A0A3Q0KIS6_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KIS6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 266 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	41.5	Very low	41.2	Very low	247 Å²	247	176.9 Å²	176.9	100%	1.217	85%	0.846	S	S	*	*				0	125.9	0	-85.8	176.2	162.1	0	0	108.1
2	R	39.8	Very low	41.4	Very low	217 Å²	217	178.9 Å²	178.9	82%	0.819	84%	0.841	S	S	*	*			trans	-50.2	148.6	169.3	-88.5	-177.1	-175.1	-179.5	1.3	112.2
3	R	38.1	Very low	42.2	Very low	241 Å²	241	172.2 Å²	172.2	91%	0.909	81%	0.813	S	S	*	*			trans	-174.1	105.2	135	-76.8	-156	-114.7	-149	0.2	104.8
4	E	37	Very low	43	Very low	153 Å²	153	166.4 Å²	166.4	72%	0.715	80%	0.797	S	S	*	*				32.2	114.1	70.8	-80.2	176.1	-160.1	0	0	110.2
5	S	43.8	Very low	43.7	Very low	96 Å²	96	158.1 Å²	158.1	67%	0.671	77%	0.773	S	S	*	*			cis	-168.9	163.4	36.5	-37.9	0	0	0	0	106.1
6	D	40.2	Very low	44.8	Very low	162 Å²	162	156 Å²	156	87%	0.866	76%	0.761	S	S	*	*			trans	177.7	95.6	130	-81.6	-18.2	0	0	0	108.5	E8	D6-E8 PolarHBondContact O-N 3.21Å
7	H	39	Very low	45.7	Very low	202 Å²	202	153.4 Å²	153.4	94%	0.935	75%	0.75	S	S	*	*			trans	-70.4	104.8	165.6	-85.3	-54.6	0	0	0	108.6
8	E	39.5	Very low	46.4	Very low	186 Å²	186	153.2 Å²	153.2	87%	0.869	75%	0.745	S	S	*	*			trans	-108.6	103.8	165.7	-136.7	166.7	-170.3	0	0	109.8	D6	D6-E8 PolarHBondContact O-N 3.21Å
9	N	35.5	Very low	47.3	Very low	138 Å²	138	150.3 Å²	150.3	74%	0.738	73%	0.733	S	S	*	*			trans	-56.2	117.5	179.5	-174.2	3.7	0	0	0	110.3	K11	N9-K11 PolarHBondContact O-N 3.29Å
10	P	47.6	Very low	48	Very low	114 Å²	114	150.1 Å²	150.1	74%	0.74	73%	0.728	S	S	*	*			trans	-67.9	100	179.6	25.7	-30.9	0	0	0	109.4	Y12	P10-Y12 PolarHBondContact O-N 2.75Å
11	K	50.9	Low	48.4	Very low	190 Å²	190	149.4 Å²	149.4	83%	0.826	72%	0.722	S	S	*	*			trans	-52.2	111.1	169.7	-76.3	173.8	178.5	169.5	0	108.9	N9 I13	N9-K11 PolarHBondContact O-N 3.29Å; K11-I13 PolarHBondContact O-N 3.2Å
12	Y	43.6	Very low	49.2	Very low	201 Å²	201	143.3 Å²	143.3	79%	0.788	69%	0.689	S	S	*	*			trans	-61.7	110.2	173.2	-170	-102.9	0	0	0	109.3	P10 P14	P10-Y12 PolarHBondContact O-N 2.75Å; Y12-P14 HydrophobicContact CD1-CG 3.74Å; Y12-P14 HydrophobicContact CE1-CB 4.27Å; Y12-P14 HydrophobicContact CE1-CG 3.75Å; Y12-P14 WeakPolarHBondContact O-CD 3.24Å
13	I	52.7	Low	50.2	Low	92 Å²	92	138.5 Å²	138.5	47%	0.472	68%	0.679	S	S	.	*			trans	-106.7	98.5	174.6	-56.4	173.1	0	0	0	107.3	K11 G15 E16	K11-I13 PolarHBondContact O-N 3.2Å; I13-G15 PolarHBondContact O-N 2.9Å; I13-G15 VanDerWaalsContact O-N 3.13Å; I13-E16 HydrophobicContact CG2-CB 4.34Å; I13-E16 HydrophobicContact CG2-CG 4.12Å
14	P	52.5	Low	51.2	Low	91 Å²	91	133.5 Å²	133.5	59%	0.591	67%	0.67	S	S	*	*	H	α-helix	trans	-69.4	-10.1	-173	-15.2	28.4	0	0	0	114.6	Y12	Y12-P14 HydrophobicContact CD1-CG 3.74Å; Y12-P14 HydrophobicContact CE1-CB 4.27Å; Y12-P14 HydrophobicContact CE1-CG 3.75Å; Y12-P14 WeakPolarHBondContact O-CD 3.24Å
15	G	54.4	Low	52.3	Low	42 Å²	42	132.1 Å²	132.1	43%	0.433	67%	0.667	S	S	.	*	H	α-helix	trans	-91.4	-35	-177.7	0	0	0	0	0	114.9	I13 F18 N19	I13-G15 PolarHBondContact O-N 2.9Å; I13-G15 VanDerWaalsContact O-N 3.13Å; G15-F18 PolarHBondContact O-N 2.96Å; G15-N19 PolarHBondContact O-N 3.23Å; G15-N19 VanDerWaalsContact O-N 3.13Å
16	E	61.4	Low	53	Low	124 Å²	124	133.4 Å²	133.4	58%	0.579	67%	0.666	S	S	*	*	H	α-helix	trans	-71.2	-36.6	-178.2	-79.9	-168.2	167.8	0	0	112.2	I13 F18 N19 K20	I13-E16 HydrophobicContact CG2-CB 4.34Å; I13-E16 HydrophobicContact CG2-CG 4.12Å; E16-F18 VanDerWaalsContact C-N 3.34Å; E16-N19 PolarHBondContact O-N 2.92Å; E16-K20 WeakPolarHBondContact O-CB 3.46Å; E16-K20 PolarHBondContact O-N 3.45Å
17	L	58.6	Low	54	Low	111 Å²	111	127.4 Å²	127.4	58%	0.581	64%	0.636	S	S	*	*	H	α-helix	trans	-64.6	-40.5	175.8	-79.8	170.1	0	0	0	111.3	K20 F21	L17-K20 PolarHBondContact O-N 2.74Å; L17-F21 WeakPolarHBondContact O-CB 3.46Å; L17-F21 PolarHBondContact O-N 3.48Å
18	F	58.8	Low	55.4	Low	150 Å²	150	120.6 Å²	120.6	66%	0.658	61%	0.611	S	S	*	*	H	α-helix	trans	-67.6	-41	179.2	-161.8	-94.3	0	0	0	112	G15 E16 F21 K22	G15-F18 PolarHBondContact O-N 2.96Å; E16-F18 VanDerWaalsContact C-N 3.34Å; F18-F21 PolarHBondContact O-N 3.47Å; F18-K22 WeakPolarHBondContact O-CB 3.45Å; F18-K22 PolarHBondContact O-N 3.47Å
19	N	63.5	Low	56.9	Low	98 Å²	98	118 Å²	118	52%	0.524	60%	0.603	S	S	.	*	H	α-helix	trans	-68.7	-38	174.1	-82.2	-19	0	0	0	112.6	G15 E16 F21 K22 N23	G15-N19 PolarHBondContact O-N 3.23Å; G15-N19 VanDerWaalsContact O-N 3.13Å; E16-N19 PolarHBondContact O-N 2.92Å; N19-F21 VanDerWaalsContact C-N 3.33Å; N19-K22 PolarHBondContact O-N 2.77Å; N19-N23 WeakPolarHBondContact O-CB 3.36Å; N19-N23 PolarHBondContact O-N 3.46Å; N19-N23 PolarHBondContact O-ND2 2.89Å
20	K	61.5	Low	58.8	Low	146 Å²	146	117.2 Å²	117.2	64%	0.635	60%	0.599	S	S	*	*	H	α-helix	trans	-60.6	-44	169.6	-88.7	-178.2	174.8	175.1	0	111.2	E16 L17 L24	E16-K20 WeakPolarHBondContact O-CB 3.46Å; E16-K20 PolarHBondContact O-N 3.45Å; L17-K20 PolarHBondContact O-N 2.74Å; K20-L24 WeakPolarHBondContact O-CB 3.36Å; K20-L24 PolarHBondContact O-N 2.86Å
21	F	56.9	Low	60.2	Low	136 Å²	136	116.7 Å²	116.7	60%	0.596	59%	0.587	S	S	*	*	H	α-helix	trans	-63.5	-42.9	178	-124.2	-89.7	0	0	0	111.8	L17 F18 N19 L24 L25	L17-F21 WeakPolarHBondContact O-CB 3.46Å; L17-F21 PolarHBondContact O-N 3.48Å; F18-F21 PolarHBondContact O-N 3.47Å; N19-F21 VanDerWaalsContact C-N 3.33Å; F21-L24 CarbonylContact O-C 3.59Å; F21-L24 WeakPolarHBondContact O-CB 3.44Å; F21-L24 PolarHBondContact O-N 3.34Å; F21-L24 VanDerWaalsContact O-N 3.16Å; F21-L25 HydrophobicContact CD1-CD1 3.6Å; F21-L25 HydrophobicContact CE1-CD1 4.05Å; F21-L25 VanDerWaalsContact O-CD1 3.3Å; F21-L25 WeakPolarHBondContact O-CD1 3.41Å; F21-L25 PolarHBondContact O-N 3.49Å
22	K	58.3	Low	61.3	Low	120 Å²	120	110.5 Å²	110.5	52%	0.522	56%	0.562	S	S	.	*	H	α-helix	trans	-66.4	-44.5	178.6	-169.7	175.8	-179.8	177.7	0	112	F18 N19 L24 L25 D26	F18-K22 WeakPolarHBondContact O-CB 3.45Å; F18-K22 PolarHBondContact O-N 3.47Å; N19-K22 PolarHBondContact O-N 2.77Å; K22-L24 PolarHBondContact O-N 3.22Å; K22-L25 PolarHBondContact O-N 3.31Å; K22-L25 VanDerWaalsContact O-N 3.11Å; K22-D26 PolarHBondContact O-N 2.76Å
23	N	61.5	Low	63.1	Low	115 Å²	115	107.9 Å²	107.9	62%	0.615	56%	0.555	S	S	*	*	H	α-helix	trans	-65.6	-23.8	173.4	-66.9	-9.5	0	0	0	112.2	N19	N19-N23 WeakPolarHBondContact O-CB 3.36Å; N19-N23 PolarHBondContact O-N 3.46Å; N19-N23 PolarHBondContact O-ND2 2.89Å
24	L	58.5	Low	64.6	Low	136 Å²	136	106.5 Å²	106.5	71%	0.712	55%	0.551	S	S	*	*	H	α-helix	trans	-78.2	-30	172.6	-143.6	90.7	0	0	0	112.8	K20 F21 K22	K20-L24 WeakPolarHBondContact O-CB 3.36Å; K20-L24 PolarHBondContact O-N 2.86Å; F21-L24 CarbonylContact O-C 3.59Å; F21-L24 WeakPolarHBondContact O-CB 3.44Å; F21-L24 PolarHBondContact O-N 3.34Å; F21-L24 VanDerWaalsContact O-N 3.16Å; K22-L24 PolarHBondContact O-N 3.22Å
25	L	59.3	Low	65.9	Low	124 Å²	124	107 Å²	107	65%	0.649	55%	0.547	S	S	*	.	H	α-helix	trans	-85.5	-29.8	179.1	-98.4	96.4	0	0	0	113.7	F21 K22 P27	F21-L25 HydrophobicContact CD1-CD1 3.6Å; F21-L25 HydrophobicContact CE1-CD1 4.05Å; F21-L25 VanDerWaalsContact O-CD1 3.3Å; F21-L25 WeakPolarHBondContact O-CD1 3.41Å; F21-L25 PolarHBondContact O-N 3.49Å; K22-L25 PolarHBondContact O-N 3.31Å; K22-L25 VanDerWaalsContact O-N 3.11Å; L25-P27 WeakPolarHBondContact O-CD 3.33Å
26	D	59.2	Low	67.3	Low	124 Å²	124	112.6 Å²	112.6	66%	0.663	56%	0.557	S	S	*	*	S	Bend	trans	-110.6	62.1	171.9	-78	-33.9	0	0	0	110.4	K22 S28	K22-D26 PolarHBondContact O-N 2.76Å; D26-S28 PolarHBondContact O-N 3.48Å
27	P	61.8	Low	68.5	Low	36 Å²	36	113.1 Å²	113.1	23%	0.234	55%	0.553	C	S	.	*			trans	-57.4	135.8	171.9	25.3	-31.8	0	0	0	108.7	L25 E31 L32	L25-P27 WeakPolarHBondContact O-CD 3.33Å; P27-E31 HydrophobicContact CB-CB 4.23Å; P27-L32 HydrophobicContact CB-CG 4.2Å; P27-L32 HydrophobicContact CG-CD1 3.77Å; P27-L32 HydrophobicContact CG-CD2 4.3Å; P27-L32 HydrophobicContact CG-CG 3.67Å
28	S	67.7	Low	69.9	Low	59 Å²	59	111.9 Å²	111.9	41%	0.413	55%	0.547	S	S	.	.			trans	-57.1	147.7	177.7	66.2	0	0	0	0	109.9	D26 N30 E31 L32	D26-S28 PolarHBondContact O-N 3.48Å; S28-N30 PolarHBondContact O-N 3.3Å; S28-E31 PolarHBondContact N-OE2 2.91Å; S28-E31 WeakPolarHBondContact O-CA 3.41Å; S28-E31 WeakPolarHBondContact O-CB 3.34Å; S28-E31 PolarHBondContact O-N 3.35Å; S28-E31 WeakPolarHBondContact OG-CG 3.17Å; S28-E31 PolarHBondContact OG-N 3.18Å; S28-E31 PolarHBondContact OG-OE2 2.85Å; S28-L32 PolarHBondContact O-N 2.83Å
29	D	71.5	Confident	71.3	Confident	131 Å²	131	107.2 Å²	107.2	70%	0.701	53%	0.533	S	S	*	.	H	α-helix	trans	-52.5	-31.6	-178.6	-172.2	48.6	0	0	0	112.4	K33	D29-K33 VanDerWaalsContact O-CB 3.23Å; D29-K33 WeakPolarHBondContact O-CB 3.33Å; D29-K33 PolarHBondContact O-N 3.36Å
30	N	75.2	Confident	72.6	Confident	121 Å²	121	108.7 Å²	108.7	65%	0.647	54%	0.537	S	S	*	.	H	α-helix	trans	-68.4	-39.6	172.3	-83.3	-21.9	0	0	0	113.7	S28 T34	S28-N30 PolarHBondContact O-N 3.3Å; N30-T34 WeakPolarHBondContact O-CB 3.35Å; N30-T34 WeakPolarHBondContact O-CG2 3.32Å; N30-T34 PolarHBondContact O-N 2.78Å; N30-T34 PolarHBondContact O-OG1 3.28Å
31	E	77.2	Confident	74	Confident	103 Å²	103	106.2 Å²	106.2	48%	0.481	53%	0.527	S	S	.	.	H	α-helix	trans	-67.4	-44.4	174.6	-74.6	166.9	150.7	0	0	111.2	P27 S28 K33 T34 I35	P27-E31 HydrophobicContact CB-CB 4.23Å; S28-E31 PolarHBondContact N-OE2 2.91Å; S28-E31 WeakPolarHBondContact O-CA 3.41Å; S28-E31 WeakPolarHBondContact O-CB 3.34Å; S28-E31 PolarHBondContact O-N 3.35Å; S28-E31 WeakPolarHBondContact OG-CG 3.17Å; S28-E31 PolarHBondContact OG-N 3.18Å; S28-E31 PolarHBondContact OG-OE2 2.85Å; E31-K33 VanDerWaalsContact C-N 3.35Å; E31-K33 PolarHBondContact O-N 3.36Å; E31-T34 VanDerWaalsContact CA-OG1 3.32Å; E31-T34 WeakPolarHBondContact CA-OG1 3.47Å; E31-T34 PolarHBondContact O-N 3.3Å; E31-T34 PolarHBondContact O-OG1 2.92Å; E31-I35 WeakPolarHBondContact O-CB 3.46Å; E31-I35 WeakPolarHBondContact O-CD1 3.36Å; E31-I35 WeakPolarHBondContact O-CG1 3.42Å; E31-I35 PolarHBondContact O-N 2.82Å
32	L	74	Confident	75.6	Confident	60 Å²	60	102 Å²	102	31%	0.314	52%	0.518	S	S	.	.	H	α-helix	trans	-57.5	-48.1	172.4	-93.5	161.1	0	0	0	111.3	P27 S28 T34 I35 Y36	P27-L32 HydrophobicContact CB-CG 4.2Å; P27-L32 HydrophobicContact CG-CD1 3.77Å; P27-L32 HydrophobicContact CG-CD2 4.3Å; P27-L32 HydrophobicContact CG-CG 3.67Å; S28-L32 PolarHBondContact O-N 2.83Å; L32-T34 VanDerWaalsContact C-N 3.34Å; L32-T34 PolarHBondContact O-N 3.41Å; L32-I35 PolarHBondContact O-N 2.92Å; L32-Y36 HydrophobicContact CB-CD2 4.44Å; L32-Y36 HydrophobicContact CB-CE2 4.37Å; L32-Y36 HydrophobicContact CD2-CD2 4.32Å; L32-Y36 HydrophobicContact CD2-CE2 3.63Å; L32-Y36 WeakPolarHBondContact O-CD2 3.23Å; L32-Y36 PolarHBondContact O-N 3.36Å
33	K	80.5	Confident	77.1	Confident	147 Å²	147	99.9 Å²	99.9	64%	0.639	51%	0.512	S	S	*	.	H	α-helix	trans	-62.6	-39.5	179.6	-170.3	173.8	-176.2	176.6	0	112.5	D29 E31 R37	D29-K33 VanDerWaalsContact O-CB 3.23Å; D29-K33 WeakPolarHBondContact O-CB 3.33Å; D29-K33 PolarHBondContact O-N 3.36Å; E31-K33 VanDerWaalsContact C-N 3.35Å; E31-K33 PolarHBondContact O-N 3.36Å; K33-R37 WeakPolarHBondContact O-CB 3.37Å; K33-R37 PolarHBondContact O-N 3.27Å
34	T	83.6	Confident	78.6	Confident	62 Å²	62	100.4 Å²	100.4	38%	0.38	51%	0.51	S	S	.	.	H	α-helix	trans	-70.1	-37.7	175.4	48.3	0	0	0	0	112.3	N30 E31 L32 R37 N38	N30-T34 WeakPolarHBondContact O-CB 3.35Å; N30-T34 WeakPolarHBondContact O-CG2 3.32Å; N30-T34 PolarHBondContact O-N 2.78Å; N30-T34 PolarHBondContact O-OG1 3.28Å; E31-T34 VanDerWaalsContact CA-OG1 3.32Å; E31-T34 WeakPolarHBondContact CA-OG1 3.47Å; E31-T34 PolarHBondContact O-N 3.3Å; E31-T34 PolarHBondContact O-OG1 2.92Å; L32-T34 VanDerWaalsContact C-N 3.34Å; L32-T34 PolarHBondContact O-N 3.41Å; T34-R37 PolarHBondContact O-N 3.46Å; T34-N38 WeakPolarHBondContact O-CB 3.49Å; T34-N38 PolarHBondContact O-N 2.87Å; T34-N38 PolarHBondContact O-ND2 3.5Å; T34-N38 PolarHBondContact O-OD1 2.81Å
35	I	81.3	Confident	80.2	Confident	101 Å²	101	99.7 Å²	99.7	52%	0.518	51%	0.506	S	S	.	.	H	α-helix	trans	-63.3	-47	173.6	-70	165.2	0	0	0	110.6	E31 L32 R37 N38 S39	E31-I35 WeakPolarHBondContact O-CB 3.46Å; E31-I35 WeakPolarHBondContact O-CD1 3.36Å; E31-I35 WeakPolarHBondContact O-CG1 3.42Å; E31-I35 PolarHBondContact O-N 2.82Å; L32-I35 PolarHBondContact O-N 2.92Å; I35-R37 VanDerWaalsContact C-N 3.35Å; I35-R37 PolarHBondContact O-N 2.84Å; I35-N38 PolarHBondContact O-N 3.4Å; I35-S39 WeakPolarHBondContact O-CB 3.23Å; I35-S39 PolarHBondContact O-N 3.46Å; I35-S39 PolarHBondContact O-OG 3.32Å; I35-S39 VanDerWaalsContact O-OG 3.12Å
