Å; S225-N229 PolarHBondContact O-N 3.23Å; S225-N229 PolarHBondContact O-ND2 3.19Å; D226-N229 PolarHBondContact O-N 2.97Å; N229-Y232 PolarHBondContact O-N 3.5Å; N229-K233 WeakPolarHBondContact O-CG 3.42Å; N229-K233 PolarHBondContact O-N 3.24Å
230	E	83.9	Confident	75	Confident	140 Å²	140	114.7 Å²	114.7	65%	0.654	54%	0.538	S	S	*	.	H	α-helix	trans	-64.7	-45.4	175	-173	172.4	-154.9	0	0	111.5	D226 I228 Y232 K233 E234	D226-E230 WeakPolarHBondContact O-CB 3.38Å; D226-E230 PolarHBondContact O-N 3.17Å; I228-E230 VanDerWaalsContact C-N 3.34Å; I228-E230 PolarHBondContact O-N 3.21Å; E230-Y232 VanDerWaalsContact C-N 3.3Å; E230-Y232 PolarHBondContact O-N 2.97Å; E230-K233 PolarHBondContact O-N 3.37Å; E230-E234 PolarHBondContact O-N 2.82Å
231	K	84.1	Confident	75.2	Confident	122 Å²	122	113.6 Å²	113.6	53%	0.53	54%	0.536	S	S	.	.	H	α-helix	trans	-65.4	-33.3	174.4	-73.2	-69.6	166.3	-161.4	0	113	R227 I228 E234 L235	R227-K231 WeakPolarHBondContact O-CG 3.23Å; R227-K231 PolarHBondContact O-N 3.48Å; R227-K231 VanDerWaalsContact O-N 3.07Å; I228-K231 PolarHBondContact O-N 3.44Å; K231-E234 WeakPolarHBondContact CD-OE2 3.34Å; K231-E234 IonicContact NZ-OE2 3.8Å; K231-E234 PolarHBondContact NZ-OE2 3.26Å; K231-E234 PolarHBondContact O-N 3.5Å; K231-L235 WeakPolarHBondContact O-CB 3.31Å; K231-L235 VanDerWaalsContact O-CG 3.31Å; K231-L235 WeakPolarHBondContact O-CG 3.45Å; K231-L235 PolarHBondContact O-N 2.84Å
232	Y	82.2	Confident	75.3	Confident	109 Å²	109	106.4 Å²	106.4	43%	0.427	51%	0.507	S	S	.	.	H	α-helix	trans	-65.1	-44.1	173.6	-176.4	-91.3	0	0	0	111.1	I228 N229 E230 E234 L235 E236 D246	I228-Y232 WeakPolarHBondContact O-CB 3.49Å; I228-Y232 PolarHBondContact O-N 3.31Å; N229-Y232 PolarHBondContact O-N 3.5Å; E230-Y232 VanDerWaalsContact C-N 3.3Å; E230-Y232 PolarHBondContact O-N 2.97Å; Y232-E234 PolarHBondContact O-N 3.48Å; Y232-L235 PolarHBondContact O-N 3.46Å; Y232-E236 WeakPolarHBondContact O-CB 3.36Å; Y232-E236 PolarHBondContact O-N 3.31Å; Y232-D246 PolarHBondContact OH-OD2 3.45Å
233	K	82.6	Confident	75.3	Confident	146 Å²	146	100.3 Å²	100.3	64%	0.635	49%	0.486	S	S	*	.	H	α-helix	trans	-61.6	-42.2	174	-75.4	-177.6	177	-178.2	0	112.9	N229 E230 L235 E236 E237	N229-K233 WeakPolarHBondContact O-CG 3.42Å; N229-K233 PolarHBondContact O-N 3.24Å; E230-K233 PolarHBondContact O-N 3.37Å; K233-L235 VanDerWaalsContact C-N 3.32Å; K233-L235 PolarHBondContact O-N 2.78Å; K233-E236 WeakPolarHBondContact O-CB 3.29Å; K233-E236 PolarHBondContact O-N 3Å; K233-E237 PolarHBondContact O-N 3.1Å
234	E	85.6	Confident	74.4	Confident	72 Å²	72	98.8 Å²	98.8	34%	0.336	48%	0.483	S	S	.	.	H	α-helix	trans	-60.7	-41.9	175.2	-169.8	-164.8	147.6	0	0	111.4	E230 K231 Y232 R238	E230-E234 PolarHBondContact O-N 2.82Å; K231-E234 WeakPolarHBondContact CD-OE2 3.34Å; K231-E234 IonicContact NZ-OE2 3.8Å; K231-E234 PolarHBondContact NZ-OE2 3.26Å; K231-E234 PolarHBondContact O-N 3.5Å; Y232-E234 PolarHBondContact O-N 3.48Å; E234-R238 VanDerWaalsContact O-CG 3.29Å; E234-R238 WeakPolarHBondContact O-CG 3.47Å; E234-R238 PolarHBondContact O-N 3.01Å; E234-R238 VanDerWaalsContact O-N 3.1Å; E234-R238 IonicContact OE1-NH1 3.98Å
235	L	82.2	Confident	73.6	Confident	90 Å²	90	95.1 Å²	95.1	47%	0.471	46%	0.461	S	S	.	.	H	α-helix	trans	-68.2	-37.6	176	-75.2	169	0	0	0	112.4	K231 Y232 K233 E237 R238 M239	K231-L235 WeakPolarHBondContact O-CB 3.31Å; K231-L235 VanDerWaalsContact O-CG 3.31Å; K231-L235 WeakPolarHBondContact O-CG 3.45Å; K231-L235 PolarHBondContact O-N 2.84Å; Y232-L235 PolarHBondContact O-N 3.46Å; K233-L235 VanDerWaalsContact C-N 3.32Å; K233-L235 PolarHBondContact O-N 2.78Å; L235-E237 VanDerWaalsContact C-N 3.34Å; L235-R238 PolarHBondContact O-N 3.49Å; L235-M239 WeakPolarHBondContact O-CB 3.34Å; L235-M239 PolarHBondContact O-N 2.85Å
236	E	77.2	Confident	72.7	Confident	70 Å²	70	95.3 Å²	95.3	33%	0.327	46%	0.459	S	S	.	.	H	α-helix	trans	-61.2	-43.1	176.7	-168.3	178.1	-172.6	0	0	111.2	Y232 K233 M239 T243	Y232-E236 WeakPolarHBondContact O-CB 3.36Å; Y232-E236 PolarHBondContact O-N 3.31Å; K233-E236 WeakPolarHBondContact O-CB 3.29Å; K233-E236 PolarHBondContact O-N 3Å; E236-M239 CarbonylContact O-C 3.58Å; E236-M239 PolarHBondContact O-N 3.35Å; E236-T243 HydrophobicContact CG-CG2 3.19Å; E236-T243 WeakPolarHBondContact OE1-CG2 3.39Å
237	E	78.9	Confident	71.4	Confident	165 Å²	165	100.8 Å²	100.8	77%	0.771	47%	0.474	S	S	*	.	H	α-helix	trans	-66.1	-42.5	175.1	-173.7	174.3	-167.1	0	0	112.3	K233 L235 M239	K233-E237 PolarHBondContact O-N 3.1Å; L235-E237 VanDerWaalsContact C-N 3.34Å; E237-M239 VanDerWaalsContact C-N 3.34Å
238	R	78.6	Confident	70.3	Confident	185 Å²	185	98.4 Å²	98.4	70%	0.698	48%	0.479	S	S	*	.	H	α-helix	trans	-73.2	-25.3	179.1	-68.7	177.4	75.5	165.1	5.1	113.2	E234 L235	E234-R238 VanDerWaalsContact O-CG 3.29Å; E234-R238 WeakPolarHBondContact O-CG 3.47Å; E234-R238 PolarHBondContact O-N 3.01Å; E234-R238 VanDerWaalsContact O-N 3.1Å; E234-R238 IonicContact OE1-NH1 3.98Å; L235-R238 PolarHBondContact O-N 3.49Å
239	M	69.1	Low	68.8	Low	86 Å²	86	98.6 Å²	98.6	42%	0.424	47%	0.473	S	S	.	.			trans	-130.6	81.8	-176.5	-63.3	-128.9	-60.8	0	0	111.2	L235 E236 E237 C241 L242	L235-M239 WeakPolarHBondContact O-CB 3.34Å; L235-M239 PolarHBondContact O-N 2.85Å; E236-M239 CarbonylContact O-C 3.58Å; E236-M239 PolarHBondContact O-N 3.35Å; E237-M239 VanDerWaalsContact C-N 3.34Å; M239-C241 PolarHBondContact O-N 2.73Å; M239-L242 HydrophobicContact CB-CD1 3.79Å; M239-L242 HydrophobicContact CB-CG 3.84Å; M239-L242 HydrophobicContact CE-CD1 3.69Å; M239-L242 HydrophobicContact CE-CD2 4.06Å; M239-L242 HydrophobicContact CE-CG 3.87Å; M239-L242 WeakPolarHBondContact O-CB 3.19Å; M239-L242 PolarHBondContact O-N 2.63Å
240	P	65.6	Low	67.4	Low	89 Å²	89	103 Å²	103	58%	0.578	49%	0.491	S	S	*	.	H	α-helix	trans	-59.2	-20.3	178.1	20.5	-31	0	0	0	113.3	L242 T243	P240-L242 PolarHBondContact O-N 3.23Å; P240-T243 PolarHBondContact O-N 3.2Å; P240-T243 PolarHBondContact O-OG1 3Å
241	C	59.5	Low	66.1	Low	65 Å²	65	105.3 Å²	105.3	44%	0.439	50%	0.499	S	S	.	.	H	α-helix	trans	-65.6	-18.9	173.3	60.8	0	0	0	0	114.1	M239 S245	M239-C241 PolarHBondContact O-N 2.73Å; C241-S245 PolarHBondContact O-N 2.82Å; C241-S245 PolarHBondContact O-OG 3.12Å
242	L	58.1	Low	64.8	Low	52 Å²	52	106.8 Å²	106.8	27%	0.272	51%	0.508	S	S	.	.	H	α-helix	trans	-75.1	-40.6	173	-62.2	179.3	0	0	0	111.2	M239 P240 M244 S245 D246	M239-L242 HydrophobicContact CB-CD1 3.79Å; M239-L242 HydrophobicContact CB-CG 3.84Å; M239-L242 HydrophobicContact CE-CD1 3.69Å; M239-L242 HydrophobicContact CE-CD2 4.06Å; M239-L242 HydrophobicContact CE-CG 3.87Å; M239-L242 WeakPolarHBondContact O-CB 3.19Å; M239-L242 PolarHBondContact O-N 2.63Å; P240-L242 PolarHBondContact O-N 3.23Å; L242-M244 VanDerWaalsContact C-N 3.32Å; L242-M244 PolarHBondContact O-N 3.27Å; L242-S245 WeakPolarHBondContact O-CB 3.5Å; L242-S245 PolarHBondContact O-N 2.9Å; L242-D246 PolarHBondContact O-N 3.26Å
243	T	57.7	Low	63.4	Low	26 Å²	26	110.3 Å²	110.3	16%	0.16	53%	0.525	C	S	.	.	H	α-helix	trans	-59.6	-39.1	177.9	62.5	0	0	0	0	113.8	E236 P240 R247	E236-T243 HydrophobicContact CG-CG2 3.19Å; E236-T243 WeakPolarHBondContact OE1-CG2 3.39Å; P240-T243 PolarHBondContact O-N 3.2Å; P240-T243 PolarHBondContact O-OG1 3Å; T243-R247 PolarHBondContact O-N 3.33Å
244	M	50.3	Low	61.9	Low	118 Å²	118	115.9 Å²	115.9	58%	0.581	54%	0.542	S	S	*	.	H	α-helix	trans	-76.6	-29.5	-178.3	-63.2	-60.9	144.9	0	0	111.9	L242 A248	L242-M244 VanDerWaalsContact C-N 3.32Å; L242-M244 PolarHBondContact O-N 3.27Å; M244-A248 PolarHBondContact O-N 2.87Å
245	S	53.8	Low	60.3	Low	23 Å²	23	117 Å²	117	16%	0.161	55%	0.554	C	S	.	*	H	α-helix	trans	-66.3	-40.6	175.7	-59.6	0	0	0	0	110.5	C241 L242 R249	C241-S245 PolarHBondContact O-N 2.82Å; C241-S245 PolarHBondContact O-OG 3.12Å; L242-S245 WeakPolarHBondContact O-CB 3.5Å; L242-S245 PolarHBondContact O-N 2.9Å; S245-R249 WeakPolarHBondContact O-CB 3.49Å; S245-R249 WeakPolarHBondContact O-CD 3.09Å; S245-R249 WeakPolarHBondContact O-CG 3.38Å; S245-R249 PolarHBondContact O-N 3.18Å; S245-R249 PolarHBondContact O-NE 3.09Å