36	Y	83.5	Confident	81.7	Confident	160 Å²	160	99 Å²	99	63%	0.627	50%	0.502	S	S	*	.	H	α-helix	trans	-62.2	-40.5	175.7	-78	-62.9	0	0	0	112.3	L32 S39 H40	L32-Y36 HydrophobicContact CB-CD2 4.44Å; L32-Y36 HydrophobicContact CB-CE2 4.37Å; L32-Y36 HydrophobicContact CD2-CD2 4.32Å; L32-Y36 HydrophobicContact CD2-CE2 3.63Å; L32-Y36 WeakPolarHBondContact O-CD2 3.23Å; L32-Y36 PolarHBondContact O-N 3.36Å; Y36-S39 WeakPolarHBondContact CA-OG 3.28Å; Y36-S39 PolarHBondContact O-OG 3.03Å; Y36-H40 VanDerWaalsContact O-CB 3.28Å; Y36-H40 WeakPolarHBondContact O-CB 3.32Å; Y36-H40 PolarHBondContact O-N 2.84Å
37	R	86.1	Confident	83.3	Confident	136 Å²	136	98.4 Å²	98.4	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-64.2	-49.9	176.1	-176.4	178.2	66.4	95.2	-0.6	111.5	K33 T34 I35 S39 H40 E41	K33-R37 WeakPolarHBondContact O-CB 3.37Å; K33-R37 PolarHBondContact O-N 3.27Å; T34-R37 PolarHBondContact O-N 3.46Å; I35-R37 VanDerWaalsContact C-N 3.35Å; I35-R37 PolarHBondContact O-N 2.84Å; R37-S39 VanDerWaalsContact C-N 3.32Å; R37-S39 PolarHBondContact O-N 3.46Å; R37-H40 PolarHBondContact O-N 3.42Å; R37-E41 HydrophobicContact CG-CG 4.47Å; R37-E41 WeakPolarHBondContact CG-OE1 3.26Å; R37-E41 IonicContact CZ-OE1 3.83Å; R37-E41 IonicContact NH1-OE1 2.84Å; R37-E41 PolarHBondContact NH1-OE1 3.05Å; R37-E41 IonicContact NH1-OE2 3.25Å; R37-E41 WeakPolarHBondContact O-CB 3.41Å; R37-E41 WeakPolarHBondContact O-CG 3.11Å; R37-E41 PolarHBondContact O-N 2.88Å
38	N	88.9	Confident	84.7	Confident	84 Å²	84	103 Å²	103	45%	0.449	51%	0.511	S	S	.	.	H	α-helix	trans	-64.3	-37.9	-179.7	-68.1	-9	0	0	0	111.6	T34 I35 A42	T34-N38 WeakPolarHBondContact O-CB 3.49Å; T34-N38 PolarHBondContact O-N 2.87Å; T34-N38 PolarHBondContact O-ND2 3.5Å; T34-N38 PolarHBondContact O-OD1 2.81Å; I35-N38 PolarHBondContact O-N 3.4Å; N38-A42 VanDerWaalsContact O-CB 3.31Å; N38-A42 WeakPolarHBondContact O-CB 3.33Å; N38-A42 PolarHBondContact O-N 3.49Å
39	S	87.5	Confident	85.8	Confident	52 Å²	52	107.8 Å²	107.8	36%	0.364	52%	0.524	S	S	.	.	H	α-helix	trans	-68.3	-38.4	175.9	68	0	0	0	0	111.6	I35 Y36 R37 A42 I43	I35-S39 WeakPolarHBondContact O-CB 3.23Å; I35-S39 PolarHBondContact O-N 3.46Å; I35-S39 PolarHBondContact O-OG 3.32Å; I35-S39 VanDerWaalsContact O-OG 3.12Å; Y36-S39 WeakPolarHBondContact CA-OG 3.28Å; Y36-S39 PolarHBondContact O-OG 3.03Å; R37-S39 VanDerWaalsContact C-N 3.32Å; R37-S39 PolarHBondContact O-N 3.46Å; S39-A42 PolarHBondContact O-N 2.83Å; S39-I43 WeakPolarHBondContact O-CB 3.41Å; S39-I43 WeakPolarHBondContact O-CD1 3.41Å; S39-I43 WeakPolarHBondContact O-CG1 3.03Å; S39-I43 PolarHBondContact O-N 3.18Å
40	H	90.6	Very high	86.6	Confident	129 Å²	129	105.4 Å²	105.4	60%	0.597	51%	0.514	S	S	*	.	H	α-helix	trans	-67.3	-44.9	175.7	-158.9	40.2	0	0	0	112.2	Y36 R37 A42 I43 E44	Y36-H40 VanDerWaalsContact O-CB 3.28Å; Y36-H40 WeakPolarHBondContact O-CB 3.32Å; Y36-H40 PolarHBondContact O-N 2.84Å; R37-H40 PolarHBondContact O-N 3.42Å; H40-A42 VanDerWaalsContact C-N 3.29Å; H40-A42 PolarHBondContact O-N 3.3Å; H40-I43 PolarHBondContact O-N 3.32Å; H40-E44 WeakPolarHBondContact O-CB 3.45Å; H40-E44 PolarHBondContact O-N 3.46Å
41	E	90.9	Very high	87.3	Confident	94 Å²	94	107.1 Å²	107.1	44%	0.439	51%	0.512	S	S	.	.	H	α-helix	trans	-59.1	-40.2	173.7	-73.5	174.8	-163.5	0	0	111.3	R37 L45	R37-E41 HydrophobicContact CG-CG 4.47Å; R37-E41 WeakPolarHBondContact CG-OE1 3.26Å; R37-E41 IonicContact CZ-OE1 3.83Å; R37-E41 IonicContact NH1-OE1 2.84Å; R37-E41 PolarHBondContact NH1-OE1 3.05Å; R37-E41 IonicContact NH1-OE2 3.25Å; R37-E41 WeakPolarHBondContact O-CB 3.41Å; R37-E41 WeakPolarHBondContact O-CG 3.11Å; R37-E41 PolarHBondContact O-N 2.88Å; E41-L45 WeakPolarHBondContact O-CB 3.26Å; E41-L45 PolarHBondContact O-N 3.28Å
42	A	91.1	Very high	87.8	Confident	49 Å²	49	106.2 Å²	106.2	41%	0.405	51%	0.51	S	S	.	.	H	α-helix	trans	-67.7	-40.8	176	0	0	0	0	0	112.6	N38 S39 H40 L45 M46	N38-A42 VanDerWaalsContact O-CB 3.31Å; N38-A42 WeakPolarHBondContact O-CB 3.33Å; N38-A42 PolarHBondContact O-N 3.49Å; S39-A42 PolarHBondContact O-N 2.83Å; H40-A42 VanDerWaalsContact C-N 3.29Å; H40-A42 PolarHBondContact O-N 3.3Å; A42-L45 PolarHBondContact O-N 2.99Å; A42-M46 WeakPolarHBondContact O-CB 3.43Å; A42-M46 WeakPolarHBondContact O-CG 3.49Å; A42-M46 PolarHBondContact O-N 3.06Å
43	I	89.7	Confident	88.5	Confident	75 Å²	75	104.8 Å²	104.8	39%	0.385	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-48.1	174.8	-71.2	163.4	0	0	0	109.9	S39 H40 L45 M46 E47	S39-I43 WeakPolarHBondContact O-CB 3.41Å; S39-I43 WeakPolarHBondContact O-CD1 3.41Å; S39-I43 WeakPolarHBondContact O-CG1 3.03Å; S39-I43 PolarHBondContact O-N 3.18Å; H40-I43 PolarHBondContact O-N 3.32Å; I43-L45 VanDerWaalsContact C-N 3.33Å; I43-L45 PolarHBondContact O-N 3.12Å; I43-M46 HydrophobicContact CG1-CE 4.31Å; I43-M46 WeakPolarHBondContact O-CB 3.36Å; I43-M46 PolarHBondContact O-N 2.87Å; I43-M46 VanDerWaalsContact O-N 3.15Å; I43-E47 HydrophobicContact CG2-CG 4.32Å; I43-E47 WeakPolarHBondContact O-CG 3.45Å; I43-E47 PolarHBondContact O-N 3.28Å
44	E	93.1	Very high	88.5	Confident	125 Å²	125	104.6 Å²	104.6	58%	0.584	51%	0.509	S	S	*	.	H	α-helix	trans	-61	-42.3	179.5	-169.5	-176.7	177.4	0	0	111.6	H40 M46 E47 K48	H40-E44 WeakPolarHBondContact O-CB 3.45Å; H40-E44 PolarHBondContact O-N 3.46Å; E44-M46 VanDerWaalsContact C-N 3.35Å; E44-M46 PolarHBondContact O-N 3.45Å; E44-E47 PolarHBondContact O-N 2.96Å; E44-K48 WeakPolarHBondContact O-CB 3.49Å; E44-K48 PolarHBondContact O-N 3.17Å
45	L	91.9	Very high	88.5	Confident	121 Å²	121	104.3 Å²	104.3	63%	0.634	51%	0.51	S	S	*	.	H	α-helix	trans	-64.3	-39.6	176.2	-167.7	148.3	0	0	0	111.8	E41 A42 I43 K49	E41-L45 WeakPolarHBondContact O-CB 3.26Å; E41-L45 PolarHBondContact O-N 3.28Å; A42-L45 PolarHBondContact O-N 2.99Å; I43-L45 VanDerWaalsContact C-N 3.33Å; I43-L45 PolarHBondContact O-N 3.12Å; L45-K49 WeakPolarHBondContact O-CB 3.29Å; L45-K49 PolarHBondContact O-N 3.12Å
46	M	90.2	Very high	88.6	Confident	111 Å²	111	103.1 Å²	103.1	55%	0.547	51%	0.508	S	S	.	.	H	α-helix	trans	-65.5	-45.8	174.2	-75.1	-172.1	-68	0	0	111.6	A42 I43 E44 K48 K49 V50	A42-M46 WeakPolarHBondContact O-CB 3.43Å; A42-M46 WeakPolarHBondContact O-CG 3.49Å; A42-M46 PolarHBondContact O-N 3.06Å; I43-M46 HydrophobicContact CG1-CE 4.31Å; I43-M46 WeakPolarHBondContact O-CB 3.36Å; I43-M46 PolarHBondContact O-N 2.87Å; I43-M46 VanDerWaalsContact O-N 3.15Å; E44-M46 VanDerWaalsContact C-N 3.35Å; E44-M46 PolarHBondContact O-N 3.45Å; M46-K48 VanDerWaalsContact C-N 3.33Å; M46-K48 PolarHBondContact O-N 3.25Å; M46-K49 PolarHBondContact O-N 2.93Å; M46-V50 WeakPolarHBondContact O-CB 3.45Å; M46-V50 WeakPolarHBondContact O-CG2 3.33Å; M46-V50 PolarHBondContact O-N 3.02Å
47	E	92.2	Very high	88.6	Confident	110 Å²	110	99 Å²	99	51%	0.514	50%	0.496	S	S	.	.	H	α-helix	trans	-59.2	-43.8	176.7	-74.9	-175.3	175.3	0	0	111.8	I43 E44 V50 R51	I43-E47 HydrophobicContact CG2-CG 4.32Å; I43-E47 WeakPolarHBondContact O-CG 3.45Å; I43-E47 PolarHBondContact O-N 3.28Å; E44-E47 PolarHBondContact O-N 2.96Å; E47-V50 PolarHBondContact O-N 2.71Å; E47-R51 WeakPolarHBondContact O-CB 3.33Å; E47-R51 PolarHBondContact O-N 3.08Å
48	K	91.8	Very high	88.5	Confident	133 Å²	133	98.6 Å²	98.6	58%	0.578	50%	0.5	S	S	*	.	H	α-helix	trans	-61.3	-49.5	175.3	-176.5	178.7	178	-179.4	0	111.3	E44 M46 V50 R51 D52	E44-K48 WeakPolarHBondContact O-CB 3.49Å; E44-K48 PolarHBondContact O-N 3.17Å; M46-K48 VanDerWaalsContact C-N 3.33Å; M46-K48 PolarHBondContact O-N 3.25Å; K48-V50 VanDerWaalsContact C-N 3.29Å; K48-V50 PolarHBondContact O-N 3.26Å; K48-R51 PolarHBondContact O-N 3.42Å; K48-R51 VanDerWaalsContact O-N 3.17Å; K48-D52 WeakPolarHBondContact O-CB 3.22Å; K48-D52 VanDerWaalsContact O-CG 3.28Å; K48-D52 PolarHBondContact O-N 2.9Å
49	K	90.8	Very high	88.1	Confident	160 Å²	160	98.7 Å²	98.7	70%	0.696	50%	0.504	S	S	*	.	H	α-helix	trans	-60.2	-39.5	179.1	-175.3	176.2	-179.4	179.7	0	112.2	L45 M46 G53	L45-K49 WeakPolarHBondContact O-CB 3.29Å; L45-K49 PolarHBondContact O-N 3.12Å; M46-K49 PolarHBondContact O-N 2.93Å; K49-G53 PolarHBondContact O-N 3.34Å
50	V	89.1	Confident	87.9	Confident	81 Å²	81	104 Å²	104	49%	0.491	52%	0.516	S	S	.	.	H	α-helix	trans	-64.9	-45.7	176	168.7	0	0	0	0	110.5	M46 E47 K48 G53 F54	M46-V50 WeakPolarHBondContact O-CB 3.45Å; M46-V50 WeakPolarHBondContact O-CG2 3.33Å; M46-V50 PolarHBondContact O-N 3.02Å; E47-V50 PolarHBondContact O-N 2.71Å; K48-V50 VanDerWaalsContact C-N 3.29Å; K48-V50 PolarHBondContact O-N 3.26Å; V50-G53 PolarHBondContact O-N 3.19Å; V50-F54 HydrophobicContact CG1-CD2 3.57Å; V50-F54 HydrophobicContact CG1-CE2 3.26Å; V50-F54 HydrophobicContact CG1-CZ 4.39Å; V50-F54 WeakPolarHBondContact O-CD2 3.49Å; V50-F54 PolarHBondContact O-N 3.31Å
51	R	89	Confident	87.4	Confident	157 Å²	157	103 Å²	103	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-64	-44.5	178.4	-167.1	-174	-50.4	-88.9	-2.3	112.8	E47 K48 G53 F54 S55	E47-R51 WeakPolarHBondContact O-CB 3.33Å; E47-R51 PolarHBondContact O-N 3.08Å; K48-R51 PolarHBondContact O-N 3.42Å; K48-R51 VanDerWaalsContact O-N 3.17Å; R51-G53 VanDerWaalsContact C-N 3.33Å; R51-F54 PolarHBondContact O-N 2.95Å; R51-S55 PolarHBondContact O-N 3.46Å; R51-S55 PolarHBondContact O-OG 3.38Å
52	D	88.8	Confident	87	Confident	84 Å²	84	101.2 Å²	101.2	45%	0.449	51%	0.512	S	S	.	.	H	α-helix	trans	-63.4	-43.4	176.7	-68.7	-14.7	0	0	0	110	K48 S55 T56	K48-D52 WeakPolarHBondContact O-CB 3.22Å; K48-D52 VanDerWaalsContact O-CG 3.28Å; K48-D52 PolarHBondContact O-N 2.9Å; D52-S55 PolarHBondContact O-N 2.85Å; D52-T56 WeakPolarHBondContact O-CG2 3.44Å; D52-T56 PolarHBondContact O-N 2.88Å; D52-T56 PolarHBondContact O-OG1 3.5Å
53	G	87.5	Confident	86.5	Confident	30 Å²	30	102.1 Å²	102.1	31%	0.309	51%	0.513	S	S	.	.	H	α-helix	trans	-56.8	-51.9	174	0	0	0	0	0	112.5	K49 V50 R51 S55 T56 D57	K49-G53 PolarHBondContact O-N 3.34Å; V50-G53 PolarHBondContact O-N 3.19Å; R51-G53 VanDerWaalsContact C-N 3.33Å; G53-S55 VanDerWaalsContact C-N 3.32Å; G53-S55 PolarHBondContact O-N 3.42Å; G53-T56 PolarHBondContact O-N 3.21Å; G53-T56 PolarHBondContact O-OG1 2.97Å; G53-D57 PolarHBondContact O-N 3.29Å
54	F	81.5	Confident	86.1	Confident	142 Å²	142	103.7 Å²	103.7	62%	0.623	52%	0.521	S	S	*	.	H	α-helix	trans	-59.5	-40.3	177	-77.7	-58.5	0	0	0	112.8	V50 R51 D57 E58	V50-F54 HydrophobicContact CG1-CD2 3.57Å; V50-F54 HydrophobicContact CG1-CE2 3.26Å; V50-F54 HydrophobicContact CG1-CZ 4.39Å; V50-F54 WeakPolarHBondContact O-CD2 3.49Å; V50-F54 PolarHBondContact O-N 3.31Å; R51-F54 PolarHBondContact O-N 2.95Å; F54-D57 PolarHBondContact O-N 3.47Å; F54-E58 VanDerWaalsContact O-CB 3.32Å; F54-E58 WeakPolarHBondContact O-CB 3.42Å; F54-E58 PolarHBondContact O-N 3.42Å
55	S	82.5	Confident	85.3	Confident	57 Å²	57	102 Å²	102	40%	0.399	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-41	178	-55	0	0	0	0	111.7	R51 D52 G53 E58 T59	R51-S55 PolarHBondContact O-N 3.46Å; R51-S55 PolarHBondContact O-OG 3.38Å; D52-S55 PolarHBondContact O-N 2.85Å; G53-S55 VanDerWaalsContact C-N 3.32Å; G53-S55 PolarHBondContact O-N 3.42Å; S55-E58 PolarHBondContact O-N 2.94Å; S55-T59 WeakPolarHBondContact O-CG2 3.23Å; S55-T59 PolarHBondContact O-N 2.86Å; S55-T59 VanDerWaalsContact O-N 3.09Å; S55-T59 PolarHBondContact O-OG1 2.95Å
56	T	84	Confident	84.6	Confident	76 Å²	76	101.8 Å²	101.8	47%	0.466	52%	0.515	S	S	.	.	H	α-helix	trans	-66.8	-38	175.9	58.7	0	0	0	0	112.6	D52 G53 T59 R60	D52-T56 WeakPolarHBondContact O-CG2 3.44Å; D52-T56 PolarHBondContact O-N 2.88Å; D52-T56 PolarHBondContact O-OG1 3.5Å; G53-T56 PolarHBondContact O-N 3.21Å; G53-T56 PolarHBondContact O-OG1 2.97Å; T56-T59 PolarHBondContact O-OG1 2.93Å; T56-R60 VanDerWaalsContact O-CG 3.24Å; T56-R60 WeakPolarHBondContact O-CG 3.34Å; T56-R60 PolarHBondContact O-N 3.4Å; T56-R60 VanDerWaalsContact O-N 3.15Å
57	D	83.5	Confident	84.2	Confident	73 Å²	73	104.9 Å²	104.9	39%	0.39	52%	0.521	S	S	.	.	H	α-helix	trans	-73.5	-35.3	176.8	-79.5	-21.5	0	0	0	112.1	G53 F54 T59 R60 L61	G53-D57 PolarHBondContact O-N 3.29Å; F54-D57 PolarHBondContact O-N 3.47Å; D57-T59 PolarHBondContact O-N 2.9Å; D57-R60 PolarHBondContact O-N 3.12Å; D57-R60 IonicContact OD1-NH1 3.95Å; D57-R60 PolarHBondContact OD1-NH1 3.36Å; D57-R60 VanDerWaalsContact OD1-NH1 3.08Å; D57-L61 WeakPolarHBondContact O-CB 3.41Å; D57-L61 WeakPolarHBondContact O-CD1 3.4Å; D57-L61 WeakPolarHBondContact O-CG 3.17Å; D57-L61 PolarHBondContact O-N 3.19Å
58	E	84.1	Confident	83.5	Confident	128 Å²	128	105.3 Å²	105.3	60%	0.598	52%	0.521	S	S	*	.	H	α-helix	trans	-59.9	-46	173.9	-176.9	176.8	-174.4	0	0	111.8	F54 S55 L61 S62	F54-E58 VanDerWaalsContact O-CB 3.32Å; F54-E58 WeakPolarHBondContact O-CB 3.42Å; F54-E58 PolarHBondContact O-N 3.42Å; S55-E58 PolarHBondContact O-N 2.94Å; E58-L61 PolarHBondContact O-N 2.89Å; E58-S62 WeakPolarHBondContact O-CB 3.22Å; E58-S62 PolarHBondContact O-N 2.92Å; E58-S62 PolarHBondContact O-OG 3.11Å