246	D	54.2	Low	59.2	Low	58 Å²	58	120 Å²	120	31%	0.31	58%	0.576	S	S	.	*	H	α-helix	trans	-77.4	-32.1	-178.3	-70.8	-31.1	0	0	0	114.4	Y232 L242 A248 R249	Y232-D246 PolarHBondContact OH-OD2 3.45Å; L242-D246 PolarHBondContact O-N 3.26Å; D246-A248 VanDerWaalsContact C-N 3.34Å; D246-A248 PolarHBondContact O-N 3.36Å; D246-R249 PolarHBondContact O-N 3.2Å; D246-R249 WeakPolarHBondContact OD1-CD 3.16Å; D246-R249 IonicContact OD1-CZ 2.73Å; D246-R249 IonicContact OD1-NE 2.88Å; D246-R249 IonicContact OD1-NH1 3.81Å; D246-R249 PolarHBondContact OD1-NH1 3.13Å
247	R	52.8	Low	58.2	Low	188 Å²	188	126.8 Å²	126.8	71%	0.709	60%	0.599	S	S	*	*	H	α-helix	trans	-70.8	-24.2	176	-75.3	-176.7	178.7	158.6	3	114.6	T243	T243-R247 PolarHBondContact O-N 3.33Å
248	A	54.2	Low	57.6	Low	68 Å²	68	125 Å²	125	56%	0.562	59%	0.589	S	S	*	*	H	α-helix	trans	-83.7	-31	171.3	0	0	0	0	0	112.3	M244 D246 E250 K251	M244-A248 PolarHBondContact O-N 2.87Å; D246-A248 VanDerWaalsContact C-N 3.34Å; D246-A248 PolarHBondContact O-N 3.36Å; A248-E250 VanDerWaalsContact C-N 3.33Å; A248-E250 PolarHBondContact O-N 3.08Å; A248-K251 PolarHBondContact O-N 3.36Å
249	R	51.5	Low	56.8	Low	107 Å²	107	119.1 Å²	119.1	40%	0.404	57%	0.571	S	S	.	*	H	α-helix	trans	-67.5	-21.8	-176.7	-81.4	165	-173	178.7	-1.6	115.2	S245 D246 K251 F262	S245-R249 WeakPolarHBondContact O-CB 3.49Å; S245-R249 WeakPolarHBondContact O-CD 3.09Å; S245-R249 WeakPolarHBondContact O-CG 3.38Å; S245-R249 PolarHBondContact O-N 3.18Å; S245-R249 PolarHBondContact O-NE 3.09Å; D246-R249 PolarHBondContact O-N 3.2Å; D246-R249 WeakPolarHBondContact OD1-CD 3.16Å; D246-R249 IonicContact OD1-CZ 2.73Å; D246-R249 IonicContact OD1-NE 2.88Å; D246-R249 IonicContact OD1-NH1 3.81Å; D246-R249 PolarHBondContact OD1-NH1 3.13Å; R249-K251 VanDerWaalsContact C-N 3.33Å; R249-K251 PolarHBondContact O-N 2.98Å; R249-F262 PolarHBondContact NH2-O 3.19Å
250	E	52.8	Low	56.6	Low	183 Å²	183	117.2 Å²	117.2	86%	0.855	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-18.3	-177.2	-151.4	171.4	-156.3	0	0	113.2	A248	A248-E250 VanDerWaalsContact C-N 3.33Å; A248-E250 PolarHBondContact O-N 3.08Å
251	K	56.6	Low	56.4	Low	190 Å²	190	117.6 Å²	117.6	83%	0.826	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-20.9	-175.6	-69.1	-176.3	179.6	178.5	0	114.9	A248 R249	A248-K251 PolarHBondContact O-N 3.36Å; R249-K251 VanDerWaalsContact C-N 3.33Å; R249-K251 PolarHBondContact O-N 2.98Å
252	E	56.5	Low	56.5	Low	153 Å²	153	119.7 Å²	119.7	72%	0.715	57%	0.568	S	S	*	*	S	Bend	trans	-115.2	90.5	179.7	-80.4	-175.2	150.5	0	0	111.4
253	K	53.6	Low	56.8	Low	183 Å²	183	120.4 Å²	120.4	80%	0.796	57%	0.571	S	S	*	*			trans	43.1	104.1	150.1	-62.5	175.7	-177.3	173.7	0	115.7	T255	K253-T255 HydrophobicContact CB-CG2 4.18Å; K253-T255 PolarHBondContact O-N 3.45Å
254	R	51.2	Low	56.9	Low	262 Å²	262	123.5 Å²	123.5	99%	0.989	59%	0.592	S	S	*	*			trans	-44.5	83.2	149.4	-73.4	176.7	165.6	169.3	-3.9	110.6
255	T	52.5	Low	57.4	Low	95 Å²	95	119 Å²	119	58%	0.583	58%	0.575	S	S	*	*			trans	-94.6	127.5	163.3	68.1	0	0	0	0	106.3	K253 R257	K253-T255 HydrophobicContact CB-CG2 4.18Å; K253-T255 PolarHBondContact O-N 3.45Å; T255-R257 PolarHBondContact O-N 2.88Å
256	T	58.2	Low	57.9	Low	153 Å²	153	123.8 Å²	123.8	94%	0.939	59%	0.591	S	S	*	*	S	Bend	trans	-68.7	14.1	-177.9	49.6	0	0	0	0	113.2
257	R	57.5	Low	58.2	Low	214 Å²	214	125.7 Å²	125.7	81%	0.808	61%	0.608	S	S	*	*	S	Bend	trans	-107.6	126.2	178.1	-77.7	-173.6	173.5	-177	-1.3	109.1	T255 D259	T255-R257 PolarHBondContact O-N 2.88Å; R257-D259 PolarHBondContact O-N 3.3Å; R257-D259 VanDerWaalsContact O-N 3.12Å
258	F	65.4	Low	58.5	Low	126 Å²	126	119.6 Å²	119.6	55%	0.553	59%	0.593	S	S	*	*			trans	-58.6	111.8	166.8	178.3	-93.4	0	0	0	108.8	P260 I263 Y266	F258-P260 HydrophobicContact CE1-CB 3.94Å; F258-I263 HydrophobicContact CE2-CD1 3.7Å; F258-I263 HydrophobicContact CZ-CD1 3.83Å; F258-Y266 AromaticContact CE1-CE1 3.74Å; F258-Y266 HydrophobicContact CE1-CE1 3.74Å; F258-Y266 AromaticContact CE1-CE2 3.91Å; F258-Y266 HydrophobicContact CE1-CE2 3.91Å; F258-Y266 AromaticContact CE1-CZ 3.36Å; F258-Y266 VanDerWaalsContact CE1-OH 3.24Å; F258-Y266 WeakPolarHBondContact CE1-OH 3.49Å; F258-Y266 HydrophobicContact CE2-CE2 4.41Å; F258-Y266 AromaticContact CZ-CD2 3.94Å; F258-Y266 HydrophobicContact CZ-CD2 3.94Å; F258-Y266 AromaticContact CZ-CE1 3.99Å; F258-Y266 HydrophobicContact CZ-CE1 3.99Å; F258-Y266 AromaticContact CZ-CE2 3.35Å; F258-Y266 HydrophobicContact CZ-CE2 3.35Å; F258-Y266 HydrophobicContact CZ-CG 4.48Å; F258-Y266 AromaticContact CZ-CZ 3.34Å; F258-Y266 WeakPolarHBondContact CZ-OH 3.42Å
259	D	62.4	Low	58.6	Low	62 Å²	62	117.5 Å²	117.5	33%	0.332	58%	0.577	S	S	.	*			trans	-105.8	111.9	171.9	178.4	-8.3	0	0	0	109.3	R257 T261 F262	R257-D259 PolarHBondContact O-N 3.3Å; R257-D259 VanDerWaalsContact O-N 3.12Å; D259-T261 PolarHBondContact O-N 3.27Å; D259-T261 VanDerWaalsContact O-N 3.12Å; D259-T261 WeakPolarHBondContact OD1-CB 3.07Å; D259-T261 WeakPolarHBondContact OD1-CG2 3.4Å; D259-T261 PolarHBondContact OD1-N 3.42Å; D259-T261 PolarHBondContact OD1-OG1 3.48Å; D259-T261 PolarHBondContact OD2-OG1 3.35Å; D259-F262 HydrophobicContact CB-CD2 3.49Å; D259-F262 VanDerWaalsContact CB-CD2 3.49Å; D259-F262 HydrophobicContact CB-CE2 3.49Å; D259-F262 VanDerWaalsContact CB-CE2 3.49Å; D259-F262 VanDerWaalsContact CG-CE2 3.44Å; D259-F262 PolarHBondContact O-N 3.27Å; D259-F262 WeakPolarHBondContact OD2-CE2 2.99Å
260	P	64.3	Low	58.9	Low	47 Å²	47	121.3 Å²	121.3	31%	0.305	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-64.2	-13.7	-175.8	26.8	-35.8	0	0	0	113.9	F258 F262 Y266	F258-P260 HydrophobicContact CE1-CB 3.94Å; P260-F262 VanDerWaalsContact C-N 3.29Å; P260-F262 PolarHBondContact O-N 2.82Å; P260-Y266 HydrophobicContact CB-CD1 3.13Å; P260-Y266 HydrophobicContact CB-CE1 3.25Å; P260-Y266 HydrophobicContact CB-CG 4.12Å; P260-Y266 HydrophobicContact CG-CE1 4.48Å; P260-Y266 WeakPolarHBondContact O-CB 3.24Å
261	T	62.1	Low	58.9	Low	97 Å²	97	114.3 Å²	114.3	60%	0.595	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-75.5	-19	-179.2	63.3	0	0	0	0	112.9	D259 I263	D259-T261 PolarHBondContact O-N 3.27Å; D259-T261 VanDerWaalsContact O-N 3.12Å; D259-T261 WeakPolarHBondContact OD1-CB 3.07Å; D259-T261 WeakPolarHBondContact OD1-CG2 3.4Å; D259-T261 PolarHBondContact OD1-N 3.42Å; D259-T261 PolarHBondContact OD1-OG1 3.48Å; D259-T261 PolarHBondContact OD2-OG1 3.35Å; T261-I263 VanDerWaalsContact C-N 3.34Å; T261-I263 PolarHBondContact O-N 3.47Å
262	F	61.6	Low	59	Low	109 Å²	109	112.5 Å²	112.5	48%	0.478	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-85.3	-0.1	-178.3	-64.9	-67.9	0	0	0	115.3	R249 D259 P260	R249-F262 PolarHBondContact NH2-O 3.19Å; D259-F262 HydrophobicContact CB-CD2 3.49Å; D259-F262 VanDerWaalsContact CB-CD2 3.49Å; D259-F262 HydrophobicContact CB-CE2 3.49Å; D259-F262 VanDerWaalsContact CB-CE2 3.49Å; D259-F262 VanDerWaalsContact CG-CE2 3.44Å; D259-F262 PolarHBondContact O-N 3.27Å; D259-F262 WeakPolarHBondContact OD2-CE2 2.99Å; P260-F262 VanDerWaalsContact C-N 3.29Å; P260-F262 PolarHBondContact O-N 2.82Å
263	I	64.3	Low	59.1	Low	66 Å²	66	111.4 Å²	111.4	34%	0.338	57%	0.571	S	S	.	*	S	Bend	trans	-111.4	109.4	177.5	-61.5	171.2	0	0	0	107.3	F258 T261 G265 Y266	F258-I263 HydrophobicContact CE2-CD1 3.7Å; F258-I263 HydrophobicContact CZ-CD1 3.83Å; T261-I263 VanDerWaalsContact C-N 3.34Å; T261-I263 PolarHBondContact O-N 3.47Å; I263-G265 PolarHBondContact O-N 3.48Å; I263-G265 VanDerWaalsContact O-N 3.13Å; I263-Y266 HydrophobicContact CB-CD2 4.35Å; I263-Y266 HydrophobicContact CB-CG 4.31Å; I263-Y266 HydrophobicContact CD1-CD2 3.91Å; I263-Y266 HydrophobicContact CD1-CE2 4.47Å; I263-Y266 HydrophobicContact CG2-CD2 4.35Å; I263-Y266 WeakPolarHBondContact O-CB 3.35Å; I263-Y266 PolarHBondContact O-N 2.97Å