59	T	81.6	Confident	82.5	Confident	85 Å²	85	100.8 Å²	100.8	52%	0.521	50%	0.502	S	S	.	.	H	α-helix	trans	-64.6	-39.4	176.5	52.4	0	0	0	0	112.3	S55 T56 D57 T63	S55-T59 WeakPolarHBondContact O-CG2 3.23Å; S55-T59 PolarHBondContact O-N 2.86Å; S55-T59 VanDerWaalsContact O-N 3.09Å; S55-T59 PolarHBondContact O-OG1 2.95Å; T56-T59 PolarHBondContact O-OG1 2.93Å; D57-T59 PolarHBondContact O-N 2.9Å; T59-T63 WeakPolarHBondContact O-CB 3.5Å; T59-T63 PolarHBondContact O-N 3.1Å; T59-T63 PolarHBondContact O-OG1 3.48Å
60	R	81.6	Confident	81.9	Confident	165 Å²	165	97 Å²	97	62%	0.623	50%	0.5	S	S	*	.	H	α-helix	trans	-64.7	-45.6	175.5	-73.3	172.2	69.5	-162.6	5.4	112.2	T56 D57 T63 L64	T56-R60 VanDerWaalsContact O-CG 3.24Å; T56-R60 WeakPolarHBondContact O-CG 3.34Å; T56-R60 PolarHBondContact O-N 3.4Å; T56-R60 VanDerWaalsContact O-N 3.15Å; D57-R60 PolarHBondContact O-N 3.12Å; D57-R60 IonicContact OD1-NH1 3.95Å; D57-R60 PolarHBondContact OD1-NH1 3.36Å; D57-R60 VanDerWaalsContact OD1-NH1 3.08Å; R60-T63 PolarHBondContact O-N 3.4Å; R60-L64 WeakPolarHBondContact O-CG 3.44Å; R60-L64 PolarHBondContact O-N 3.34Å
61	L	81.8	Confident	81.4	Confident	108 Å²	108	104 Å²	104	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-63.3	-44.3	177.6	-83.7	155.7	0	0	0	111.4	D57 E58 T63 L64 L65	D57-L61 WeakPolarHBondContact O-CB 3.41Å; D57-L61 WeakPolarHBondContact O-CD1 3.4Å; D57-L61 WeakPolarHBondContact O-CG 3.17Å; D57-L61 PolarHBondContact O-N 3.19Å; E58-L61 PolarHBondContact O-N 2.89Å; L61-T63 PolarHBondContact O-N 3.42Å; L61-L64 PolarHBondContact O-N 3.47Å; L61-L65 PolarHBondContact O-N 2.94Å
62	S	80.4	Confident	80.6	Confident	55 Å²	55	101.3 Å²	101.3	39%	0.385	52%	0.515	S	S	.	.	H	α-helix	trans	-59.8	-45.3	176.4	-60.5	0	0	0	0	111.5	E58 L64 L65 D66	E58-S62 WeakPolarHBondContact O-CB 3.22Å; E58-S62 PolarHBondContact O-N 2.92Å; E58-S62 PolarHBondContact O-OG 3.11Å; S62-L64 VanDerWaalsContact C-N 3.32Å; S62-L64 PolarHBondContact O-N 2.89Å; S62-L65 PolarHBondContact O-N 3.35Å; S62-D66 PolarHBondContact O-N 2.95Å
63	T	81.9	Confident	79.9	Confident	68 Å²	68	100.8 Å²	100.8	42%	0.417	53%	0.53	S	S	.	.	H	α-helix	trans	-61.9	-38.4	176.8	-55.3	0	0	0	0	112.3	T59 R60 L61 R67	T59-T63 WeakPolarHBondContact O-CB 3.5Å; T59-T63 PolarHBondContact O-N 3.1Å; T59-T63 PolarHBondContact O-OG1 3.48Å; R60-T63 PolarHBondContact O-N 3.4Å; L61-T63 PolarHBondContact O-N 3.42Å; T63-R67 WeakPolarHBondContact O-CG 3.5Å; T63-R67 PolarHBondContact O-N 2.88Å
64	L	80.6	Confident	79	Confident	108 Å²	108	102.9 Å²	102.9	57%	0.565	54%	0.54	S	S	*	.	H	α-helix	trans	-69.6	-42	177.1	-75.3	173.2	0	0	0	111.9	R60 L61 S62 R67 F68	R60-L64 WeakPolarHBondContact O-CG 3.44Å; R60-L64 PolarHBondContact O-N 3.34Å; L61-L64 PolarHBondContact O-N 3.47Å; S62-L64 VanDerWaalsContact C-N 3.32Å; S62-L64 PolarHBondContact O-N 2.89Å; L64-R67 PolarHBondContact O-N 3.45Å; L64-F68 WeakPolarHBondContact O-CB 3.49Å; L64-F68 PolarHBondContact O-N 3.37Å
65	L	76.4	Confident	78.3	Confident	91 Å²	91	105.3 Å²	105.3	48%	0.476	55%	0.55	S	S	.	.	H	α-helix	trans	-61.7	-43.5	175.7	-82.1	162.5	0	0	0	111.4	L61 S62 R67 F68 H69	L61-L65 PolarHBondContact O-N 2.94Å; S62-L65 PolarHBondContact O-N 3.35Å; L65-R67 PolarHBondContact O-N 3.1Å; L65-F68 PolarHBondContact O-N 3.43Å; L65-H69 PolarHBondContact O-CD2 3.15Å; L65-H69 PolarHBondContact O-N 3.05Å
66	D	78.4	Confident	77.5	Confident	115 Å²	115	104.4 Å²	104.4	62%	0.615	54%	0.543	S	S	*	.	H	α-helix	trans	-61.6	-42.8	177.2	-76.2	-22.4	0	0	0	112	S62 F68 H69 A70	S62-D66 PolarHBondContact O-N 2.95Å; D66-F68 PolarHBondContact O-N 3.04Å; D66-H69 PolarHBondContact O-N 3.31Å; D66-A70 VanDerWaalsContact O-CB 3.31Å; D66-A70 WeakPolarHBondContact O-CB 3.25Å; D66-A70 PolarHBondContact O-N 2.99Å
67	R	80.9	Confident	77	Confident	177 Å²	177	105.7 Å²	105.7	67%	0.668	55%	0.547	S	S	*	.	H	α-helix	trans	-63.4	-40.2	173.7	-73.5	-174.4	-157.2	177.3	6.3	112.5	T63 L64 L65 A70 R71	T63-R67 WeakPolarHBondContact O-CG 3.5Å; T63-R67 PolarHBondContact O-N 2.88Å; L64-R67 PolarHBondContact O-N 3.45Å; L65-R67 PolarHBondContact O-N 3.1Å; R67-A70 PolarHBondContact O-N 2.92Å; R67-R71 WeakPolarHBondContact O-CB 3.38Å; R67-R71 PolarHBondContact O-N 3.26Å
68	F	76.7	Confident	76.8	Confident	118 Å²	118	107.4 Å²	107.4	52%	0.518	56%	0.556	S	S	.	*	H	α-helix	trans	-64.9	-45.7	178.9	-179.7	-103.8	0	0	0	111.3	L64 L65 D66 R71 L72	L64-F68 WeakPolarHBondContact O-CB 3.49Å; L64-F68 PolarHBondContact O-N 3.37Å; L65-F68 PolarHBondContact O-N 3.43Å; D66-F68 PolarHBondContact O-N 3.04Å; F68-R71 PolarHBondContact O-N 3.22Å; F68-L72 HydrophobicContact CD1-CD1 3.85Å; F68-L72 HydrophobicContact CE1-CD1 3.22Å; F68-L72 HydrophobicContact CE1-CG 4.22Å; F68-L72 HydrophobicContact CE2-CD1 4.25Å; F68-L72 HydrophobicContact CZ-CD1 3.46Å; F68-L72 VanDerWaalsContact CZ-CD1 3.46Å; F68-L72 HydrophobicContact CZ-CG 4.19Å; F68-L72 PolarHBondContact O-N 3.04Å
69	H	72	Confident	76.7	Confident	38 Å²	38	105 Å²	105	18%	0.176	55%	0.547	C	S	.	.	H	α-helix	trans	-66.9	-36.7	176.3	-71.4	-50.8	0	0	0	113	L65 D66 R71 L72 G73 P76	L65-H69 PolarHBondContact O-CD2 3.15Å; L65-H69 PolarHBondContact O-N 3.05Å; D66-H69 PolarHBondContact O-N 3.31Å; H69-R71 VanDerWaalsContact C-N 3.26Å; H69-R71 PolarHBondContact O-N 3.44Å; H69-L72 PolarHBondContact O-N 3.46Å; H69-G73 PolarHBondContact O-N 2.74Å; H69-P76 WeakPolarHBondContact CE1-CD 3.31Å; H69-P76 VanDerWaalsContact CE1-CG 3.4Å; H69-P76 WeakPolarHBondContact CE1-CG 3.3Å; H69-P76 WeakPolarHBondContact ND1-CD 3.31Å
70	A	77.2	Confident	76.7	Confident	80 Å²	80	105.3 Å²	105.3	66%	0.661	54%	0.544	S	S	*	.	H	α-helix	trans	-59.8	-38.8	171.7	0	0	0	0	0	111.6	D66 R67 G73	D66-A70 VanDerWaalsContact O-CB 3.31Å; D66-A70 WeakPolarHBondContact O-CB 3.25Å; D66-A70 PolarHBondContact O-N 2.99Å; R67-A70 PolarHBondContact O-N 2.92Å; A70-G73 PolarHBondContact O-N 3.16Å
71	R	78.5	Confident	76.6	Confident	229 Å²	229	103.6 Å²	103.6	86%	0.864	54%	0.538	S	S	*	.	H	α-helix	trans	-74.5	-32.9	179.3	-168.1	171.9	-176	175.4	1	113.7	R67 F68 H69 G73	R67-R71 WeakPolarHBondContact O-CB 3.38Å; R67-R71 PolarHBondContact O-N 3.26Å; F68-R71 PolarHBondContact O-N 3.22Å; H69-R71 VanDerWaalsContact C-N 3.26Å; H69-R71 PolarHBondContact O-N 3.44Å; R71-G73 PolarHBondContact O-N 2.88Å
72	L	73.5	Confident	76.7	Confident	101 Å²	101	103.4 Å²	103.4	53%	0.529	53%	0.534	S	S	.	.	H	α-helix	trans	-77.6	-7.3	175.3	-76	177.9	0	0	0	113.6	F68 H69 S74	F68-L72 HydrophobicContact CD1-CD1 3.85Å; F68-L72 HydrophobicContact CE1-CD1 3.22Å; F68-L72 HydrophobicContact CE1-CG 4.22Å; F68-L72 HydrophobicContact CE2-CD1 4.25Å; F68-L72 HydrophobicContact CZ-CD1 3.46Å; F68-L72 VanDerWaalsContact CZ-CD1 3.46Å; F68-L72 HydrophobicContact CZ-CG 4.19Å; F68-L72 PolarHBondContact O-N 3.04Å; H69-L72 PolarHBondContact O-N 3.46Å; L72-S74 PolarHBondContact O-N 3.31Å; L72-S74 VanDerWaalsContact O-N 3.08Å
73	G	73.4	Confident	77	Confident	73 Å²	73	106.5 Å²	106.5	75%	0.753	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	6.1	-179.9	0	0	0	0	0	114.6	H69 A70 R71	H69-G73 PolarHBondContact O-N 2.74Å; A70-G73 PolarHBondContact O-N 3.16Å; R71-G73 PolarHBondContact O-N 2.88Å
74	S	68.9	Low	77.1	Confident	74 Å²	74	107.2 Å²	107.2	52%	0.517	54%	0.544	S	S	.	.	S	Bend	trans	-143.2	133.7	178.9	59.4	0	0	0	0	111.5	L72	L72-S74 PolarHBondContact O-N 3.31Å; L72-S74 VanDerWaalsContact O-N 3.08Å
75	K	66.6	Low	77.4	Confident	193 Å²	193	106.3 Å²	106.3	84%	0.839	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-72.6	140.9	166.2	-71.4	-178.3	180	179.4	0	108	N77	K75-N77 PolarHBondContact O-N 2.83Å
76	P	65.2	Low	78	Confident	38 Å²	38	106.7 Å²	106.7	25%	0.247	54%	0.54	C	S	.	.	P	Polyproline II helix	trans	-64.9	139.2	-178.9	30.4	-30.5	0	0	0	108.4	H69 N78	H69-P76 WeakPolarHBondContact CE1-CD 3.31Å; H69-P76 VanDerWaalsContact CE1-CG 3.4Å; H69-P76 WeakPolarHBondContact CE1-CG 3.3Å; H69-P76 WeakPolarHBondContact ND1-CD 3.31Å; P76-N78 PolarHBondContact O-N 3.09Å
77	N	73.7	Confident	78.4	Confident	103 Å²	103	105.5 Å²	105.5	55%	0.551	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-51.6	135.9	171.5	-175.1	-1.8	0	0	0	108.6	K75 D79 I80 R81	K75-N77 PolarHBondContact O-N 2.83Å; N77-D79 PolarHBondContact O-N 3.43Å; N77-D79 VanDerWaalsContact O-N 3.08Å; N77-I80 HydrophobicContact CB-CD1 4.03Å; N77-I80 HydrophobicContact CB-CG1 4.16Å; N77-I80 PolarHBondContact O-N 2.84Å; N77-R81 PolarHBondContact O-N 3.41Å
78	N	78.9	Confident	78.6	Confident	108 Å²	108	99.5 Å²	99.5	58%	0.578	52%	0.521	S	S	*	.	H	α-helix	trans	-55.6	-32.3	-175.8	-161.3	23.3	0	0	0	111.7	P76 R81 H82	P76-N78 PolarHBondContact O-N 3.09Å; N78-R81 PolarHBondContact OD1-NE 2.95Å; N78-R81 PolarHBondContact OD1-NH2 2.84Å; N78-H82 WeakPolarHBondContact O-CB 3.34Å; N78-H82 PolarHBondContact O-N 2.83Å
79	D	82.3	Confident	79.2	Confident	79 Å²	79	99.1 Å²	99.1	42%	0.422	52%	0.524	S	S	.	.	H	α-helix	trans	-61.1	-44.4	173.4	-178.5	59.4	0	0	0	113.2	N77 H82 K83	N77-D79 PolarHBondContact O-N 3.43Å; N77-D79 VanDerWaalsContact O-N 3.08Å; D79-H82 WeakPolarHBondContact O-CB 3.33Å; D79-H82 PolarHBondContact O-N 2.87Å; D79-K83 VanDerWaalsContact CG-CE 3.44Å; D79-K83 WeakPolarHBondContact O-CG 3.49Å; D79-K83 PolarHBondContact O-N 3.21Å; D79-K83 WeakPolarHBondContact OD1-CE 3.42Å; D79-K83 IonicContact OD1-NZ 3.08Å; D79-K83 WeakPolarHBondContact OD2-CE 3.4Å
80	I	81.1	Confident	79.9	Confident	90 Å²	90	104.6 Å²	104.6	46%	0.462	54%	0.543	S	S	.	.	H	α-helix	trans	-65	-46.2	179.4	-63.5	171.7	0	0	0	110.1	N77 H82 K83 V84	N77-I80 HydrophobicContact CB-CD1 4.03Å; N77-I80 HydrophobicContact CB-CG1 4.16Å; N77-I80 PolarHBondContact O-N 2.84Å; I80-H82 VanDerWaalsContact C-N 3.25Å; I80-H82 PolarHBondContact O-N 2.95Å; I80-K83 PolarHBondContact O-N 2.88Å; I80-V84 HydrophobicContact CG2-CG2 4.22Å; I80-V84 WeakPolarHBondContact O-CG2 3.29Å; I80-V84 PolarHBondContact O-N 3.43Å
81	R	79.9	Confident	80.4	Confident	129 Å²	129	101.5 Å²	101.5	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-58.5	-41.6	176.8	176.6	172	49.2	-165.3	-6.4	111.1	N77 N78 V84 N85	N77-R81 PolarHBondContact O-N 3.41Å; N78-R81 PolarHBondContact OD1-NE 2.95Å; N78-R81 PolarHBondContact OD1-NH2 2.84Å; R81-V84 PolarHBondContact O-N 2.7Å; R81-N85 WeakPolarHBondContact O-CB 3.32Å; R81-N85 VanDerWaalsContact O-CG 3.27Å; R81-N85 PolarHBondContact O-N 3.21Å
82	H	83.7	Confident	80.9	Confident	105 Å²	105	94.5 Å²	94.5	49%	0.486	50%	0.501	S	S	.	.	H	α-helix	trans	-62.5	-47.1	175.9	-172.2	57.2	0	0	0	112.1	N78 D79 I80 V84 N85 Q86	N78-H82 WeakPolarHBondContact O-CB 3.34Å; N78-H82 PolarHBondContact O-N 2.83Å; D79-H82 WeakPolarHBondContact O-CB 3.33Å; D79-H82 PolarHBondContact O-N 2.87Å; I80-H82 VanDerWaalsContact C-N 3.25Å; I80-H82 PolarHBondContact O-N 2.95Å; H82-V84 PolarHBondContact O-N 3.44Å; H82-N85 PolarHBondContact O-N 2.73Å; H82-Q86 PolarHBondContact NE2-NE2 2.81Å; H82-Q86 WeakPolarHBondContact O-CG 3.17Å; H82-Q86 PolarHBondContact O-N 2.79Å
83	K	86.5	Confident	81.5	Confident	120 Å²	120	95.5 Å²	95.5	52%	0.522	50%	0.503	S	S	.	.	H	α-helix	trans	-62.4	-40.8	177.3	-70	174.5	-169.2	-71.4	0	112.7	D79 I80 Q86 L87	D79-K83 VanDerWaalsContact CG-CE 3.44Å; D79-K83 WeakPolarHBondContact O-CG 3.49Å; D79-K83 PolarHBondContact O-N 3.21Å; D79-K83 WeakPolarHBondContact OD1-CE 3.42Å; D79-K83 IonicContact OD1-NZ 3.08Å; D79-K83 WeakPolarHBondContact OD2-CE 3.4Å; I80-K83 PolarHBondContact O-N 2.88Å; K83-Q86 PolarHBondContact O-N 3.48Å; K83-L87 WeakPolarHBondContact O-CB 3.25Å; K83-L87 PolarHBondContact O-N 3.48Å
84	V	85.3	Confident	82.2	Confident	82 Å²	82	94.1 Å²	94.1	50%	0.497	48%	0.478	S	S	.	.	H	α-helix	trans	-64.8	-42.9	176.3	171.8	0	0	0	0	110.7	I80 R81 H82 L87 A88	I80-V84 HydrophobicContact CG2-CG2 4.22Å; I80-V84 WeakPolarHBondContact O-CG2 3.29Å; I80-V84 PolarHBondContact O-N 3.43Å; R81-V84 PolarHBondContact O-N 2.7Å; H82-V84 PolarHBondContact O-N 3.44Å; V84-L87 PolarHBondContact O-N 2.85Å; V84-A88 WeakPolarHBondContact O-CB 3.41Å; V84-A88 PolarHBondContact O-N 3.45Å
85	N	86.2	Confident	83	Confident	90 Å²	90	94.8 Å²	94.8	48%	0.481	48%	0.476	S	S	.	.	H	α-helix	trans	-63.5	-42.3	175.1	-74.1	-8.9	0	0	0	111.7	R81 H82 L87 A88 L89	R81-N85 WeakPolarHBondContact O-CB 3.32Å; R81-N85 VanDerWaalsContact O-CG 3.27Å; R81-N85 PolarHBondContact O-N 3.21Å; H82-N85 PolarHBondContact O-N 2.73Å; N85-L87 VanDerWaalsContact C-N 3.33Å; N85-L87 PolarHBondContact O-N 3.36Å; N85-A88 PolarHBondContact O-N 3.35Å; N85-L89 VanDerWaalsContact O-CG 3.3Å; N85-L89 WeakPolarHBondContact O-CG 3.35Å; N85-L89 PolarHBondContact O-N 2.88Å
86	Q	88.7	Confident	83.9	Confident	99 Å²	99	86.3 Å²	86.3	46%	0.463	44%	0.441	S	S	.	.	H	α-helix	trans	-60.5	-43.8	173.7	-74	-171.8	-2.4	0	0	111.6	H82 K83 L89 R90	H82-Q86 PolarHBondContact NE2-NE2 2.81Å; H82-Q86 WeakPolarHBondContact O-CG 3.17Å; H82-Q86 PolarHBondContact O-N 2.79Å; K83-Q86 PolarHBondContact O-N 3.48Å; Q86-L89 PolarHBondContact O-N 3.29Å; Q86-R90 WeakPolarHBondContact O-CG 3.35Å; Q86-R90 PolarHBondContact O-N 3.44Å