264	P	59.7	Low	59.6	Low	92 Å²	92	109.9 Å²	109.9	60%	0.597	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.8	121.9	172.5	-24.6	33.7	0	0	0	109.6
265	G	60.3	Low	60.6	Low	22 Å²	22	99.1 Å²	99.1	23%	0.227	54%	0.537	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	-3.7	-177	0	0	0	0	0	115.8	I263 T268 G269	I263-G265 PolarHBondContact O-N 3.48Å; I263-G265 VanDerWaalsContact O-N 3.13Å; G265-T268 VanDerWaalsContact CA-OG1 3.23Å; G265-T268 WeakPolarHBondContact CA-OG1 3.5Å; G265-G269 CarbonylContact O-C 3.01Å; G265-G269 WeakPolarHBondContact O-CA 3.4Å; G265-G269 PolarHBondContact O-N 3.13Å
266	Y	64.8	Low	62	Low	125 Å²	125	102.9 Å²	102.9	49%	0.49	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-42.4	-177.4	-168.3	-73.3	0	0	0	113	F258 P260 I263 T268	F258-Y266 AromaticContact CE1-CE1 3.74Å; F258-Y266 HydrophobicContact CE1-CE1 3.74Å; F258-Y266 AromaticContact CE1-CE2 3.91Å; F258-Y266 HydrophobicContact CE1-CE2 3.91Å; F258-Y266 AromaticContact CE1-CZ 3.36Å; F258-Y266 VanDerWaalsContact CE1-OH 3.24Å; F258-Y266 WeakPolarHBondContact CE1-OH 3.49Å; F258-Y266 HydrophobicContact CE2-CE2 4.41Å; F258-Y266 AromaticContact CZ-CD2 3.94Å; F258-Y266 HydrophobicContact CZ-CD2 3.94Å; F258-Y266 AromaticContact CZ-CE1 3.99Å; F258-Y266 HydrophobicContact CZ-CE1 3.99Å; F258-Y266 AromaticContact CZ-CE2 3.35Å; F258-Y266 HydrophobicContact CZ-CE2 3.35Å; F258-Y266 HydrophobicContact CZ-CG 4.48Å; F258-Y266 AromaticContact CZ-CZ 3.34Å; F258-Y266 WeakPolarHBondContact CZ-OH 3.42Å; P260-Y266 HydrophobicContact CB-CD1 3.13Å; P260-Y266 HydrophobicContact CB-CE1 3.25Å; P260-Y266 HydrophobicContact CB-CG 4.12Å; P260-Y266 HydrophobicContact CG-CE1 4.48Å; P260-Y266 WeakPolarHBondContact O-CB 3.24Å; I263-Y266 HydrophobicContact CB-CD2 4.35Å; I263-Y266 HydrophobicContact CB-CG 4.31Å; I263-Y266 HydrophobicContact CD1-CD2 3.91Å; I263-Y266 HydrophobicContact CD1-CE2 4.47Å; I263-Y266 HydrophobicContact CG2-CD2 4.35Å; I263-Y266 WeakPolarHBondContact O-CB 3.35Å; I263-Y266 PolarHBondContact O-N 2.97Å; Y266-T268 VanDerWaalsContact C-N 3.29Å
267	S	59.9	Low	62.9	Low	97 Å²	97	102.8 Å²	102.8	68%	0.678	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-27.5	174.2	60.1	0	0	0	0	112.6
268	T	59.1	Low	63.8	Low	61 Å²	61	94.7 Å²	94.7	37%	0.374	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-58.2	173.1	48.4	0	0	0	0	109.2	G265 Y266 R282	G265-T268 VanDerWaalsContact CA-OG1 3.23Å; G265-T268 WeakPolarHBondContact CA-OG1 3.5Å; Y266-T268 VanDerWaalsContact C-N 3.29Å; T268-R282 PolarHBondContact O-NE 3.47Å; T268-R282 PolarHBondContact O-NH1 3.12Å; T268-R282 PolarHBondContact O-NH2 3.31Å
269	G	55.8	Low	64.3	Low	23 Å²	23	91.8 Å²	91.8	24%	0.237	51%	0.508	C	S	.	.			trans	129.2	163.5	-175.5	0	0	0	0	0	109.3	G265 S271	G265-G269 CarbonylContact O-C 3.01Å; G265-G269 WeakPolarHBondContact O-CA 3.4Å; G265-G269 PolarHBondContact O-N 3.13Å; G269-S271 CarbonylContact O-C 3.43Å; G269-S271 PolarHBondContact O-N 2.93Å
270	L	57.4	Low	65.4	Low	188 Å²	188	94 Å²	94	98%	0.984	52%	0.517	S	S	*	.	S	Bend	trans	-54.6	-13.3	-175.3	-67.4	169.8	0	0	0	114.9
271	S	54.2	Low	66.3	Low	35 Å²	35	96.9 Å²	96.9	25%	0.245	53%	0.529	C	S	.	.			trans	-86.3	104.1	167.7	48.6	0	0	0	0	111.7	G269 I273 N278 R282	G269-S271 CarbonylContact O-C 3.43Å; G269-S271 PolarHBondContact O-N 2.93Å; S271-I273 PolarHBondContact O-N 2.86Å; S271-N278 WeakPolarHBondContact CB-ND2 3.44Å; S271-N278 PolarHBondContact OG-ND2 3.05Å; S271-N278 VanDerWaalsContact OG-ND2 3.13Å; S271-R282 PolarHBondContact O-NH2 3.4Å; S271-R282 PolarHBondContact OG-NH2 2.7Å
272	I	57.3	Low	67.1	Low	153 Å²	153	95.2 Å²	95.2	79%	0.785	51%	0.512	S	S	*	.			trans	-65.6	-20.7	167.4	-58.4	170.6	0	0	0	110.7	N274	I272-N274 PolarHBondContact O-N 3.01Å
273	I	60.5	Low	68.1	Low	129 Å²	129	91.6 Å²	91.6	66%	0.662	51%	0.505	S	S	*	.	S	Bend	trans	-81.9	113.4	-179.4	-50.7	174.3	0	0	0	109.7	S271 S275 N278	S271-I273 PolarHBondContact O-N 2.86Å; I273-S275 PolarHBondContact O-N 2.94Å; I273-N278 PolarHBondContact O-ND2 3.28Å; I273-N278 VanDerWaalsContact O-ND2 3.09Å
274	N	63.2	Low	69.1	Low	151 Å²	151	96 Å²	96	81%	0.807	52%	0.518	S	S	*	.			trans	-68.3	78.6	167.4	-72.9	-27.4	0	0	0	109.7	I272	I272-N274 PolarHBondContact O-N 3.01Å
275	S	73.1	Confident	70.4	Confident	36 Å²	36	95.7 Å²	95.7	25%	0.252	51%	0.51	S	S	.	.			trans	-96.8	148.3	169.3	79.9	0	0	0	0	110.5	I273 Q277 N278 A279	I273-S275 PolarHBondContact O-N 2.94Å; S275-Q277 PolarHBondContact O-N 2.9Å; S275-N278 WeakPolarHBondContact O-CB 3.16Å; S275-N278 PolarHBondContact O-N 2.97Å; S275-N278 VanDerWaalsContact O-N 3.08Å; S275-N278 WeakPolarHBondContact OG-CB 3.23Å; S275-N278 VanDerWaalsContact OG-CG 3.23Å; S275-N278 PolarHBondContact OG-N 3.33Å; S275-N278 PolarHBondContact OG-ND2 2.89Å; S275-N278 VanDerWaalsContact OG-ND2 3.12Å; S275-A279 PolarHBondContact O-N 3.15Å; S275-A279 VanDerWaalsContact O-N 3.1Å
276	E	80.3	Confident	71.4	Confident	175 Å²	175	101.6 Å²	101.6	82%	0.818	53%	0.53	S	S	*	.	H	α-helix	trans	-55.7	-41.2	175.7	-175.4	175.5	-169.4	0	0	111.8	N278 A279 E280	E276-N278 VanDerWaalsContact C-N 3.32Å; E276-N278 PolarHBondContact O-N 3.38Å; E276-A279 WeakPolarHBondContact O-CB 3.37Å; E276-A279 PolarHBondContact O-N 3.49Å; E276-A279 VanDerWaalsContact O-N 3.12Å; E276-E280 PolarHBondContact O-N 3.36Å
277	Q	78.7	Confident	72.3	Confident	151 Å²	151	98.8 Å²	98.8	71%	0.706	53%	0.528	S	S	*	.	H	α-helix	trans	-58.2	-42.3	175.6	-65.8	177.9	-13.1	0	0	112.3	S275 E280 L281	S275-Q277 PolarHBondContact O-N 2.9Å; Q277-E280 PolarHBondContact O-N 3.1Å; Q277-L281 WeakPolarHBondContact O-CB 3.42Å; Q277-L281 PolarHBondContact O-N 2.93Å
278	N	75.3	Confident	73.5	Confident	44 Å²	44	99.6 Å²	99.6	24%	0.235	52%	0.524	C	S	.	.	H	α-helix	trans	-68.6	-35.4	177.9	-73.4	-29.2	0	0	0	111.8	S271 I273 S275 E276 R282	S271-N278 WeakPolarHBondContact CB-ND2 3.44Å; S271-N278 PolarHBondContact OG-ND2 3.05Å; S271-N278 VanDerWaalsContact OG-ND2 3.13Å; I273-N278 PolarHBondContact O-ND2 3.28Å; I273-N278 VanDerWaalsContact O-ND2 3.09Å; S275-N278 WeakPolarHBondContact O-CB 3.16Å; S275-N278 PolarHBondContact O-N 2.97Å; S275-N278 VanDerWaalsContact O-N 3.08Å; S275-N278 WeakPolarHBondContact OG-CB 3.23Å; S275-N278 VanDerWaalsContact OG-CG 3.23Å; S275-N278 PolarHBondContact OG-N 3.33Å; S275-N278 PolarHBondContact OG-ND2 2.89Å; S275-N278 VanDerWaalsContact OG-ND2 3.12Å; E276-N278 VanDerWaalsContact C-N 3.32Å; E276-N278 PolarHBondContact O-N 3.38Å; N278-R282 WeakPolarHBondContact O-CB 3.33Å; N278-R282 WeakPolarHBondContact O-CD 3.49Å; N278-R282 WeakPolarHBondContact O-CG 3.44Å; N278-R282 PolarHBondContact O-N 3.12Å
279	A	76.6	Confident	74.6	Confident	64 Å²	64	101.8 Å²	101.8	53%	0.529	53%	0.533	S	S	.	.	H	α-helix	trans	-66.4	-43.8	175.2	0	0	0	0	0	111.6	S275 E276 R282 G283	S275-A279 PolarHBondContact O-N 3.15Å; S275-A279 VanDerWaalsContact O-N 3.1Å; E276-A279 WeakPolarHBondContact O-CB 3.37Å; E276-A279 PolarHBondContact O-N 3.49Å; E276-A279 VanDerWaalsContact O-N 3.12Å; A279-R282 PolarHBondContact O-N 3.05Å; A279-G283 PolarHBondContact O-N 2.96Å
280	E	84.9	Confident	75.7	Confident	109 Å²	109	106 Å²	106	51%	0.509	55%	0.55	S	S	.	.	H	α-helix	trans	-60.2	-48	174.8	-167.6	-158.1	141.2	0	0	111.1	E276 Q277 R282 G283 R284	E276-E280 PolarHBondContact O-N 3.36Å; Q277-E280 PolarHBondContact O-N 3.1Å; E280-R282 VanDerWaalsContact C-N 3.31Å; E280-R282 PolarHBondContact O-N 3.27Å; E280-G283 WeakPolarHBondContact O-CA 3.35Å; E280-G283 PolarHBondContact O-N 2.93Å; E280-R284 WeakPolarHBondContact O-CG 3.46Å; E280-R284 PolarHBondContact O-N 2.69Å; E280-R284 WeakPolarHBondContact OE1-CD 3.37Å; E280-R284 IonicContact OE1-CZ 3.92Å; E280-R284 IonicContact OE1-NH1 2.68Å; E280-R284 PolarHBondContact OE1-NH1 3.31Å