87	L	86.2	Confident	84.6	Confident	90 Å²	90	95.9 Å²	95.9	47%	0.471	47%	0.472	S	S	.	.	H	α-helix	trans	-63.4	-44.3	176.9	-177.5	132.3	0	0	0	111	K83 V84 N85 L89 R90 L91	K83-L87 WeakPolarHBondContact O-CB 3.25Å; K83-L87 PolarHBondContact O-N 3.48Å; V84-L87 PolarHBondContact O-N 2.85Å; N85-L87 VanDerWaalsContact C-N 3.33Å; N85-L87 PolarHBondContact O-N 3.36Å; L87-L89 VanDerWaalsContact C-N 3.33Å; L87-L89 PolarHBondContact O-N 3.47Å; L87-R90 PolarHBondContact O-N 2.85Å; L87-L91 HydrophobicContact CD2-CD1 3.51Å; L87-L91 HydrophobicContact CD2-CG 4.18Å; L87-L91 HydrophobicContact CG-CD1 4.23Å; L87-L91 HydrophobicContact CG-CG 4.37Å; L87-L91 WeakPolarHBondContact O-CB 3.35Å; L87-L91 VanDerWaalsContact O-CG 3.24Å; L87-L91 WeakPolarHBondContact O-CG 3.5Å; L87-L91 PolarHBondContact O-N 2.82Å
88	A	87	Confident	85	Confident	51 Å²	51	93.2 Å²	93.2	42%	0.421	46%	0.462	S	S	.	.	H	α-helix	trans	-59.8	-42.1	175.8	0	0	0	0	0	112.1	V84 N85 L91 S92	V84-A88 WeakPolarHBondContact O-CB 3.41Å; V84-A88 PolarHBondContact O-N 3.45Å; N85-A88 PolarHBondContact O-N 3.35Å; A88-L91 PolarHBondContact O-N 2.88Å; A88-S92 WeakPolarHBondContact O-CB 3.34Å; A88-S92 PolarHBondContact O-N 3.26Å
89	L	88.6	Confident	84.9	Confident	110 Å²	110	92.9 Å²	92.9	58%	0.576	47%	0.467	S	S	*	.	H	α-helix	trans	-61.4	-48.7	174.6	-71.9	170.6	0	0	0	111.4	N85 Q86 L87 L91 S92 E93	N85-L89 VanDerWaalsContact O-CG 3.3Å; N85-L89 WeakPolarHBondContact O-CG 3.35Å; N85-L89 PolarHBondContact O-N 2.88Å; Q86-L89 PolarHBondContact O-N 3.29Å; L87-L89 VanDerWaalsContact C-N 3.33Å; L87-L89 PolarHBondContact O-N 3.47Å; L89-L91 VanDerWaalsContact C-N 3.33Å; L89-L91 PolarHBondContact O-N 2.87Å; L89-S92 PolarHBondContact O-N 3.34Å; L89-S92 VanDerWaalsContact O-N 3.12Å; L89-S92 PolarHBondContact O-OG 2.92Å; L89-E93 WeakPolarHBondContact O-CG 3.49Å; L89-E93 PolarHBondContact O-N 2.84Å
90	R	87	Confident	85.1	Confident	153 Å²	153	91.6 Å²	91.6	58%	0.577	46%	0.464	S	S	*	.	H	α-helix	trans	-62.7	-38.1	176.7	-65	-52.7	-173.7	-175.2	-1.6	112.8	Q86 L87 S92 E93 I94	Q86-R90 WeakPolarHBondContact O-CG 3.35Å; Q86-R90 PolarHBondContact O-N 3.44Å; L87-R90 PolarHBondContact O-N 2.85Å; R90-S92 VanDerWaalsContact C-N 3.31Å; R90-E93 WeakPolarHBondContact CD-OE2 3.44Å; R90-E93 IonicContact CZ-OE2 3.65Å; R90-E93 IonicContact NE-OE2 3.27Å; R90-E93 IonicContact NH1-OE1 2.93Å; R90-E93 PolarHBondContact NH1-OE1 2.87Å; R90-E93 IonicContact NH1-OE2 3.73Å; R90-E93 PolarHBondContact NH1-OE2 3.45Å; R90-E93 PolarHBondContact O-N 3.49Å; R90-I94 WeakPolarHBondContact O-CD1 3.45Å; R90-I94 PolarHBondContact O-N 3.27Å; R90-I94 VanDerWaalsContact O-N 3.1Å
91	L	88	Confident	85.4	Confident	15 Å²	15	94.4 Å²	94.4	8%	0.079	48%	0.478	C	S	.	.	H	α-helix	trans	-65.9	-35.5	174.8	-70.3	-178.9	0	0	0	112.1	L87 A88 L89 D95 C96 I104	L87-L91 HydrophobicContact CD2-CD1 3.51Å; L87-L91 HydrophobicContact CD2-CG 4.18Å; L87-L91 HydrophobicContact CG-CD1 4.23Å; L87-L91 HydrophobicContact CG-CG 4.37Å; L87-L91 WeakPolarHBondContact O-CB 3.35Å; L87-L91 VanDerWaalsContact O-CG 3.24Å; L87-L91 WeakPolarHBondContact O-CG 3.5Å; L87-L91 PolarHBondContact O-N 2.82Å; A88-L91 PolarHBondContact O-N 2.88Å; L89-L91 VanDerWaalsContact C-N 3.33Å; L89-L91 PolarHBondContact O-N 2.87Å; L91-D95 PolarHBondContact O-N 3.27Å; L91-D95 VanDerWaalsContact O-N 3.08Å; L91-C96 HydrophobicContact CD2-CB 3.92Å; L91-C96 PolarHBondContact O-N 2.87Å; L91-I104 HydrophobicContact CD1-CD1 4.5Å; L91-I104 HydrophobicContact CD2-CB 4.4Å; L91-I104 HydrophobicContact CD2-CD1 3.63Å; L91-I104 HydrophobicContact CD2-CG1 3.47Å; L91-I104 VanDerWaalsContact CD2-CG1 3.47Å; L91-I104 HydrophobicContact CD2-CG2 4.16Å
92	S	87.6	Confident	85.9	Confident	81 Å²	81	94.2 Å²	94.2	57%	0.566	48%	0.483	S	S	*	.	H	α-helix	trans	-68.4	-38.6	174	73.9	0	0	0	0	112.2	A88 L89 R90 I94 D95	A88-S92 WeakPolarHBondContact O-CB 3.34Å; A88-S92 PolarHBondContact O-N 3.26Å; L89-S92 PolarHBondContact O-N 3.34Å; L89-S92 VanDerWaalsContact O-N 3.12Å; L89-S92 PolarHBondContact O-OG 2.92Å; R90-S92 VanDerWaalsContact C-N 3.31Å; S92-I94 VanDerWaalsContact C-N 3.33Å; S92-I94 PolarHBondContact O-N 3.26Å; S92-D95 PolarHBondContact O-N 2.97Å; S92-D95 VanDerWaalsContact O-N 3.15Å
93	E	86.9	Confident	86.1	Confident	122 Å²	122	91.1 Å²	91.1	57%	0.57	47%	0.472	S	S	*	.	H	α-helix	trans	-61.9	-39.2	175.3	-71.9	170.9	-178.6	0	0	112.2	L89 R90 D95	L89-E93 WeakPolarHBondContact O-CG 3.49Å; L89-E93 PolarHBondContact O-N 2.84Å; R90-E93 WeakPolarHBondContact CD-OE2 3.44Å; R90-E93 IonicContact CZ-OE2 3.65Å; R90-E93 IonicContact NE-OE2 3.27Å; R90-E93 IonicContact NH1-OE1 2.93Å; R90-E93 PolarHBondContact NH1-OE1 2.87Å; R90-E93 IonicContact NH1-OE2 3.73Å; R90-E93 PolarHBondContact NH1-OE2 3.45Å; R90-E93 PolarHBondContact O-N 3.49Å; E93-D95 VanDerWaalsContact C-N 3.29Å
94	I	87	Confident	86.3	Confident	44 Å²	44	87.2 Å²	87.2	23%	0.226	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-0	180	-64.6	157.3	0	0	0	111.6	R90 S92 C96 R107 V108	R90-I94 WeakPolarHBondContact O-CD1 3.45Å; R90-I94 PolarHBondContact O-N 3.27Å; R90-I94 VanDerWaalsContact O-N 3.1Å; S92-I94 VanDerWaalsContact C-N 3.33Å; S92-I94 PolarHBondContact O-N 3.26Å; I94-C96 VanDerWaalsContact C-N 3.31Å; I94-C96 PolarHBondContact O-N 3.28Å; I94-R107 HydrophobicContact CG2-CB 3.8Å; I94-R107 HydrophobicContact CG2-CG 3.31Å; I94-R107 WeakPolarHBondContact O-CG 3.27Å; I94-R107 PolarHBondContact O-NE 2.96Å; I94-V108 HydrophobicContact CD1-CG2 3.67Å; I94-V108 HydrophobicContact CG2-CG2 4.29Å
95	D	85.7	Confident	86.5	Confident	88 Å²	88	89.6 Å²	89.6	47%	0.471	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	51.4	-173.9	-178.6	40.5	0	0	0	111.9	L91 S92 E93 R107	L91-D95 PolarHBondContact O-N 3.27Å; L91-D95 VanDerWaalsContact O-N 3.08Å; S92-D95 PolarHBondContact O-N 2.97Å; S92-D95 VanDerWaalsContact O-N 3.15Å; E93-D95 VanDerWaalsContact C-N 3.29Å; D95-R107 PolarHBondContact O-NE 3.3Å; D95-R107 IonicContact OD2-CZ 3.55Å; D95-R107 IonicContact OD2-NH2 3.97Å; D95-R107 PolarHBondContact OD2-NH2 2.93Å
96	C	85.4	Confident	86.8	Confident	16 Å²	16	88.8 Å²	88.8	11%	0.108	46%	0.456	C	S	.	.			trans	-106.5	112.1	177.2	-165	0	0	0	0	110.4	L91 I94 S98 R107	L91-C96 HydrophobicContact CD2-CB 3.92Å; L91-C96 PolarHBondContact O-N 2.87Å; I94-C96 VanDerWaalsContact C-N 3.31Å; I94-C96 PolarHBondContact O-N 3.28Å; C96-S98 VanDerWaalsContact C-N 3.34Å; C96-S98 PolarHBondContact SG-O 2.92Å; C96-S98 VanDerWaalsContact SG-O 3.41Å; C96-R107 HydrophobicContact CB-CB 4.3Å; C96-R107 HydrophobicContact CB-CG 4.17Å
97	R	81.4	Confident	86.9	Confident	238 Å²	238	89 Å²	89	90%	0.898	45%	0.453	S	S	*	.			trans	-82.3	-8.9	-178.4	-59.6	-177.9	-174.7	-173.3	0.1	114.3
98	S	81.2	Confident	87.2	Confident	48 Å²	48	87.7 Å²	87.7	34%	0.336	45%	0.449	S	S	.	.			trans	-116.5	128.3	-174.9	175.4	0	0	0	0	110.5	C96 S100 S103	C96-S98 VanDerWaalsContact C-N 3.34Å; C96-S98 PolarHBondContact SG-O 2.92Å; C96-S98 VanDerWaalsContact SG-O 3.41Å; S98-S100 PolarHBondContact O-N 3.22Å; S98-S100 PolarHBondContact OG-N 3.47Å; S98-S103 PolarHBondContact OG-OG 3.27Å
99	C	77.1	Confident	87.5	Confident	101 Å²	101	90 Å²	90	68%	0.682	45%	0.453	S	S	*	.			trans	-77.7	6.8	175.4	-58	0	0	0	0	113.1
100	S	85.8	Confident	87.7	Confident	51 Å²	51	86.8 Å²	86.8	36%	0.357	44%	0.443	S	S	.	.			trans	-72.4	133	177.4	96.4	0	0	0	0	110.4	S98 H102 S103 I104	S98-S100 PolarHBondContact O-N 3.22Å; S98-S100 PolarHBondContact OG-N 3.47Å; S100-H102 PolarHBondContact O-N 2.86Å; S100-H102 VanDerWaalsContact O-N 3.13Å; S100-S103 PolarHBondContact O-N 3.46Å; S100-S103 WeakPolarHBondContact OG-CB 3.35Å; S100-S103 PolarHBondContact OG-N 3.34Å; S100-S103 VanDerWaalsContact OG-N 3.13Å; S100-S103 PolarHBondContact OG-OG 3.49Å; S100-I104 WeakPolarHBondContact O-CG1 3.37Å; S100-I104 PolarHBondContact O-N 2.85Å
101	I	88.3	Confident	87.9	Confident	149 Å²	149	82.3 Å²	82.3	76%	0.764	44%	0.435	S	S	*	.	H	α-helix	trans	-53.9	-38.4	-178.8	-63.4	170.8	0	0	0	111.3	I104 K105	I101-I104 PolarHBondContact O-N 3.4Å; I101-K105 VanDerWaalsContact O-CB 3.31Å; I101-K105 WeakPolarHBondContact O-CB 3.31Å; I101-K105 PolarHBondContact O-N 3.12Å
102	H	90.6	Very high	88.2	Confident	126 Å²	126	85.9 Å²	85.9	58%	0.583	45%	0.45	S	S	*	.	H	α-helix	trans	-65.9	-44.7	178.6	-172.7	67.3	0	0	0	112.2	S100 I104 K105 N106	S100-H102 PolarHBondContact O-N 2.86Å; S100-H102 VanDerWaalsContact O-N 3.13Å; H102-I104 VanDerWaalsContact C-N 3.34Å; H102-I104 PolarHBondContact O-N 3.45Å; H102-K105 PolarHBondContact O-N 3.01Å; H102-N106 PolarHBondContact CD2-ND2 2.84Å; H102-N106 PolarHBondContact CE1-ND2 3.49Å; H102-N106 PolarHBondContact NE2-ND2 2.85Å; H102-N106 WeakPolarHBondContact O-CB 3.38Å; H102-N106 PolarHBondContact O-N 3.46Å; H102-N106 PolarHBondContact O-ND2 3.29Å; H102-N106 PolarHBondContact O-OD1 3.48Å
103	S	88.5	Confident	88.6	Confident	39 Å²	39	87.9 Å²	87.9	27%	0.273	45%	0.45	S	S	.	.	H	α-helix	trans	-61.5	-42.9	176	-59.3	0	0	0	0	111.8	S98 S100 N106 R107	S98-S103 PolarHBondContact OG-OG 3.27Å; S100-S103 PolarHBondContact O-N 3.46Å; S100-S103 WeakPolarHBondContact OG-CB 3.35Å; S100-S103 PolarHBondContact OG-N 3.34Å; S100-S103 VanDerWaalsContact OG-N 3.13Å; S100-S103 PolarHBondContact OG-OG 3.49Å; S103-N106 PolarHBondContact O-N 3.45Å; S103-R107 WeakPolarHBondContact O-CB 3.37Å; S103-R107 PolarHBondContact O-N 2.86Å
104	I	89.1	Confident	88.9	Confident	39 Å²	39	89.3 Å²	89.3	20%	0.2	45%	0.451	C	S	.	.	H	α-helix	trans	-63.1	-50.3	178	-60.1	171.3	0	0	0	109.9	L91 S100 I101 H102 N106 R107 V108	L91-I104 HydrophobicContact CD1-CD1 4.5Å; L91-I104 HydrophobicContact CD2-CB 4.4Å; L91-I104 HydrophobicContact CD2-CD1 3.63Å; L91-I104 HydrophobicContact CD2-CG1 3.47Å; L91-I104 VanDerWaalsContact CD2-CG1 3.47Å; L91-I104 HydrophobicContact CD2-CG2 4.16Å; S100-I104 WeakPolarHBondContact O-CG1 3.37Å; S100-I104 PolarHBondContact O-N 2.85Å; I101-I104 PolarHBondContact O-N 3.4Å; H102-I104 VanDerWaalsContact C-N 3.34Å; H102-I104 PolarHBondContact O-N 3.45Å; I104-N106 VanDerWaalsContact C-N 3.34Å; I104-N106 PolarHBondContact O-N 3.48Å; I104-R107 PolarHBondContact O-N 3.35Å; I104-V108 HydrophobicContact CG2-CG2 4.25Å; I104-V108 WeakPolarHBondContact O-CB 3.36Å; I104-V108 VanDerWaalsContact O-CG2 3.29Å; I104-V108 WeakPolarHBondContact O-CG2 3.24Å; I104-V108 PolarHBondContact O-N 3.32Å
105	K	91.2	Very high	89.3	Confident	132 Å²	132	92.2 Å²	92.2	57%	0.574	46%	0.464	S	S	*	.	H	α-helix	trans	-56.2	-48.8	178.5	-177.5	-177.9	177.1	-177.3	0	111.4	I101 H102 R107 V108 L109	I101-K105 VanDerWaalsContact O-CB 3.31Å; I101-K105 WeakPolarHBondContact O-CB 3.31Å; I101-K105 PolarHBondContact O-N 3.12Å; H102-K105 PolarHBondContact O-N 3.01Å; K105-R107 VanDerWaalsContact C-N 3.32Å; K105-R107 PolarHBondContact O-N 3.25Å; K105-V108 PolarHBondContact O-N 3.48Å; K105-L109 HydrophobicContact CG-CD1 4.09Å; K105-L109 WeakPolarHBondContact O-CB 3.49Å; K105-L109 VanDerWaalsContact O-CG 3.3Å; K105-L109 WeakPolarHBondContact O-CG 3.38Å; K105-L109 PolarHBondContact O-N 3.23Å
106	N	92.2	Very high	89.9	Confident	72 Å²	72	90.9 Å²	90.9	39%	0.385	46%	0.457	S	S	.	.	H	α-helix	trans	-64.4	-38.8	-179.2	-66.8	-7.8	0	0	0	111.7	H102 S103 I104 L109 A110	H102-N106 PolarHBondContact CD2-ND2 2.84Å; H102-N106 PolarHBondContact CE1-ND2 3.49Å; H102-N106 PolarHBondContact NE2-ND2 2.85Å; H102-N106 WeakPolarHBondContact O-CB 3.38Å; H102-N106 PolarHBondContact O-N 3.46Å; H102-N106 PolarHBondContact O-ND2 3.29Å; H102-N106 PolarHBondContact O-OD1 3.48Å; S103-N106 PolarHBondContact O-N 3.45Å; I104-N106 VanDerWaalsContact C-N 3.34Å; I104-N106 PolarHBondContact O-N 3.48Å; N106-L109 PolarHBondContact O-N 2.93Å; N106-A110 WeakPolarHBondContact O-CB 3.39Å; N106-A110 PolarHBondContact O-N 2.89Å
107	R	91	Very high	90.5	Very high	103 Å²	103	94 Å²	94	39%	0.389	47%	0.472	S	S	.	.	H	α-helix	trans	-71.3	-39.1	179.1	-165.5	65.4	168.2	166.5	-7	112.2	I94 D95 C96 S103 I104 K105 A110 S111	I94-R107 HydrophobicContact CG2-CB 3.8Å; I94-R107 HydrophobicContact CG2-CG 3.31Å; I94-R107 WeakPolarHBondContact O-CG 3.27Å; I94-R107 PolarHBondContact O-NE 2.96Å; D95-R107 PolarHBondContact O-NE 3.3Å; D95-R107 IonicContact OD2-CZ 3.55Å; D95-R107 IonicContact OD2-NH2 3.97Å; D95-R107 PolarHBondContact OD2-NH2 2.93Å; C96-R107 HydrophobicContact CB-CB 4.3Å; C96-R107 HydrophobicContact CB-CG 4.17Å; S103-R107 WeakPolarHBondContact O-CB 3.37Å; S103-R107 PolarHBondContact O-N 2.86Å; I104-R107 PolarHBondContact O-N 3.35Å; K105-R107 VanDerWaalsContact C-N 3.32Å; K105-R107 PolarHBondContact O-N 3.25Å; R107-A110 PolarHBondContact O-N 3.49Å; R107-S111 WeakPolarHBondContact O-CB 3.49Å; R107-S111 PolarHBondContact O-N 3.16Å