281	L	83.4	Confident	76.5	Confident	108 Å²	108	106.4 Å²	106.4	57%	0.565	54%	0.538	S	S	*	.	H	α-helix	trans	-60.2	-42.2	-179.6	-145.8	113.7	0	0	0	111.4	Q277 G283 R284 I285	Q277-L281 WeakPolarHBondContact O-CB 3.42Å; Q277-L281 PolarHBondContact O-N 2.93Å; L281-G283 VanDerWaalsContact C-N 3.35Å; L281-G283 PolarHBondContact O-N 2.88Å; L281-R284 PolarHBondContact O-N 2.9Å; L281-I285 HydrophobicContact CD2-CD1 3.98Å; L281-I285 WeakPolarHBondContact O-CG1 3.43Å; L281-I285 PolarHBondContact O-N 2.93Å
282	R	79.1	Confident	77.1	Confident	62 Å²	62	108.8 Å²	108.8	23%	0.234	55%	0.552	C	S	.	*	H	α-helix	trans	-62.6	-40.2	174	-71.9	169.2	-164.7	-159.2	1.2	111.9	T268 S271 N278 A279 E280 K286	T268-R282 PolarHBondContact O-NE 3.47Å; T268-R282 PolarHBondContact O-NH1 3.12Å; T268-R282 PolarHBondContact O-NH2 3.31Å; S271-R282 PolarHBondContact O-NH2 3.4Å; S271-R282 PolarHBondContact OG-NH2 2.7Å; N278-R282 WeakPolarHBondContact O-CB 3.33Å; N278-R282 WeakPolarHBondContact O-CD 3.49Å; N278-R282 WeakPolarHBondContact O-CG 3.44Å; N278-R282 PolarHBondContact O-N 3.12Å; A279-R282 PolarHBondContact O-N 3.05Å; E280-R282 VanDerWaalsContact C-N 3.31Å; E280-R282 PolarHBondContact O-N 3.27Å; R282-K286 WeakPolarHBondContact O-CB 3.44Å; R282-K286 WeakPolarHBondContact O-CG 3.42Å; R282-K286 PolarHBondContact O-N 3.39Å
283	G	82.9	Confident	77.3	Confident	33 Å²	33	110 Å²	110	34%	0.34	55%	0.551	S	S	.	*	H	α-helix	trans	-61.9	-42.2	174.2	0	0	0	0	0	112.8	A279 E280 L281 K286 S287	A279-G283 PolarHBondContact O-N 2.96Å; E280-G283 WeakPolarHBondContact O-CA 3.35Å; E280-G283 PolarHBondContact O-N 2.93Å; L281-G283 VanDerWaalsContact C-N 3.35Å; L281-G283 PolarHBondContact O-N 2.88Å; G283-K286 PolarHBondContact O-N 3.22Å; G283-S287 WeakPolarHBondContact O-CB 3.47Å; G283-S287 PolarHBondContact O-N 3.49Å; G283-S287 PolarHBondContact O-OG 3.5Å
284	R	85.6	Confident	77.2	Confident	157 Å²	157	114.9 Å²	114.9	59%	0.592	56%	0.561	S	S	*	*	H	α-helix	trans	-66.9	-44.5	177.5	-68.2	172.3	88.1	160.7	0.7	111.7	E280 L281 S287 L288	E280-R284 WeakPolarHBondContact O-CG 3.46Å; E280-R284 PolarHBondContact O-N 2.69Å; E280-R284 WeakPolarHBondContact OE1-CD 3.37Å; E280-R284 IonicContact OE1-CZ 3.92Å; E280-R284 IonicContact OE1-NH1 2.68Å; E280-R284 PolarHBondContact OE1-NH1 3.31Å; L281-R284 PolarHBondContact O-N 2.9Å; R284-S287 PolarHBondContact O-N 3.12Å; R284-L288 WeakPolarHBondContact O-CB 3.21Å; R284-L288 PolarHBondContact O-N 3.49Å
285	I	84.9	Confident	76.9	Confident	87 Å²	87	112.5 Å²	112.5	45%	0.446	56%	0.556	S	S	.	*	H	α-helix	trans	-60.8	-46.6	175.1	-68.7	167.1	0	0	0	110.7	L281 S287 L288 L289	L281-I285 HydrophobicContact CD2-CD1 3.98Å; L281-I285 WeakPolarHBondContact O-CG1 3.43Å; L281-I285 PolarHBondContact O-N 2.93Å; I285-S287 VanDerWaalsContact C-N 3.31Å; I285-S287 PolarHBondContact O-N 2.66Å; I285-L288 PolarHBondContact O-N 2.94Å; I285-L289 HydrophobicContact CG2-CD1 3.9Å; I285-L289 HydrophobicContact CG2-CG 4.39Å; I285-L289 WeakPolarHBondContact O-CG 3.41Å; I285-L289 PolarHBondContact O-N 3.16Å
286	K	82.8	Confident	75.6	Confident	145 Å²	145	117 Å²	117	63%	0.63	61%	0.609	S	S	*	*	H	α-helix	trans	-58.2	-43.3	175	-77.5	179.4	179.3	-178.2	0	111.8	R282 G283 L289 L290	R282-K286 WeakPolarHBondContact O-CB 3.44Å; R282-K286 WeakPolarHBondContact O-CG 3.42Å; R282-K286 PolarHBondContact O-N 3.39Å; G283-K286 PolarHBondContact O-N 3.22Å; K286-L289 PolarHBondContact O-N 3.31Å; K286-L290 WeakPolarHBondContact O-CB 3.42Å; K286-L290 VanDerWaalsContact O-CG 3.27Å; K286-L290 WeakPolarHBondContact O-CG 3.34Å; K286-L290 PolarHBondContact O-N 3.47Å