108	V	91.3	Very high	91.2	Very high	64 Å²	64	86.1 Å²	86.1	39%	0.388	45%	0.448	S	S	.	.	H	α-helix	trans	-60.8	-46.2	171.8	170.1	0	0	0	0	110.6	I94 I104 K105 S111 K112	I94-V108 HydrophobicContact CD1-CG2 3.67Å; I94-V108 HydrophobicContact CG2-CG2 4.29Å; I104-V108 HydrophobicContact CG2-CG2 4.25Å; I104-V108 WeakPolarHBondContact O-CB 3.36Å; I104-V108 VanDerWaalsContact O-CG2 3.29Å; I104-V108 WeakPolarHBondContact O-CG2 3.24Å; I104-V108 PolarHBondContact O-N 3.32Å; K105-V108 PolarHBondContact O-N 3.48Å; V108-S111 PolarHBondContact O-N 2.93Å; V108-K112 WeakPolarHBondContact O-CB 3.44Å; V108-K112 PolarHBondContact O-N 3.34Å
109	L	94	Very high	92	Very high	98 Å²	98	89.2 Å²	89.2	51%	0.513	46%	0.457	S	S	.	.	H	α-helix	trans	-61.6	-46.7	176.9	-73.4	172.3	0	0	0	111.7	K105 N106 S111 K112 E113	K105-L109 HydrophobicContact CG-CD1 4.09Å; K105-L109 WeakPolarHBondContact O-CB 3.49Å; K105-L109 VanDerWaalsContact O-CG 3.3Å; K105-L109 WeakPolarHBondContact O-CG 3.38Å; K105-L109 PolarHBondContact O-N 3.23Å; N106-L109 PolarHBondContact O-N 2.93Å; L109-S111 VanDerWaalsContact C-N 3.33Å; L109-S111 PolarHBondContact O-N 3.43Å; L109-K112 PolarHBondContact O-N 2.89Å; L109-K112 VanDerWaalsContact O-N 3.16Å; L109-E113 WeakPolarHBondContact O-CB 3.28Å; L109-E113 PolarHBondContact O-N 3.39Å
110	A	92.6	Very high	92.9	Very high	43 Å²	43	88.4 Å²	88.4	36%	0.355	45%	0.449	S	S	.	.	H	α-helix	trans	-62.7	-39.4	177.1	0	0	0	0	0	112.3	N106 R107 K112 Y114	N106-A110 WeakPolarHBondContact O-CB 3.39Å; N106-A110 PolarHBondContact O-N 2.89Å; R107-A110 PolarHBondContact O-N 3.49Å; A110-K112 VanDerWaalsContact C-N 3.34Å; A110-Y114 WeakPolarHBondContact O-CB 3.37Å; A110-Y114 PolarHBondContact O-N 2.88Å
111	S	91.6	Very high	93.5	Very high	59 Å²	59	91.3 Å²	91.3	41%	0.413	46%	0.46	S	S	.	.	H	α-helix	trans	-65.4	-38	174.4	-173.2	0	0	0	0	111.8	R107 V108 L109 Y114 Q115	R107-S111 WeakPolarHBondContact O-CB 3.49Å; R107-S111 PolarHBondContact O-N 3.16Å; V108-S111 PolarHBondContact O-N 2.93Å; L109-S111 VanDerWaalsContact C-N 3.33Å; L109-S111 PolarHBondContact O-N 3.43Å; S111-Y114 PolarHBondContact O-N 2.92Å; S111-Q115 WeakPolarHBondContact O-CB 3.05Å; S111-Q115 PolarHBondContact O-N 3.12Å
112	K	93.6	Very high	93.9	Very high	91 Å²	91	88 Å²	88	40%	0.396	45%	0.446	S	S	.	.	H	α-helix	trans	-69.8	-44.4	177.3	-179.4	53	-179.8	156.2	0	111.4	V108 L109 A110 Y114 Q115 D116	V108-K112 WeakPolarHBondContact O-CB 3.44Å; V108-K112 PolarHBondContact O-N 3.34Å; L109-K112 PolarHBondContact O-N 2.89Å; L109-K112 VanDerWaalsContact O-N 3.16Å; A110-K112 VanDerWaalsContact C-N 3.34Å; K112-Y114 VanDerWaalsContact C-N 3.3Å; K112-Y114 PolarHBondContact O-N 3.23Å; K112-Q115 WeakPolarHBondContact O-CB 3.41Å; K112-Q115 PolarHBondContact O-N 3.44Å; K112-Q115 VanDerWaalsContact O-N 3.13Å; K112-D116 WeakPolarHBondContact CE-OD1 3.43Å; K112-D116 WeakPolarHBondContact CE-OD2 3.37Å; K112-D116 IonicContact NZ-OD1 3.99Å; K112-D116 PolarHBondContact NZ-OD1 3.34Å; K112-D116 IonicContact NZ-OD2 2.79Å; K112-D116 VanDerWaalsContact O-CG 3.23Å; K112-D116 PolarHBondContact O-N 2.71Å
113	E	95.7	Very high	94.2	Very high	122 Å²	122	85.4 Å²	85.4	57%	0.57	44%	0.44	S	S	*	.	H	α-helix	trans	-58.9	-42.8	173.2	-176.4	-178.5	-179.4	0	0	111.3	L109 Q115 D116 N117	L109-E113 WeakPolarHBondContact O-CB 3.28Å; L109-E113 PolarHBondContact O-N 3.39Å; E113-Q115 PolarHBondContact O-N 2.84Å; E113-D116 PolarHBondContact O-N 2.8Å; E113-N117 VanDerWaalsContact O-CB 3.31Å; E113-N117 WeakPolarHBondContact O-CB 3.28Å; E113-N117 PolarHBondContact O-N 3.01Å; E113-N117 PolarHBondContact O-ND2 3.41Å
114	Y	94.5	Very high	94.6	Very high	152 Å²	152	87 Å²	87	60%	0.596	45%	0.45	S	S	*	.	H	α-helix	trans	-62.1	-42.1	174.2	-177.3	-103.9	0	0	0	112.3	A110 S111 K112 N117 L118	A110-Y114 WeakPolarHBondContact O-CB 3.37Å; A110-Y114 PolarHBondContact O-N 2.88Å; S111-Y114 PolarHBondContact O-N 2.92Å; K112-Y114 VanDerWaalsContact C-N 3.3Å; K112-Y114 PolarHBondContact O-N 3.23Å; Y114-N117 PolarHBondContact O-N 2.93Å; Y114-L118 HydrophobicContact CD1-CD1 3.82Å; Y114-L118 HydrophobicContact CD1-CG 4.37Å; Y114-L118 HydrophobicContact CE1-CD1 3.25Å; Y114-L118 HydrophobicContact CE1-CG 3.97Å; Y114-L118 HydrophobicContact CE2-CG 4.42Å; Y114-L118 WeakPolarHBondContact O-CB 3.46Å; Y114-L118 WeakPolarHBondContact O-CG 3.48Å; Y114-L118 PolarHBondContact O-N 3.05Å
115	Q	95.3	Very high	95	Very high	106 Å²	106	90.9 Å²	90.9	50%	0.495	47%	0.471	S	S	.	.	H	α-helix	trans	-62.7	-44.8	175.2	-176.8	-179.3	-5.2	0	0	111.8	S111 K112 E113 N117 L118 E119	S111-Q115 WeakPolarHBondContact O-CB 3.05Å; S111-Q115 PolarHBondContact O-N 3.12Å; K112-Q115 WeakPolarHBondContact O-CB 3.41Å; K112-Q115 PolarHBondContact O-N 3.44Å; K112-Q115 VanDerWaalsContact O-N 3.13Å; E113-Q115 PolarHBondContact O-N 2.84Å; Q115-N117 VanDerWaalsContact C-N 3.35Å; Q115-L118 PolarHBondContact O-N 3.03Å; Q115-E119 WeakPolarHBondContact O-CB 3.45Å; Q115-E119 PolarHBondContact O-N 3.48Å
116	D	97	Very high	95.3	Very high	60 Å²	60	89.8 Å²	89.8	32%	0.321	47%	0.468	S	S	.	.	H	α-helix	trans	-65.7	-39.5	178.9	-65.8	-18.7	0	0	0	111	K112 E113 E119 T120	K112-D116 WeakPolarHBondContact CE-OD1 3.43Å; K112-D116 WeakPolarHBondContact CE-OD2 3.37Å; K112-D116 IonicContact NZ-OD1 3.99Å; K112-D116 PolarHBondContact NZ-OD1 3.34Å; K112-D116 IonicContact NZ-OD2 2.79Å; K112-D116 VanDerWaalsContact O-CG 3.23Å; K112-D116 PolarHBondContact O-N 2.71Å; E113-D116 PolarHBondContact O-N 2.8Å; D116-E119 PolarHBondContact O-N 2.85Å; D116-T120 VanDerWaalsContact O-CG2 3.31Å; D116-T120 WeakPolarHBondContact O-CG2 3.12Å; D116-T120 PolarHBondContact O-N 3.37Å; D116-T120 PolarHBondContact O-OG1 2.83Å
117	N	97.3	Very high	95.5	Very high	81 Å²	81	89.7 Å²	89.7	43%	0.433	47%	0.473	S	S	.	.	H	α-helix	trans	-64.4	-40.8	173.7	-73.2	-23.4	0	0	0	111.9	E113 Y114 Q115 T120 L121	E113-N117 VanDerWaalsContact O-CB 3.31Å; E113-N117 WeakPolarHBondContact O-CB 3.28Å; E113-N117 PolarHBondContact O-N 3.01Å; E113-N117 PolarHBondContact O-ND2 3.41Å; Y114-N117 PolarHBondContact O-N 2.93Å; Q115-N117 VanDerWaalsContact C-N 3.35Å; N117-T120 WeakPolarHBondContact CA-OG1 3.27Å; N117-T120 PolarHBondContact O-OG1 2.9Å; N117-L121 WeakPolarHBondContact O-CB 3.46Å; N117-L121 VanDerWaalsContact O-CG 3.24Å; N117-L121 WeakPolarHBondContact O-CG 3.34Å; N117-L121 PolarHBondContact O-N 2.89Å
118	L	97.2	Very high	95.8	Very high	73 Å²	73	87.4 Å²	87.4	38%	0.382	47%	0.473	S	S	.	.	H	α-helix	trans	-65.2	-42.2	174.1	-77.9	178.9	0	0	0	111.8	Y114 Q115 L121 V122	Y114-L118 HydrophobicContact CD1-CD1 3.82Å; Y114-L118 HydrophobicContact CD1-CG 4.37Å; Y114-L118 HydrophobicContact CE1-CD1 3.25Å; Y114-L118 HydrophobicContact CE1-CG 3.97Å; Y114-L118 HydrophobicContact CE2-CG 4.42Å; Y114-L118 WeakPolarHBondContact O-CB 3.46Å; Y114-L118 WeakPolarHBondContact O-CG 3.48Å; Y114-L118 PolarHBondContact O-N 3.05Å; Q115-L118 PolarHBondContact O-N 3.03Å; L118-L121 PolarHBondContact O-N 3.08Å; L118-V122 VanDerWaalsContact O-CG2 3.3Å; L118-V122 WeakPolarHBondContact O-CG2 3.16Å; L118-V122 PolarHBondContact O-N 3.2Å
119	E	97.3	Very high	96.1	Very high	113 Å²	113	91.3 Å²	91.3	53%	0.528	48%	0.481	S	S	.	.	H	α-helix	trans	-63.3	-42.3	178.1	-171.8	170.8	-178.5	0	0	111.7	Q115 D116 V122 T123	Q115-E119 WeakPolarHBondContact O-CB 3.45Å; Q115-E119 PolarHBondContact O-N 3.48Å; D116-E119 PolarHBondContact O-N 2.85Å; E119-V122 PolarHBondContact O-N 3.47Å; E119-T123 WeakPolarHBondContact O-CG2 3.28Å; E119-T123 PolarHBondContact O-N 3.49Å; E119-T123 PolarHBondContact O-OG1 3.03Å
120	T	97	Very high	96.3	Very high	83 Å²	83	90.8 Å²	90.8	51%	0.509	48%	0.479	S	S	.	.	H	α-helix	trans	-66.3	-35.9	174.4	53.4	0	0	0	0	112.8	D116 N117 T123 S124	D116-T120 VanDerWaalsContact O-CG2 3.31Å; D116-T120 WeakPolarHBondContact O-CG2 3.12Å; D116-T120 PolarHBondContact O-N 3.37Å; D116-T120 PolarHBondContact O-OG1 2.83Å; N117-T120 WeakPolarHBondContact CA-OG1 3.27Å; N117-T120 PolarHBondContact O-OG1 2.9Å; T120-T123 VanDerWaalsContact CA-OG1 3.32Å; T120-T123 WeakPolarHBondContact CA-OG1 3.24Å; T120-T123 PolarHBondContact O-OG1 3.41Å; T120-S124 VanDerWaalsContact O-CB 3.24Å; T120-S124 WeakPolarHBondContact O-CB 3.4Å; T120-S124 PolarHBondContact O-N 3.11Å
121	L	97.5	Very high	96.5	Very high	113 Å²	113	91.5 Å²	91.5	59%	0.592	48%	0.481	S	S	*	.	H	α-helix	trans	-68.3	-41.9	173.7	-75.1	170.9	0	0	0	112.4	N117 L118 S124 L125	N117-L121 WeakPolarHBondContact O-CB 3.46Å; N117-L121 VanDerWaalsContact O-CG 3.24Å; N117-L121 WeakPolarHBondContact O-CG 3.34Å; N117-L121 PolarHBondContact O-N 2.89Å; L118-L121 PolarHBondContact O-N 3.08Å; L121-S124 PolarHBondContact O-N 2.96Å; L121-L125 WeakPolarHBondContact O-CB 3.47Å; L121-L125 PolarHBondContact O-N 3.37Å
122	V	97.6	Very high	96.8	Very high	79 Å²	79	93.3 Å²	93.3	48%	0.479	49%	0.486	S	S	.	.	H	α-helix	trans	-63.2	-48.4	177.1	168.8	0	0	0	0	110.4	L118 E119 S124 L125 E126	L118-V122 VanDerWaalsContact O-CG2 3.3Å; L118-V122 WeakPolarHBondContact O-CG2 3.16Å; L118-V122 PolarHBondContact O-N 3.2Å; E119-V122 PolarHBondContact O-N 3.47Å; V122-S124 VanDerWaalsContact C-N 3.33Å; V122-S124 PolarHBondContact O-N 2.99Å; V122-L125 PolarHBondContact O-N 3.18Å; V122-L125 VanDerWaalsContact O-N 3.15Å; V122-E126 HydrophobicContact CG1-CG 4.43Å; V122-E126 WeakPolarHBondContact O-CG 3.33Å; V122-E126 PolarHBondContact O-N 3.16Å
123	T	96.9	Very high	97	Very high	72 Å²	72	94 Å²	94	44%	0.442	49%	0.489	S	S	.	.	H	α-helix	trans	-62.7	-38.6	177.6	50.5	0	0	0	0	112.3	E119 T120 E126 S127	E119-T123 WeakPolarHBondContact O-CG2 3.28Å; E119-T123 PolarHBondContact O-N 3.49Å; E119-T123 PolarHBondContact O-OG1 3.03Å; T120-T123 VanDerWaalsContact CA-OG1 3.32Å; T120-T123 WeakPolarHBondContact CA-OG1 3.24Å; T120-T123 PolarHBondContact O-OG1 3.41Å; T123-E126 PolarHBondContact O-N 2.89Å; T123-S127 WeakPolarHBondContact O-CB 3.17Å; T123-S127 PolarHBondContact O-N 3.31Å
124	S	97	Very high	97	Very high	71 Å²	71	91.6 Å²	91.6	50%	0.497	48%	0.483	S	S	.	.	H	α-helix	trans	-62.5	-44.9	172.3	-179.9	0	0	0	0	111.9	T120 L121 V122 S127 S128	T120-S124 VanDerWaalsContact O-CB 3.24Å; T120-S124 WeakPolarHBondContact O-CB 3.4Å; T120-S124 PolarHBondContact O-N 3.11Å; L121-S124 PolarHBondContact O-N 2.96Å; V122-S124 VanDerWaalsContact C-N 3.33Å; V122-S124 PolarHBondContact O-N 2.99Å; S124-S127 PolarHBondContact O-N 2.82Å; S124-S127 PolarHBondContact O-OG 3.39Å; S124-S128 PolarHBondContact O-N 2.79Å
125	L	97.5	Very high	97.2	Very high	121 Å²	121	88.5 Å²	88.5	63%	0.634	48%	0.476	S	S	*	.	H	α-helix	trans	-64.4	-41.5	177.3	-177.8	61.2	0	0	0	112	L121 V122 S127 S128 Y129	L121-L125 WeakPolarHBondContact O-CB 3.47Å; L121-L125 PolarHBondContact O-N 3.37Å; V122-L125 PolarHBondContact O-N 3.18Å; V122-L125 VanDerWaalsContact O-N 3.15Å; L125-S127 VanDerWaalsContact C-N 3.32Å; L125-S127 PolarHBondContact O-N 3.46Å; L125-S128 PolarHBondContact O-N 2.92Å; L125-Y129 WeakPolarHBondContact O-CB 3.41Å; L125-Y129 PolarHBondContact O-N 2.93Å
126	E	97.7	Very high	97.3	Very high	110 Å²	110	88.1 Å²	88.1	51%	0.514	48%	0.476	S	S	.	.	H	α-helix	trans	-60.6	-41.5	173.6	-74.6	176	168.1	0	0	111.5	V122 T123 S128 Y129 N130	V122-E126 HydrophobicContact CG1-CG 4.43Å; V122-E126 WeakPolarHBondContact O-CG 3.33Å; V122-E126 PolarHBondContact O-N 3.16Å; T123-E126 PolarHBondContact O-N 2.89Å; E126-S128 PolarHBondContact O-N 2.9Å; E126-Y129 PolarHBondContact O-N 3.34Å; E126-N130 WeakPolarHBondContact O-CB 3.37Å; E126-N130 VanDerWaalsContact O-CG 3.26Å; E126-N130 PolarHBondContact O-N 3.48Å; E126-N130 PolarHBondContact O-ND2 2.83Å; E126-N130 VanDerWaalsContact O-ND2 3.07Å
127	S	96.6	Very high	97.2	Very high	70 Å²	70	90.5 Å²	90.5	49%	0.49	49%	0.487	S	S	.	.	H	α-helix	trans	-63.4	-40.8	176.2	80	0	0	0	0	112.2	T123 S124 L125 N130 S131	T123-S127 WeakPolarHBondContact O-CB 3.17Å; T123-S127 PolarHBondContact O-N 3.31Å; S124-S127 PolarHBondContact O-N 2.82Å; S124-S127 PolarHBondContact O-OG 3.39Å; L125-S127 VanDerWaalsContact C-N 3.32Å; L125-S127 PolarHBondContact O-N 3.46Å; S127-N130 PolarHBondContact O-N 2.87Å; S127-S131 PolarHBondContact O-N 2.7Å
128	S	96.9	Very high	97.2	Very high	54 Å²	54	92.4 Å²	92.4	38%	0.378	49%	0.493	S	S	.	.	H	α-helix	trans	-68.5	-41.1	175.5	-175	0	0	0	0	112.2	S124 L125 E126 N130 S131 L132	S124-S128 PolarHBondContact O-N 2.79Å; L125-S128 PolarHBondContact O-N 2.92Å; E126-S128 PolarHBondContact O-N 2.9Å; S128-N130 VanDerWaalsContact C-N 3.32Å; S128-N130 PolarHBondContact O-N 2.82Å; S128-S131 PolarHBondContact O-N 2.97Å; S128-S131 PolarHBondContact O-OG 3.22Å; S128-L132 WeakPolarHBondContact O-CB 3.48Å; S128-L132 WeakPolarHBondContact O-CG 3.22Å; S128-L132 PolarHBondContact O-N 3.32Å
129	Y	97.7	Very high	97.2	Very high	147 Å²	147	93 Å²	93	58%	0.576	50%	0.499	S	S	*	.	H	α-helix	trans	-60.7	-44	174.3	174.6	-98.4	0	0	0	111.2	L125 E126 L132 K133	L125-Y129 WeakPolarHBondContact O-CB 3.41Å; L125-Y129 PolarHBondContact O-N 2.93Å; E126-Y129 PolarHBondContact O-N 3.34Å; Y129-L132 PolarHBondContact O-N 3.49Å; Y129-K133 HydrophobicContact CE1-CD 4.45Å; Y129-K133 WeakPolarHBondContact O-CB 3.31Å; Y129-K133 PolarHBondContact O-N 2.85Å
130	N	97.5	Very high	97.2	Very high	87 Å²	87	91.8 Å²	91.8	47%	0.465	49%	0.494	S	S	.	.	H	α-helix	trans	-65.7	-39.6	177.5	-73.8	-35.8	0	0	0	112.3	E126 S127 S128 K133 T134	E126-N130 WeakPolarHBondContact O-CB 3.37Å; E126-N130 VanDerWaalsContact O-CG 3.26Å; E126-N130 PolarHBondContact O-N 3.48Å; E126-N130 PolarHBondContact O-ND2 2.83Å; E126-N130 VanDerWaalsContact O-ND2 3.07Å; S127-N130 PolarHBondContact O-N 2.87Å; S128-N130 VanDerWaalsContact C-N 3.32Å; S128-N130 PolarHBondContact O-N 2.82Å; N130-K133 PolarHBondContact O-N 3.16Å; N130-T134 PolarHBondContact O-N 3.41Å; N130-T134 PolarHBondContact O-OG1 3.2Å; N130-T134 VanDerWaalsContact O-OG1 3.05Å
131	S	97.3	Very high	97.1	Very high	57 Å²	57	91.8 Å²	91.8	40%	0.399	49%	0.488	S	S	.	.	H	α-helix	trans	-66.6	-43.2	176.6	69.4	0	0	0	0	111.9	S127 S128 K133 T134 I135	S127-S131 PolarHBondContact O-N 2.7Å; S128-S131 PolarHBondContact O-N 2.97Å; S128-S131 PolarHBondContact O-OG 3.22Å; S131-K133 VanDerWaalsContact C-N 3.33Å; S131-K133 PolarHBondContact O-N 2.9Å; S131-T134 PolarHBondContact O-N 3.35Å; S131-I135 WeakPolarHBondContact O-CG1 3.48Å; S131-I135 PolarHBondContact O-N 2.86Å
132	L	97.8	Very high	97	Very high	97 Å²	97	92.1 Å²	92.1	51%	0.508	49%	0.488	S	S	.	.	H	α-helix	trans	-61	-41.6	174	-73.9	171.4	0	0	0	111.8	S128 Y129 T134 I135 I136	S128-L132 WeakPolarHBondContact O-CB 3.48Å; S128-L132 WeakPolarHBondContact O-CG 3.22Å; S128-L132 PolarHBondContact O-N 3.32Å; Y129-L132 PolarHBondContact O-N 3.49Å; L132-T134 VanDerWaalsContact C-N 3.35Å; L132-T134 PolarHBondContact O-N 3.46Å; L132-I135 PolarHBondContact O-N 2.93Å; L132-I136 WeakPolarHBondContact O-CG1 3.33Å; L132-I136 PolarHBondContact O-N 3.41Å
133	K	97.6	Very high	96.9	Very high	106 Å²	106	94.2 Å²	94.2	46%	0.461	49%	0.492	S	S	.	.	H	α-helix	trans	-60.6	-43.5	175.2	-175.9	179.3	178.2	-179	0	111.8	Y129 N130 S131 I136 M137	Y129-K133 HydrophobicContact CE1-CD 4.45Å; Y129-K133 WeakPolarHBondContact O-CB 3.31Å; Y129-K133 PolarHBondContact O-N 2.85Å; N130-K133 PolarHBondContact O-N 3.16Å; S131-K133 VanDerWaalsContact C-N 3.33Å; S131-K133 PolarHBondContact O-N 2.9Å; K133-I136 PolarHBondContact O-N 3.38Å; K133-M137 WeakPolarHBondContact O-CG 3.49Å; K133-M137 PolarHBondContact O-N 3.24Å
134	T	96.8	Very high	96.7	Very high	72 Å²	72	96.9 Å²	96.9	44%	0.442	49%	0.494	S	S	.	.	H	α-helix	trans	-61.8	-44.7	175.2	-58.4	0	0	0	0	111.4	N130 S131 L132 I136 M137 E138	N130-T134 PolarHBondContact O-N 3.41Å; N130-T134 PolarHBondContact O-OG1 3.2Å; N130-T134 VanDerWaalsContact O-OG1 3.05Å; S131-T134 PolarHBondContact O-N 3.35Å; L132-T134 VanDerWaalsContact C-N 3.35Å; L132-T134 PolarHBondContact O-N 3.46Å; T134-I136 VanDerWaalsContact C-N 3.34Å; T134-I136 PolarHBondContact O-N 2.89Å; T134-M137 WeakPolarHBondContact O-CB 3.34Å; T134-M137 PolarHBondContact O-N 2.82Å; T134-M137 VanDerWaalsContact O-N 3.16Å; T134-E138 WeakPolarHBondContact O-CG 3.46Å; T134-E138 PolarHBondContact O-N 2.91Å
135	I	97	Very high	96.5	Very high	87 Å²	87	96.9 Å²	96.9	45%	0.446	49%	0.489	S	S	.	.	H	α-helix	trans	-61	-43.2	177	-67.5	165.2	0	0	0	111	S131 L132 M137 E138 V139	S131-I135 WeakPolarHBondContact O-CG1 3.48Å; S131-I135 PolarHBondContact O-N 2.86Å; L132-I135 PolarHBondContact O-N 2.93Å; I135-M137 VanDerWaalsContact C-N 3.31Å; I135-M137 PolarHBondContact O-N 2.95Å; I135-E138 PolarHBondContact O-N 3.43Å; I135-V139 HydrophobicContact CG2-CG2 4.34Å; I135-V139 WeakPolarHBondContact O-CG2 3.36Å; I135-V139 PolarHBondContact O-N 3.05Å
136	I	97.4	Very high	96.2	Very high	97 Å²	97	96.3 Å²	96.3	50%	0.497	49%	0.485	S	S	.	.	H	α-helix	trans	-58.3	-46.5	175.6	-71.8	161	0	0	0	110.2	L132 K133 T134 E138 V139 E140	L132-I136 WeakPolarHBondContact O-CG1 3.33Å; L132-I136 PolarHBondContact O-N 3.41Å; K133-I136 PolarHBondContact O-N 3.38Å; T134-I136 VanDerWaalsContact C-N 3.34Å; T134-I136 PolarHBondContact O-N 2.89Å; I136-E138 VanDerWaalsContact C-N 3.34Å; I136-E138 PolarHBondContact O-N 3.04Å; I136-V139 PolarHBondContact O-N 3.43Å; I136-E140 HydrophobicContact CG2-CG 4.36Å; I136-E140 WeakPolarHBondContact O-CB 3.38Å; I136-E140 WeakPolarHBondContact O-CG 3.47Å; I136-E140 PolarHBondContact O-N 3.49Å
137	M	96.3	Very high	95.9	Very high	111 Å²	111	94.5 Å²	94.5	55%	0.547	48%	0.482	S	S	.	.	H	α-helix	trans	-62.1	-38.9	177.7	-69.8	175.9	58.3	0	0	112.9	K133 T134 I135 E141	K133-M137 WeakPolarHBondContact O-CG 3.49Å; K133-M137 PolarHBondContact O-N 3.24Å; T134-M137 WeakPolarHBondContact O-CB 3.34Å; T134-M137 PolarHBondContact O-N 2.82Å; T134-M137 VanDerWaalsContact O-N 3.16Å; I135-M137 VanDerWaalsContact C-N 3.31Å; I135-M137 PolarHBondContact O-N 2.95Å; M137-E141 WeakPolarHBondContact O-CB 3.44Å; M137-E141 PolarHBondContact O-N 3.27Å
138	E	97.2	Very high	95.5	Very high	121 Å²	121	100.3 Å²	100.3	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-65.7	-41.7	175.8	-73	175.2	-175.5	0	0	112.1	T134 I135 I136 E141 M142	T134-E138 WeakPolarHBondContact O-CG 3.46Å; T134-E138 PolarHBondContact O-N 2.91Å; I135-E138 PolarHBondContact O-N 3.43Å; I136-E138 VanDerWaalsContact C-N 3.34Å; I136-E138 PolarHBondContact O-N 3.04Å; E138-E141 PolarHBondContact O-N 3.35Å; E138-M142 WeakPolarHBondContact O-CB 3.33Å; E138-M142 PolarHBondContact O-N 2.91Å
139	V	96.3	Very high	94.9	Very high	85 Å²	85	103.9 Å²	103.9	52%	0.515	50%	0.502	S	S	.	.	H	α-helix	trans	-66.6	-43.9	176.7	171.8	0	0	0	0	110.8	I135 I136 E141 M142 E143	I135-V139 HydrophobicContact CG2-CG2 4.34Å; I135-V139 WeakPolarHBondContact O-CG2 3.36Å; I135-V139 PolarHBondContact O-N 3.05Å; I136-V139 PolarHBondContact O-N 3.43Å; V139-E141 VanDerWaalsContact C-N 3.29Å; V139-E141 PolarHBondContact O-N 2.9Å; V139-M142 WeakPolarHBondContact O-CB 3.45Å; V139-M142 PolarHBondContact O-N 3.16Å; V139-E143 WeakPolarHBondContact O-CB 3.33Å; V139-E143 PolarHBondContact O-N 3.23Å
140	E	97.1	Very high	94.2	Very high	88 Å²	88	101 Å²	101	41%	0.411	50%	0.503	S	S	.	.	H	α-helix	trans	-61.8	-37.6	174.6	-73.6	177.7	-179.7	0	0	111.9	I136 E143 R144	I136-E140 HydrophobicContact CG2-CG 4.36Å; I136-E140 WeakPolarHBondContact O-CB 3.38Å; I136-E140 WeakPolarHBondContact O-CG 3.47Å; I136-E140 PolarHBondContact O-N 3.49Å; E140-E143 PolarHBondContact O-N 3Å; E140-R144 WeakPolarHBondContact O-CG 3.35Å; E140-R144 PolarHBondContact O-N 3.28Å; E140-R144 IonicContact OE2-NH1 3.44Å
141	E	96.1	Very high	93.6	Very high	82 Å²	82	102.6 Å²	102.6	38%	0.383	51%	0.512	S	S	.	.	H	α-helix	trans	-67.8	-40.7	174.4	-178.4	54.9	-152.2	0	0	111.7	M137 E138 V139 E143 R144 N145	M137-E141 WeakPolarHBondContact O-CB 3.44Å; M137-E141 PolarHBondContact O-N 3.27Å; E138-E141 PolarHBondContact O-N 3.35Å; V139-E141 VanDerWaalsContact C-N 3.29Å; V139-E141 PolarHBondContact O-N 2.9Å; E141-E143 VanDerWaalsContact C-N 3.34Å; E141-R144 PolarHBondContact O-N 3.45Å; E141-R144 IonicContact OE2-CZ 2.73Å; E141-R144 VanDerWaalsContact OE2-CZ 3.25Å; E141-R144 IonicContact OE2-NE 3.7Å; E141-R144 PolarHBondContact OE2-NE 2.97Å; E141-R144 IonicContact OE2-NH2 3.91Å; E141-R144 PolarHBondContact OE2-NH2 2.99Å; E141-N145 WeakPolarHBondContact O-CB 3.32Å; E141-N145 PolarHBondContact O-N 3.39Å; E141-N145 PolarHBondContact O-ND2 3.02Å; E141-N145 PolarHBondContact OE1-ND2 2.95Å
142	M	95.1	Very high	93	Very high	120 Å²	120	102.8 Å²	102.8	59%	0.591	51%	0.509	S	S	*	.	H	α-helix	trans	-62	-43.6	173.6	-171.3	-178.2	-59.3	0	0	111.2	E138 V139 N145 L146	E138-M142 WeakPolarHBondContact O-CB 3.33Å; E138-M142 PolarHBondContact O-N 2.91Å; V139-M142 WeakPolarHBondContact O-CB 3.45Å; V139-M142 PolarHBondContact O-N 3.16Å; M142-N145 PolarHBondContact O-N 3Å; M142-L146 HydrophobicContact CG-CD1 4.28Å; M142-L146 HydrophobicContact CG-CG 4.49Å; M142-L146 WeakPolarHBondContact O-CB 3.37Å; M142-L146 VanDerWaalsContact O-CG 3.31Å; M142-L146 WeakPolarHBondContact O-CG 3.45Å; M142-L146 PolarHBondContact O-N 3.11Å
143	E	94.6	Very high	92.1	Very high	123 Å²	123	106.9 Å²	106.9	58%	0.575	52%	0.517	S	S	*	.	H	α-helix	trans	-60.1	-48.6	175.5	-174.5	-176.3	173.5	0	0	111	V139 E140 E141 N145 L146 V147	V139-E143 WeakPolarHBondContact O-CB 3.33Å; V139-E143 PolarHBondContact O-N 3.23Å; E140-E143 PolarHBondContact O-N 3Å; E141-E143 VanDerWaalsContact C-N 3.34Å; E143-N145 VanDerWaalsContact C-N 3.27Å; E143-N145 PolarHBondContact O-N 3.36Å; E143-L146 PolarHBondContact O-N 3.3Å; E143-L146 VanDerWaalsContact O-N 3.16Å; E143-V147 HydrophobicContact CG-CG2 4.4Å; E143-V147 WeakPolarHBondContact O-CB 3.4Å; E143-V147 WeakPolarHBondContact O-CG2 3.37Å; E143-V147 PolarHBondContact O-N 3.32Å
144	R	93.7	Very high	90.9	Very high	129 Å²	129	108.8 Å²	108.8	49%	0.487	52%	0.522	S	S	.	.	H	α-helix	trans	-56.4	-43.2	174.7	-77.6	-171.3	-65.4	-89.6	3.7	111.8	E140 E141 V147 R148	E140-R144 WeakPolarHBondContact O-CG 3.35Å; E140-R144 PolarHBondContact O-N 3.28Å; E140-R144 IonicContact OE2-NH1 3.44Å; E141-R144 PolarHBondContact O-N 3.45Å; E141-R144 IonicContact OE2-CZ 2.73Å; E141-R144 VanDerWaalsContact OE2-CZ 3.25Å; E141-R144 IonicContact OE2-NE 3.7Å; E141-R144 PolarHBondContact OE2-NE 2.97Å; E141-R144 IonicContact OE2-NH2 3.91Å; E141-R144 PolarHBondContact OE2-NH2 2.99Å; R144-V147 PolarHBondContact O-N 3.07Å; R144-R148 VanDerWaalsContact O-CB 3.24Å; R144-R148 WeakPolarHBondContact O-CB 3.07Å; R144-R148 PolarHBondContact O-N 3.45Å
145	N	93.2	Very high	89.9	Confident	71 Å²	71	108.9 Å²	108.9	38%	0.38	52%	0.519	S	S	.	.	H	α-helix	trans	-66.4	-39.7	177.9	-76.3	-47.9	0	0	0	112.4	E141 M142 E143 R148 F149	E141-N145 WeakPolarHBondContact O-CB 3.32Å; E141-N145 PolarHBondContact O-N 3.39Å; E141-N145 PolarHBondContact O-ND2 3.02Å; E141-N145 PolarHBondContact OE1-ND2 2.95Å; M142-N145 PolarHBondContact O-N 3Å; E143-N145 VanDerWaalsContact C-N 3.27Å; E143-N145 PolarHBondContact O-N 3.36Å; N145-R148 PolarHBondContact O-N 3.46Å; N145-F149 WeakPolarHBondContact O-CB 3.23Å; N145-F149 PolarHBondContact O-N 2.94Å
146	L	90.3	Very high	89	Confident	108 Å²	108	107.7 Å²	107.7	57%	0.565	52%	0.519	S	S	*	.	H	α-helix	trans	-67.6	-42.1	175.6	-72.2	175.5	0	0	0	112	M142 E143 F149 S150	M142-L146 HydrophobicContact CG-CD1 4.28Å; M142-L146 HydrophobicContact CG-CG 4.49Å; M142-L146 WeakPolarHBondContact O-CB 3.37Å; M142-L146 VanDerWaalsContact O-CG 3.31Å; M142-L146 WeakPolarHBondContact O-CG 3.45Å; M142-L146 PolarHBondContact O-N 3.11Å; E143-L146 PolarHBondContact O-N 3.3Å; E143-L146 VanDerWaalsContact O-N 3.16Å; L146-F149 PolarHBondContact O-N 3.44Å; L146-S150 WeakPolarHBondContact O-CB 3.39Å; L146-S150 PolarHBondContact O-N 2.98Å
147	V	90.7	Very high	88.2	Confident	72 Å²	72	110.6 Å²	110.6	44%	0.436	53%	0.53	S	S	.	.	H	α-helix	trans	-63	-44.9	174.7	170.2	0	0	0	0	110.1	E143 R144 F149 S150 N151	E143-V147 HydrophobicContact CG-CG2 4.4Å; E143-V147 WeakPolarHBondContact O-CB 3.4Å; E143-V147 WeakPolarHBondContact O-CG2 3.37Å; E143-V147 PolarHBondContact O-N 3.32Å; R144-V147 PolarHBondContact O-N 3.07Å; V147-F149 VanDerWaalsContact C-N 3.34Å; V147-F149 PolarHBondContact O-N 2.84Å; V147-S150 PolarHBondContact O-N 3.39Å; V147-N151 WeakPolarHBondContact CG1-ND2 3.36Å; V147-N151 VanDerWaalsContact O-CB 3.28Å; V147-N151 WeakPolarHBondContact O-CB 3.14Å; V147-N151 PolarHBondContact O-N 3.23Å; V147-N151 PolarHBondContact O-ND2 2.93Å; V147-N151 VanDerWaalsContact O-ND2 3.16Å
148	R	88.2	Confident	87.6	Confident	192 Å²	192	110.7 Å²	110.7	73%	0.725	53%	0.529	S	S	*	.	H	α-helix	trans	-60.8	-43.9	174.8	-178.7	-176.9	173.4	-161.8	-1.2	111.7	R144 N145 N151 D152	R144-R148 VanDerWaalsContact O-CB 3.24Å; R144-R148 WeakPolarHBondContact O-CB 3.07Å; R144-R148 PolarHBondContact O-N 3.45Å; N145-R148 PolarHBondContact O-N 3.46Å; R148-N151 PolarHBondContact O-N 2.95Å; R148-D152 PolarHBondContact O-N 2.89Å; R148-D152 VanDerWaalsContact O-N 3.11Å
149	F	84.1	Confident	86.9	Confident	129 Å²	129	105.8 Å²	105.8	57%	0.566	51%	0.508	S	S	*	.	H	α-helix	trans	-63.1	-47.9	177.1	-177.9	-104.3	0	0	0	111	N145 L146 V147 N151 D152 L155	N145-F149 WeakPolarHBondContact O-CB 3.23Å; N145-F149 PolarHBondContact O-N 2.94Å; L146-F149 PolarHBondContact O-N 3.44Å; V147-F149 VanDerWaalsContact C-N 3.34Å; V147-F149 PolarHBondContact O-N 2.84Å; F149-N151 VanDerWaalsContact C-N 3.28Å; F149-N151 PolarHBondContact O-N 3.41Å; F149-D152 WeakPolarHBondContact O-CB 3.18Å; F149-D152 PolarHBondContact O-N 2.99Å; F149-L155 HydrophobicContact CD1-CD1 3.42Å; F149-L155 VanDerWaalsContact CD1-CD1 3.42Å; F149-L155 HydrophobicContact CD2-CD1 3.9Å; F149-L155 HydrophobicContact CE1-CD1 3.18Å; F149-L155 HydrophobicContact CE2-CD1 3.68Å; F149-L155 HydrophobicContact CG-CD1 3.78Å; F149-L155 HydrophobicContact CZ-CD1 3.32Å; F149-L155 HydrophobicContact CZ-CD2 4.31Å; F149-L155 HydrophobicContact CZ-CG 4.39Å; F149-L155 WeakPolarHBondContact O-CD1 3.41Å