287	S	84	Confident	75.4	Confident	67 Å²	67	114.1 Å²	114.1	47%	0.469	60%	0.598	S	S	.	*	H	α-helix	trans	-65.5	-39.7	178.6	-59.2	0	0	0	0	112.5	G283 R284 I285 L290 R291	G283-S287 WeakPolarHBondContact O-CB 3.47Å; G283-S287 PolarHBondContact O-N 3.49Å; G283-S287 PolarHBondContact O-OG 3.5Å; R284-S287 PolarHBondContact O-N 3.12Å; I285-S287 VanDerWaalsContact C-N 3.31Å; I285-S287 PolarHBondContact O-N 2.66Å; S287-L290 PolarHBondContact O-N 3.47Å; S287-R291 WeakPolarHBondContact O-CG 3.27Å; S287-R291 PolarHBondContact O-N 3.13Å
288	L	84.9	Confident	75.2	Confident	113 Å²	113	112.2 Å²	112.2	59%	0.592	59%	0.592	S	S	*	*	H	α-helix	trans	-62.1	-50.4	174	-90.4	151	0	0	0	111.5	R284 I285 L290 R291 T292	R284-L288 WeakPolarHBondContact O-CB 3.21Å; R284-L288 PolarHBondContact O-N 3.49Å; I285-L288 PolarHBondContact O-N 2.94Å; L288-L290 VanDerWaalsContact C-N 3.29Å; L288-L290 PolarHBondContact O-N 2.97Å; L288-R291 PolarHBondContact O-N 2.97Å; L288-R291 VanDerWaalsContact O-N 3.13Å; L288-T292 PolarHBondContact O-N 2.83Å; L288-T292 PolarHBondContact O-OG1 3.49Å
289	L	82.3	Confident	75.2	Confident	107 Å²	107	115.9 Å²	115.9	56%	0.56	61%	0.612	S	S	*	*	H	α-helix	trans	-61.5	-36.3	178.6	-71.3	171.2	0	0	0	112.6	I285 K286 T292 K293	I285-L289 HydrophobicContact CG2-CD1 3.9Å; I285-L289 HydrophobicContact CG2-CG 4.39Å; I285-L289 WeakPolarHBondContact O-CG 3.41Å; I285-L289 PolarHBondContact O-N 3.16Å; K286-L289 PolarHBondContact O-N 3.31Å; L289-T292 WeakPolarHBondContact CA-OG1 3.48Å; L289-T292 PolarHBondContact O-OG1 2.97Å; L289-K293 PolarHBondContact O-N 2.93Å; L289-K293 VanDerWaalsContact O-N 3.16Å
290	L	78.7	Confident	75.1	Confident	112 Å²	112	119 Å²	119	59%	0.586	62%	0.617	S	S	*	*	H	α-helix	trans	-72.5	-33.3	175.3	-72.5	169	0	0	0	112.6	K286 S287 L288 R294	K286-L290 WeakPolarHBondContact O-CB 3.42Å; K286-L290 VanDerWaalsContact O-CG 3.27Å; K286-L290 WeakPolarHBondContact O-CG 3.34Å; K286-L290 PolarHBondContact O-N 3.47Å; S287-L290 PolarHBondContact O-N 3.47Å; L288-L290 VanDerWaalsContact C-N 3.29Å; L288-L290 PolarHBondContact O-N 2.97Å; L290-R294 PolarHBondContact O-N 3.44Å
291	R	74	Confident	74.5	Confident	196 Å²	196	119.6 Å²	119.6	74%	0.74	62%	0.624	S	S	*	*	H	α-helix	trans	-66.9	-45.8	172.7	-82.2	-177.5	180	-169	0.1	111.5	S287 L288 K293 R294 S295	S287-R291 WeakPolarHBondContact O-CG 3.27Å; S287-R291 PolarHBondContact O-N 3.13Å; L288-R291 PolarHBondContact O-N 2.97Å; L288-R291 VanDerWaalsContact O-N 3.13Å; R291-K293 PolarHBondContact O-N 3.44Å; R291-R294 PolarHBondContact O-N 3.4Å; R291-S295 PolarHBondContact O-N 3.28Å; R291-S295 PolarHBondContact O-OG 3.04Å
292	T	65.9	Low	73.9	Confident	86 Å²	86	120.4 Å²	120.4	53%	0.528	63%	0.628	S	S	.	*	H	α-helix	trans	-64.2	-28.6	177.9	47.9	0	0	0	0	112.9	L288 L289 R294 S295	L288-T292 PolarHBondContact O-N 2.83Å; L288-T292 PolarHBondContact O-OG1 3.49Å; L289-T292 WeakPolarHBondContact CA-OG1 3.48Å; L289-T292 PolarHBondContact O-OG1 2.97Å; T292-R294 VanDerWaalsContact C-N 3.33Å; T292-S295 PolarHBondContact O-OG 3.36Å
293	K	61.6	Low	73.6	Confident	178 Å²	178	124.6 Å²	124.6	77%	0.774	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-16.7	173.2	-95.6	-168.2	170.9	-172.6	0	114.6	L289 R291	L289-K293 PolarHBondContact O-N 2.93Å; L289-K293 VanDerWaalsContact O-N 3.16Å; R291-K293 PolarHBondContact O-N 3.44Å
294	R	59	Low	72.8	Confident	232 Å²	232	131.6 Å²	131.6	88%	0.875	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-11.9	176.7	-74.2	-174.3	177.7	-161.9	-0.2	113.1	L290 R291 T292	L290-R294 PolarHBondContact O-N 3.44Å; R291-R294 PolarHBondContact O-N 3.4Å; T292-R294 VanDerWaalsContact C-N 3.33Å
295	S	57.3	Low	71.8	Confident	100 Å²	100	129.5 Å²	129.5	70%	0.699	69%	0.687	S	S	*	*			trans	-109.7	18.5	-176.4	69.4	0	0	0	0	113.7	R291 T292	R291-S295 PolarHBondContact O-N 3.28Å; R291-S295 PolarHBondContact O-OG 3.04Å; T292-S295 PolarHBondContact O-OG 3.36Å
296	G	46	Very low	70.6	Confident	131 Å²	131	133.4 Å²	133.4	100%	1.351	71%	0.709	S	S	*	*			trans	-132.5	0	178.7	0	0	0	0	0	111.5

Retrieved 296 of 296 residues in 125.2 ms (Link to these results)

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