150	S	84.3	Confident	86.4	Confident	86 Å²	86	105.2 Å²	105.2	60%	0.601	50%	0.504	S	S	*	.	H	α-helix	trans	-64.1	-31	177.5	-173.5	0	0	0	0	113.4	L146 V147 D152	L146-S150 WeakPolarHBondContact O-CB 3.39Å; L146-S150 PolarHBondContact O-N 2.98Å; V147-S150 PolarHBondContact O-N 3.39Å; S150-D152 VanDerWaalsContact C-N 3.29Å
151	N	84.2	Confident	86	Confident	122 Å²	122	104 Å²	104	65%	0.652	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-3.9	175.8	-70.7	-28.9	0	0	0	112.7	V147 R148 F149 W153	V147-N151 WeakPolarHBondContact CG1-ND2 3.36Å; V147-N151 VanDerWaalsContact O-CB 3.28Å; V147-N151 WeakPolarHBondContact O-CB 3.14Å; V147-N151 PolarHBondContact O-N 3.23Å; V147-N151 PolarHBondContact O-ND2 2.93Å; V147-N151 VanDerWaalsContact O-ND2 3.16Å; R148-N151 PolarHBondContact O-N 2.95Å; F149-N151 VanDerWaalsContact C-N 3.28Å; F149-N151 PolarHBondContact O-N 3.41Å; N151-W153 PolarHBondContact O-N 3.3Å
152	D	85.7	Confident	85.7	Confident	61 Å²	61	102.7 Å²	102.7	33%	0.326	50%	0.5	S	S	.	.			trans	-64.1	119.3	173	-167.6	-15.4	0	0	0	108.5	R148 F149 S150 R154 L155 S156	R148-D152 PolarHBondContact O-N 2.89Å; R148-D152 VanDerWaalsContact O-N 3.11Å; F149-D152 WeakPolarHBondContact O-CB 3.18Å; F149-D152 PolarHBondContact O-N 2.99Å; S150-D152 VanDerWaalsContact C-N 3.29Å; D152-R154 PolarHBondContact O-N 2.94Å; D152-R154 WeakPolarHBondContact OD1-CG 3.47Å; D152-R154 PolarHBondContact OD1-N 3.16Å; D152-L155 PolarHBondContact O-N 2.91Å; D152-S156 PolarHBondContact O-N 3.42Å
153	W	77.7	Confident	85.4	Confident	183 Å²	183	101.7 Å²	101.7	69%	0.693	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-55.7	-24	-178.6	70.6	-87.1	0	0	0	112.4	N151 L155 S156 S159	N151-W153 PolarHBondContact O-N 3.3Å; W153-L155 VanDerWaalsContact C-N 3.26Å; W153-L155 PolarHBondContact O-N 2.79Å; W153-S156 WeakPolarHBondContact O-CB 3.32Å; W153-S156 PolarHBondContact O-N 2.88Å; W153-S156 VanDerWaalsContact O-N 3.12Å; W153-S159 WeakPolarHBondContact O-CB 3.44Å; W153-S159 PolarHBondContact O-OG 2.94Å
154	R	73.7	Confident	85.3	Confident	146 Å²	146	101.3 Å²	101.3	55%	0.551	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-67.3	-26.2	176.6	-61.9	176.9	65.9	101.3	6	113.1	D152 S159	D152-R154 PolarHBondContact O-N 2.94Å; D152-R154 WeakPolarHBondContact OD1-CG 3.47Å; D152-R154 PolarHBondContact OD1-N 3.16Å; R154-S159 PolarHBondContact O-OG 3.48Å
155	L	74.4	Confident	85.3	Confident	74 Å²	74	101.7 Å²	101.7	39%	0.387	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-94.5	1.3	173.9	-56.3	-175	0	0	0	112.4	F149 D152 W153 Q157	F149-L155 HydrophobicContact CD1-CD1 3.42Å; F149-L155 VanDerWaalsContact CD1-CD1 3.42Å; F149-L155 HydrophobicContact CD2-CD1 3.9Å; F149-L155 HydrophobicContact CE1-CD1 3.18Å; F149-L155 HydrophobicContact CE2-CD1 3.68Å; F149-L155 HydrophobicContact CG-CD1 3.78Å; F149-L155 HydrophobicContact CZ-CD1 3.32Å; F149-L155 HydrophobicContact CZ-CD2 4.31Å; F149-L155 HydrophobicContact CZ-CG 4.39Å; F149-L155 WeakPolarHBondContact O-CD1 3.41Å; D152-L155 PolarHBondContact O-N 2.91Å; W153-L155 VanDerWaalsContact C-N 3.26Å; W153-L155 PolarHBondContact O-N 2.79Å; L155-Q157 PolarHBondContact O-N 2.83Å
156	S	79	Confident	85.2	Confident	62 Å²	62	101 Å²	101	43%	0.434	50%	0.499	S	S	.	.	S	Bend	trans	-53.9	137.9	170.2	-175.1	0	0	0	0	108.8	D152 W153 E158 S159 V160	D152-S156 PolarHBondContact O-N 3.42Å; W153-S156 WeakPolarHBondContact O-CB 3.32Å; W153-S156 PolarHBondContact O-N 2.88Å; W153-S156 VanDerWaalsContact O-N 3.12Å; S156-E158 PolarHBondContact O-N 2.91Å; S156-E158 VanDerWaalsContact O-N 3.08Å; S156-S159 PolarHBondContact N-OG 3.13Å; S156-S159 PolarHBondContact O-N 3.4Å; S156-S159 PolarHBondContact O-OG 3.42Å; S156-V160 PolarHBondContact O-N 3.13Å
157	Q	81.1	Confident	85.4	Confident	158 Å²	158	101.9 Å²	101.9	74%	0.738	50%	0.502	S	S	*	.	H	α-helix	trans	-52.9	-37.1	-179.7	-174.2	177.2	-2.8	0	0	111.2	L155 L161	L155-Q157 PolarHBondContact O-N 2.83Å; Q157-L161 HydrophobicContact CG-CD1 3.97Å; Q157-L161 HydrophobicContact CG-CG 4.44Å; Q157-L161 VanDerWaalsContact O-CB 3.27Å; Q157-L161 WeakPolarHBondContact O-CB 3.34Å; Q157-L161 WeakPolarHBondContact O-CG 3.47Å; Q157-L161 PolarHBondContact O-N 3.47Å
158	E	84	Confident	85.6	Confident	113 Å²	113	103.6 Å²	103.6	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-70.5	-39	178.9	-166.7	59	-145.6	0	0	112.8	S156 L161 S162 R165	S156-E158 PolarHBondContact O-N 2.91Å; S156-E158 VanDerWaalsContact O-N 3.08Å; E158-L161 PolarHBondContact O-N 3.3Å; E158-S162 VanDerWaalsContact O-CB 3.24Å; E158-S162 WeakPolarHBondContact O-CB 3.3Å; E158-S162 PolarHBondContact O-N 2.81Å; E158-R165 IonicContact OE1-NH1 2.75Å
159	S	82.3	Confident	86	Confident	18 Å²	18	99.8 Å²	99.8	13%	0.126	50%	0.495	C	S	.	.	H	α-helix	trans	-67.6	-43.6	177.8	60.3	0	0	0	0	111.1	W153 R154 S156 L161 S162 D163	W153-S159 WeakPolarHBondContact O-CB 3.44Å; W153-S159 PolarHBondContact O-OG 2.94Å; R154-S159 PolarHBondContact O-OG 3.48Å; S156-S159 PolarHBondContact N-OG 3.13Å; S156-S159 PolarHBondContact O-N 3.4Å; S156-S159 PolarHBondContact O-OG 3.42Å; S159-L161 VanDerWaalsContact C-N 3.35Å; S159-L161 PolarHBondContact O-N 2.87Å; S159-S162 PolarHBondContact O-N 2.66Å; S159-D163 WeakPolarHBondContact O-CB 3.44Å; S159-D163 PolarHBondContact O-N 3.37Å
160	V	85.6	Confident	86.5	Confident	72 Å²	72	99.1 Å²	99.1	44%	0.436	50%	0.497	S	S	.	.	H	α-helix	trans	-63.4	-41.9	176.8	177.2	0	0	0	0	110.8	S156 D163 M164	S156-V160 PolarHBondContact O-N 3.13Å; V160-D163 PolarHBondContact O-N 3.49Å; V160-M164 VanDerWaalsContact O-CB 3.28Å; V160-M164 WeakPolarHBondContact O-CB 3.34Å; V160-M164 PolarHBondContact O-N 2.91Å
161	L	88.7	Confident	87	Confident	62 Å²	62	102.5 Å²	102.5	33%	0.325	50%	0.5	S	S	.	.	H	α-helix	trans	-65.6	-40.2	175.5	-74.6	174.3	0	0	0	112	Q157 E158 S159 M164 R165	Q157-L161 HydrophobicContact CG-CD1 3.97Å; Q157-L161 HydrophobicContact CG-CG 4.44Å; Q157-L161 VanDerWaalsContact O-CB 3.27Å; Q157-L161 WeakPolarHBondContact O-CB 3.34Å; Q157-L161 WeakPolarHBondContact O-CG 3.47Å; Q157-L161 PolarHBondContact O-N 3.47Å; E158-L161 PolarHBondContact O-N 3.3Å; S159-L161 VanDerWaalsContact C-N 3.35Å; S159-L161 PolarHBondContact O-N 2.87Å; L161-M164 PolarHBondContact O-N 2.83Å; L161-R165 WeakPolarHBondContact O-CB 3.36Å; L161-R165 VanDerWaalsContact O-CG 3.28Å; L161-R165 WeakPolarHBondContact O-CG 3.35Å; L161-R165 PolarHBondContact O-N 3.27Å
162	S	90	Very high	87.6	Confident	55 Å²	55	100.5 Å²	100.5	39%	0.385	49%	0.487	S	S	.	.	H	α-helix	trans	-64.4	-44.4	176.1	-175.3	0	0	0	0	112	E158 S159 M164 R165 S166	E158-S162 VanDerWaalsContact O-CB 3.24Å; E158-S162 WeakPolarHBondContact O-CB 3.3Å; E158-S162 PolarHBondContact O-N 2.81Å; S159-S162 PolarHBondContact O-N 2.66Å; S162-M164 VanDerWaalsContact C-N 3.34Å; S162-M164 PolarHBondContact O-N 3.45Å; S162-R165 PolarHBondContact O-N 2.96Å; S162-S166 WeakPolarHBondContact O-CB 3.28Å; S162-S166 PolarHBondContact O-N 3.23Å; S162-S166 PolarHBondContact O-OG 3.47Å
163	D	88.7	Confident	88.1	Confident	99 Å²	99	104.4 Å²	104.4	53%	0.529	50%	0.501	S	S	.	.	H	α-helix	trans	-63.4	-41.2	175.5	-77.2	-8.2	0	0	0	110.9	S159 V160 S166 M167	S159-D163 WeakPolarHBondContact O-CB 3.44Å; S159-D163 PolarHBondContact O-N 3.37Å; V160-D163 PolarHBondContact O-N 3.49Å; D163-S166 PolarHBondContact O-N 3.39Å; D163-M167 WeakPolarHBondContact O-CB 3.34Å; D163-M167 PolarHBondContact O-N 3.42Å
164	M	92	Very high	88.9	Confident	115 Å²	115	103.8 Å²	103.8	57%	0.567	50%	0.5	S	S	*	.	H	α-helix	trans	-63.6	-44.4	175.9	-172.7	177.3	-177	0	0	112	V160 L161 S162 M167 Q168	V160-M164 VanDerWaalsContact O-CB 3.28Å; V160-M164 WeakPolarHBondContact O-CB 3.34Å; V160-M164 PolarHBondContact O-N 2.91Å; L161-M164 PolarHBondContact O-N 2.83Å; S162-M164 VanDerWaalsContact C-N 3.34Å; S162-M164 PolarHBondContact O-N 3.45Å; M164-M167 PolarHBondContact O-N 3.44Å; M164-Q168 WeakPolarHBondContact O-CB 3.37Å; M164-Q168 PolarHBondContact O-N 2.8Å
165	R	92.9	Very high	90	Very high	137 Å²	137	99.3 Å²	99.3	52%	0.517	49%	0.491	S	S	.	.	H	α-helix	trans	-61.6	-44.1	174.2	-73.7	174.3	-170.6	149.5	5	111.1	E158 L161 S162 M167 Q168 H169	E158-R165 IonicContact OE1-NH1 2.75Å; L161-R165 WeakPolarHBondContact O-CB 3.36Å; L161-R165 VanDerWaalsContact O-CG 3.28Å; L161-R165 WeakPolarHBondContact O-CG 3.35Å; L161-R165 PolarHBondContact O-N 3.27Å; S162-R165 PolarHBondContact O-N 2.96Å; R165-M167 PolarHBondContact O-N 2.98Å; R165-Q168 WeakPolarHBondContact O-CB 3.47Å; R165-Q168 PolarHBondContact O-N 2.94Å; R165-H169 PolarHBondContact O-CD2 3.25Å; R165-H169 VanDerWaalsContact O-CD2 3.22Å; R165-H169 PolarHBondContact O-N 2.99Å
166	S	91.9	Very high	91.1	Very high	57 Å²	57	100.4 Å²	100.4	40%	0.399	50%	0.498	S	S	.	.	H	α-helix	trans	-61.4	-44.3	177.4	-61.3	0	0	0	0	111.5	S162 D163 Q168 H169 I170	S162-S166 WeakPolarHBondContact O-CB 3.28Å; S162-S166 PolarHBondContact O-N 3.23Å; S162-S166 PolarHBondContact O-OG 3.47Å; D163-S166 PolarHBondContact O-N 3.39Å; S166-Q168 VanDerWaalsContact C-N 3.35Å; S166-Q168 PolarHBondContact O-N 2.94Å; S166-H169 PolarHBondContact O-N 3.48Å; S166-I170 VanDerWaalsContact O-CG1 3.31Å; S166-I170 WeakPolarHBondContact O-CG1 3.39Å; S166-I170 PolarHBondContact O-N 2.87Å
167	M	94.2	Very high	91.9	Very high	127 Å²	127	103.1 Å²	103.1	63%	0.626	51%	0.507	S	S	*	.	H	α-helix	trans	-63.9	-39.2	175.4	-176.3	168	58.3	0	0	112.1	D163 M164 R165 I170 K171	D163-M167 WeakPolarHBondContact O-CB 3.34Å; D163-M167 PolarHBondContact O-N 3.42Å; M164-M167 PolarHBondContact O-N 3.44Å; R165-M167 PolarHBondContact O-N 2.98Å; M167-I170 PolarHBondContact O-N 2.9Å; M167-K171 WeakPolarHBondContact O-CB 3.34Å; M167-K171 PolarHBondContact O-N 3.15Å
168	Q	95.4	Very high	92.6	Very high	108 Å²	108	97.7 Å²	97.7	51%	0.505	49%	0.486	S	S	.	.	H	α-helix	trans	-62.6	-45.1	174.3	-174.3	-179.9	-28	0	0	111.5	M164 R165 S166 I170 K171 E172	M164-Q168 WeakPolarHBondContact O-CB 3.37Å; M164-Q168 PolarHBondContact O-N 2.8Å; R165-Q168 WeakPolarHBondContact O-CB 3.47Å; R165-Q168 PolarHBondContact O-N 2.94Å; S166-Q168 VanDerWaalsContact C-N 3.35Å; S166-Q168 PolarHBondContact O-N 2.94Å; Q168-I170 VanDerWaalsContact C-N 3.33Å; Q168-I170 PolarHBondContact O-N 2.97Å; Q168-K171 WeakPolarHBondContact O-CB 3.33Å; Q168-K171 PolarHBondContact O-N 3.41Å; Q168-K171 VanDerWaalsContact O-N 3.16Å; Q168-E172 PolarHBondContact NE2-OE1 2.99Å; Q168-E172 WeakPolarHBondContact O-CG 3.32Å; Q168-E172 PolarHBondContact O-N 2.86Å
169	H	95.5	Very high	93.2	Very high	111 Å²	111	98.7 Å²	98.7	51%	0.514	49%	0.489	S	S	.	.	H	α-helix	trans	-62.5	-38.5	175.4	-74.7	-48.9	0	0	0	112.9	R165 S166 K171 E172 K173	R165-H169 PolarHBondContact O-CD2 3.25Å; R165-H169 VanDerWaalsContact O-CD2 3.22Å; R165-H169 PolarHBondContact O-N 2.99Å; S166-H169 PolarHBondContact O-N 3.48Å; H169-K171 VanDerWaalsContact C-N 3.33Å; H169-E172 IonicContact ND1-OE2 3.48Å; H169-E172 PolarHBondContact ND1-OE2 3.02Å; H169-E172 PolarHBondContact O-N 3.42Å; H169-K173 WeakPolarHBondContact O-CB 3.32Å; H169-K173 WeakPolarHBondContact O-CG 3.3Å; H169-K173 PolarHBondContact O-N 2.84Å
170	I	94.4	Very high	93.8	Very high	115 Å²	115	101.2 Å²	101.2	59%	0.59	51%	0.506	S	S	*	.	H	α-helix	trans	-63.2	-43.2	174.2	-69.2	165.3	0	0	0	110.2	S166 M167 Q168 E172 K173 Y174	S166-I170 VanDerWaalsContact O-CG1 3.31Å; S166-I170 WeakPolarHBondContact O-CG1 3.39Å; S166-I170 PolarHBondContact O-N 2.87Å; M167-I170 PolarHBondContact O-N 2.9Å; Q168-I170 VanDerWaalsContact C-N 3.33Å; Q168-I170 PolarHBondContact O-N 2.97Å; I170-E172 PolarHBondContact O-N 2.95Å; I170-K173 PolarHBondContact O-N 3.47Å; I170-Y174 WeakPolarHBondContact O-CB 3.37Å; I170-Y174 PolarHBondContact O-N 3.21Å
171	K	96.2	Very high	94.2	Very high	157 Å²	157	103.7 Å²	103.7	68%	0.683	52%	0.516	S	S	*	.	H	α-helix	trans	-61.4	-43.1	176.3	-175.1	-178.4	179.7	-178.1	0	112	M167 Q168 H169 Y174 S175	M167-K171 WeakPolarHBondContact O-CB 3.34Å; M167-K171 PolarHBondContact O-N 3.15Å; Q168-K171 WeakPolarHBondContact O-CB 3.33Å; Q168-K171 PolarHBondContact O-N 3.41Å; Q168-K171 VanDerWaalsContact O-N 3.16Å; H169-K171 VanDerWaalsContact C-N 3.33Å; K171-Y174 PolarHBondContact O-N 3.39Å; K171-S175 WeakPolarHBondContact O-CB 3.34Å; K171-S175 PolarHBondContact O-N 2.87Å
172	E	96.2	Very high	94.5	Very high	81 Å²	81	109.6 Å²	109.6	38%	0.379	53%	0.534	S	S	.	.	H	α-helix	trans	-62.6	-47.5	175.5	-72.9	166	-175.3	0	0	111.3	Q168 H169 I170 Y174 S175 N176	Q168-E172 PolarHBondContact NE2-OE1 2.99Å; Q168-E172 WeakPolarHBondContact O-CG 3.32Å; Q168-E172 PolarHBondContact O-N 2.86Å; H169-E172 IonicContact ND1-OE2 3.48Å; H169-E172 PolarHBondContact ND1-OE2 3.02Å; H169-E172 PolarHBondContact O-N 3.42Å; I170-E172 PolarHBondContact O-N 2.95Å; E172-Y174 PolarHBondContact O-N 3.24Å; E172-S175 WeakPolarHBondContact O-CB 3.38Å; E172-S175 PolarHBondContact O-N 2.87Å; E172-N176 VanDerWaalsContact O-CG 3.3Å; E172-N176 PolarHBondContact O-N 3.42Å; E172-N176 PolarHBondContact O-ND2 2.97Å
173	K	95.6	Very high	94.7	Very high	143 Å²	143	110.3 Å²	110.3	62%	0.622	53%	0.531	S	S	*	.	H	α-helix	trans	-58.8	-46.4	175.6	-77.1	-178.6	179.2	-178.2	0	111.8	H169 I170 S175 N176 L177	H169-K173 WeakPolarHBondContact O-CB 3.32Å; H169-K173 WeakPolarHBondContact O-CG 3.3Å; H169-K173 PolarHBondContact O-N 2.84Å; I170-K173 PolarHBondContact O-N 3.47Å; K173-S175 VanDerWaalsContact C-N 3.34Å; K173-S175 PolarHBondContact O-N 2.88Å; K173-N176 PolarHBondContact O-N 2.88Å; K173-L177 WeakPolarHBondContact O-CB 3.33Å; K173-L177 WeakPolarHBondContact O-CG 3.48Å; K173-L177 PolarHBondContact O-N 3.43Å
174	Y	96.2	Very high	95	Very high	170 Å²	170	108.1 Å²	108.1	67%	0.667	52%	0.524	S	S	*	.	H	α-helix	trans	-61.4	-42.6	176.9	179.8	-98.1	0	0	0	111.7	I170 K171 E172 N176 L177 S178	I170-Y174 WeakPolarHBondContact O-CB 3.37Å; I170-Y174 PolarHBondContact O-N 3.21Å; K171-Y174 PolarHBondContact O-N 3.39Å; E172-Y174 PolarHBondContact O-N 3.24Å; Y174-N176 PolarHBondContact O-N 2.9Å; Y174-L177 PolarHBondContact O-N 2.88Å; Y174-S178 VanDerWaalsContact O-CB 3.27Å; Y174-S178 WeakPolarHBondContact O-CB 3.2Å; Y174-S178 PolarHBondContact O-N 3.38Å
175	S	96.2	Very high	95.1	Very high	52 Å²	52	107.6 Å²	107.6	36%	0.364	52%	0.523	S	S	.	.	H	α-helix	trans	-61.2	-44	175.7	-172.5	0	0	0	0	112	K171 E172 K173 S178 K179	K171-S175 WeakPolarHBondContact O-CB 3.34Å; K171-S175 PolarHBondContact O-N 2.87Å; E172-S175 WeakPolarHBondContact O-CB 3.38Å; E172-S175 PolarHBondContact O-N 2.87Å; K173-S175 VanDerWaalsContact C-N 3.34Å; K173-S175 PolarHBondContact O-N 2.88Å; S175-S178 PolarHBondContact O-N 3.27Å; S175-K179 WeakPolarHBondContact O-CG 3.24Å; S175-K179 PolarHBondContact O-N 2.98Å
176	N	96.7	Very high	95.1	Very high	97 Å²	97	106.9 Å²	106.9	52%	0.519	52%	0.52	S	S	.	.	H	α-helix	trans	-67.7	-42.9	178.7	-69.3	-18.1	0	0	0	112.1	E172 K173 Y174 S178 K179 S180	E172-N176 VanDerWaalsContact O-CG 3.3Å; E172-N176 PolarHBondContact O-N 3.42Å; E172-N176 PolarHBondContact O-ND2 2.97Å; K173-N176 PolarHBondContact O-N 2.88Å; Y174-N176 PolarHBondContact O-N 2.9Å; N176-S178 VanDerWaalsContact C-N 3.33Å; N176-S178 PolarHBondContact O-N 3.39Å; N176-K179 PolarHBondContact O-N 3.12Å; N176-S180 WeakPolarHBondContact O-CB 3.47Å; N176-S180 PolarHBondContact O-N 2.78Å
177	L	96.1	Very high	95.1	Very high	119 Å²	119	108.6 Å²	108.6	62%	0.623	52%	0.522	S	S	*	.	H	α-helix	trans	-61.5	-42.1	173.9	-77.3	162.9	0	0	0	111.4	K173 Y174 K179 S180 L181	K173-L177 WeakPolarHBondContact O-CB 3.33Å; K173-L177 WeakPolarHBondContact O-CG 3.48Å; K173-L177 PolarHBondContact O-N 3.43Å; Y174-L177 PolarHBondContact O-N 2.88Å; L177-K179 VanDerWaalsContact C-N 3.34Å; L177-K179 PolarHBondContact O-N 2.91Å; L177-S180 PolarHBondContact O-N 2.88Å; L177-L181 WeakPolarHBondContact O-CB 3.44Å; L177-L181 PolarHBondContact O-N 3.4Å
178	S	96.2	Very high	94.9	Very high	43 Å²	43	107.3 Å²	107.3	30%	0.301	52%	0.518	S	S	.	.	H	α-helix	trans	-60.9	-41.9	175.7	-173.4	0	0	0	0	112	Y174 S175 N176 R182	Y174-S178 VanDerWaalsContact O-CB 3.27Å; Y174-S178 WeakPolarHBondContact O-CB 3.2Å; Y174-S178 PolarHBondContact O-N 3.38Å; S175-S178 PolarHBondContact O-N 3.27Å; N176-S178 VanDerWaalsContact C-N 3.33Å; N176-S178 PolarHBondContact O-N 3.39Å; S178-R182 WeakPolarHBondContact O-CG 3.46Å; S178-R182 PolarHBondContact O-N 2.97Å; S178-R182 VanDerWaalsContact O-N 3.12Å
179	K	95.9	Very high	94.6	Very high	135 Å²	135	105.3 Å²	105.3	59%	0.587	52%	0.515	S	S	*	.	H	α-helix	trans	-64.9	-45.5	173.8	-71.3	172.8	-175.5	174.3	0	111.9	S175 N176 L177 L181 R182 E183	S175-K179 WeakPolarHBondContact O-CG 3.24Å; S175-K179 PolarHBondContact O-N 2.98Å; N176-K179 PolarHBondContact O-N 3.12Å; L177-K179 VanDerWaalsContact C-N 3.34Å; L177-K179 PolarHBondContact O-N 2.91Å; K179-L181 VanDerWaalsContact C-N 3.32Å; K179-L181 PolarHBondContact O-N 3.46Å; K179-R182 PolarHBondContact O-N 3.35Å; K179-E183 PolarHBondContact O-N 2.89Å
180	S	94.4	Very high	94.2	Very high	70 Å²	70	105 Å²	105	49%	0.49	51%	0.514	S	S	.	.	H	α-helix	trans	-61.9	-40.8	178.2	-170.4	0	0	0	0	111.7	N176 L177 E183 S184	N176-S180 WeakPolarHBondContact O-CB 3.47Å; N176-S180 PolarHBondContact O-N 2.78Å; L177-S180 PolarHBondContact O-N 2.88Å; S180-E183 PolarHBondContact O-N 3.01Å; S180-S184 PolarHBondContact O-N 3Å; S180-S184 PolarHBondContact O-OG 2.91Å
181	L	95.6	Very high	93.8	Very high	124 Å²	124	104.5 Å²	104.5	65%	0.649	51%	0.512	S	S	*	.	H	α-helix	trans	-63.2	-43.7	177	-178.7	63.2	0	0	0	111.2	L177 K179 E183 S184 D185	L177-L181 WeakPolarHBondContact O-CB 3.44Å; L177-L181 PolarHBondContact O-N 3.4Å; K179-L181 VanDerWaalsContact C-N 3.32Å; K179-L181 PolarHBondContact O-N 3.46Å; L181-E183 VanDerWaalsContact C-N 3.31Å; L181-E183 PolarHBondContact O-N 3.47Å; L181-S184 PolarHBondContact O-N 3.15Å; L181-D185 VanDerWaalsContact O-CB 3.32Å; L181-D185 WeakPolarHBondContact O-CB 3.38Å; L181-D185 PolarHBondContact O-N 3.44Å
182	R	94.7	Very high	93.2	Very high	186 Å²	186	103.3 Å²	103.3	70%	0.702	51%	0.513	S	S	*	.	H	α-helix	trans	-61.5	-39.6	174.7	-73.5	177	-176.2	-136.1	-0.1	112.2	S178 K179 D185 R186	S178-R182 WeakPolarHBondContact O-CG 3.46Å; S178-R182 PolarHBondContact O-N 2.97Å; S178-R182 VanDerWaalsContact O-N 3.12Å; K179-R182 PolarHBondContact O-N 3.35Å; R182-D185 PolarHBondContact O-N 3.24Å; R182-R186 WeakPolarHBondContact O-CB 3.49Å; R182-R186 PolarHBondContact O-N 3.31Å
183	E	94.7	Very high	92.4	Very high	71 Å²	71	104 Å²	104	33%	0.332	53%	0.527	S	S	.	.	H	α-helix	trans	-69.1	-42.2	177.7	-179.1	54.8	-156.5	0	0	111.6	K179 S180 L181 D185 R186 Q187	K179-E183 PolarHBondContact O-N 2.89Å; S180-E183 PolarHBondContact O-N 3.01Å; L181-E183 VanDerWaalsContact C-N 3.31Å; L181-E183 PolarHBondContact O-N 3.47Å; E183-D185 VanDerWaalsContact C-N 3.34Å; E183-D185 PolarHBondContact O-N 2.86Å; E183-R186 WeakPolarHBondContact O-CB 3.31Å; E183-R186 PolarHBondContact O-N 2.62Å; E183-R186 IonicContact OE1-CZ 2.7Å; E183-R186 IonicContact OE1-NE 2.97Å; E183-R186 PolarHBondContact OE1-NE 3.34Å; E183-R186 IonicContact OE1-NH2 3.85Å; E183-R186 PolarHBondContact OE1-NH2 3.26Å; E183-R186 IonicContact OE2-CZ 3.85Å; E183-R186 IonicContact OE2-NE 3.68Å; E183-R186 PolarHBondContact OE2-NE 3.13Å; E183-R186 IonicContact OE2-NH2 3.34Å; E183-Q187 WeakPolarHBondContact O-CB 3.31Å; E183-Q187 VanDerWaalsContact O-CG 3.29Å; E183-Q187 WeakPolarHBondContact O-CG 3.49Å; E183-Q187 PolarHBondContact O-N 2.84Å; E183-Q187 PolarHBondContact OE1-NE2 2.89Å
184	S	93.2	Very high	91.4	Very high	53 Å²	53	101 Å²	101	37%	0.371	52%	0.524	S	S	.	.	H	α-helix	trans	-63	-39.4	173.4	-63.4	0	0	0	0	112.4	S180 L181 Q187 L188	S180-S184 PolarHBondContact O-N 3Å; S180-S184 PolarHBondContact O-OG 2.91Å; L181-S184 PolarHBondContact O-N 3.15Å; S184-Q187 PolarHBondContact O-N 2.95Å; S184-L188 WeakPolarHBondContact O-CB 3.44Å; S184-L188 WeakPolarHBondContact O-CG 3.42Å; S184-L188 PolarHBondContact O-N 3.49Å
185	D	95.1	Very high	90.2	Very high	103 Å²	103	96.6 Å²	96.6	55%	0.551	51%	0.514	S	S	*	.	H	α-helix	trans	-65.3	-39	175.3	-170.4	55.3	0	0	0	111.9	L181 R182 E183 L188 S189	L181-D185 VanDerWaalsContact O-CB 3.32Å; L181-D185 WeakPolarHBondContact O-CB 3.38Å; L181-D185 PolarHBondContact O-N 3.44Å; R182-D185 PolarHBondContact O-N 3.24Å; E183-D185 VanDerWaalsContact C-N 3.34Å; E183-D185 PolarHBondContact O-N 2.86Å; D185-L188 PolarHBondContact O-N 3.43Å; D185-S189 WeakPolarHBondContact O-CB 3.24Å; D185-S189 PolarHBondContact O-N 2.92Å; D185-S189 PolarHBondContact O-OG 2.85Å
186	R	92.2	Very high	88.6	Confident	122 Å²	122	102.8 Å²	102.8	46%	0.46	54%	0.537	S	S	.	.	H	α-helix	trans	-62.6	-46.6	172.3	-168.8	-172.2	74.3	71.7	3.6	111.4	R182 E183 S189 E190	R182-R186 WeakPolarHBondContact O-CB 3.49Å; R182-R186 PolarHBondContact O-N 3.31Å; E183-R186 WeakPolarHBondContact O-CB 3.31Å; E183-R186 PolarHBondContact O-N 2.62Å; E183-R186 IonicContact OE1-CZ 2.7Å; E183-R186 IonicContact OE1-NE 2.97Å; E183-R186 PolarHBondContact OE1-NE 3.34Å; E183-R186 IonicContact OE1-NH2 3.85Å; E183-R186 PolarHBondContact OE1-NH2 3.26Å; E183-R186 IonicContact OE2-CZ 3.85Å; E183-R186 IonicContact OE2-NE 3.68Å; E183-R186 PolarHBondContact OE2-NE 3.13Å; E183-R186 IonicContact OE2-NH2 3.34Å; R186-S189 PolarHBondContact O-N 3.41Å; R186-E190 IonicContact CZ-OE2 2.78Å; R186-E190 IonicContact NH1-OE2 2.62Å; R186-E190 PolarHBondContact NH1-OE2 2.75Å; R186-E190 IonicContact NH2-OE2 3.69Å; R186-E190 WeakPolarHBondContact O-CB 3.42Å; R186-E190 PolarHBondContact O-N 2.82Å
187	Q	92.9	Very high	86.9	Confident	93 Å²	93	107.7 Å²	107.7	44%	0.435	55%	0.554	S	S	.	*	H	α-helix	trans	-64.9	-40.4	178.6	-72.9	174.3	5.3	0	0	111.9	E183 S184 E190 L191	E183-Q187 WeakPolarHBondContact O-CB 3.31Å; E183-Q187 VanDerWaalsContact O-CG 3.29Å; E183-Q187 WeakPolarHBondContact O-CG 3.49Å; E183-Q187 PolarHBondContact O-N 2.84Å; E183-Q187 PolarHBondContact OE1-NE2 2.89Å; S184-Q187 PolarHBondContact O-N 2.95Å; Q187-E190 PolarHBondContact O-N 3.17Å; Q187-L191 VanDerWaalsContact O-CB 3.31Å; Q187-L191 WeakPolarHBondContact O-CB 3.49Å; Q187-L191 VanDerWaalsContact O-CG 3.31Å; Q187-L191 WeakPolarHBondContact O-CG 3.33Å; Q187-L191 PolarHBondContact O-N 3.35Å
188	L	89.6	Confident	85.2	Confident	101 Å²	101	105.4 Å²	105.4	53%	0.529	55%	0.552	S	S	.	*	H	α-helix	trans	-63.6	-43.9	173.3	-76.8	171.8	0	0	0	111.3	S184 D185 L191 L192	S184-L188 WeakPolarHBondContact O-CB 3.44Å; S184-L188 WeakPolarHBondContact O-CG 3.42Å; S184-L188 PolarHBondContact O-N 3.49Å; D185-L188 PolarHBondContact O-N 3.43Å; L188-L191 PolarHBondContact O-N 3.25Å; L188-L192 VanDerWaalsContact O-CB 3.25Å; L188-L192 WeakPolarHBondContact O-CB 3.49Å; L188-L192 WeakPolarHBondContact O-CG 3.37Å; L188-L192 PolarHBondContact O-N 3.42Å
189	S	88.4	Confident	83.8	Confident	66 Å²	66	106.8 Å²	106.8	46%	0.462	56%	0.56	S	S	.	*	H	α-helix	trans	-62.7	-42.3	176.5	-62.7	0	0	0	0	111.9	D185 R186 S193	D185-S189 WeakPolarHBondContact O-CB 3.24Å; D185-S189 PolarHBondContact O-N 2.92Å; D185-S189 PolarHBondContact O-OG 2.85Å; R186-S189 PolarHBondContact O-N 3.41Å; S189-S193 WeakPolarHBondContact O-CB 3.35Å; S189-S193 PolarHBondContact O-N 3.5Å; S189-S193 PolarHBondContact O-OG 2.91Å
190	E	88.8	Confident	82.8	Confident	104 Å²	104	105 Å²	105	49%	0.486	56%	0.557	S	S	.	*	H	α-helix	trans	-64.4	-47	176.6	-171.9	170.6	-176.9	0	0	110.9	R186 Q187 S193 S194	R186-E190 IonicContact CZ-OE2 2.78Å; R186-E190 IonicContact NH1-OE2 2.62Å; R186-E190 PolarHBondContact NH1-OE2 2.75Å; R186-E190 IonicContact NH2-OE2 3.69Å; R186-E190 WeakPolarHBondContact O-CB 3.42Å; R186-E190 PolarHBondContact O-N 2.82Å; Q187-E190 PolarHBondContact O-N 3.17Å; E190-S193 WeakPolarHBondContact CA-OG 3.14Å; E190-S193 PolarHBondContact O-N 3.35Å; E190-S193 PolarHBondContact O-OG 2.98Å; E190-S194 WeakPolarHBondContact O-CB 3.41Å; E190-S194 PolarHBondContact O-N 3.26Å; E190-S194 PolarHBondContact O-OG 2.83Å
191	L	86	Confident	82.1	Confident	104 Å²	104	108.5 Å²	108.5	55%	0.545	57%	0.565	S	S	.	*	H	α-helix	trans	-61	-48.2	175.3	-78.2	167.6	0	0	0	111.7	Q187 L188 S193 S194 V195	Q187-L191 VanDerWaalsContact O-CB 3.31Å; Q187-L191 WeakPolarHBondContact O-CB 3.49Å; Q187-L191 VanDerWaalsContact O-CG 3.31Å; Q187-L191 WeakPolarHBondContact O-CG 3.33Å; Q187-L191 PolarHBondContact O-N 3.35Å; L188-L191 PolarHBondContact O-N 3.25Å; L191-S193 PolarHBondContact O-N 3.4Å; L191-S194 WeakPolarHBondContact CA-OG 3.42Å; L191-S194 PolarHBondContact O-N 3.12Å; L191-S194 VanDerWaalsContact O-N 3.09Å; L191-S194 PolarHBondContact O-OG 2.95Å; L191-V195 VanDerWaalsContact O-CG2 3.3Å; L191-V195 WeakPolarHBondContact O-CG2 3.45Å; L191-V195 PolarHBondContact O-N 2.65Å
192	L	82.3	Confident	81.4	Confident	133 Å²	133	111.6 Å²	111.6	70%	0.696	57%	0.568	S	S	*	*	H	α-helix	trans	-62	-31.5	177.3	-73.2	170.1	0	0	0	112.4	L188	L188-L192 VanDerWaalsContact O-CB 3.25Å; L188-L192 WeakPolarHBondContact O-CB 3.49Å; L188-L192 WeakPolarHBondContact O-CG 3.37Å; L188-L192 PolarHBondContact O-N 3.42Å
193	S	80	Confident	80.9	Confident	96 Å²	96	106.4 Å²	106.4	67%	0.671	55%	0.554	S	S	*	*	H	α-helix	trans	-76.1	-32.6	173.7	74	0	0	0	0	113.2	S189 E190 L191	S189-S193 WeakPolarHBondContact O-CB 3.35Å; S189-S193 PolarHBondContact O-N 3.5Å; S189-S193 PolarHBondContact O-OG 2.91Å; E190-S193 WeakPolarHBondContact CA-OG 3.14Å; E190-S193 PolarHBondContact O-N 3.35Å; E190-S193 PolarHBondContact O-OG 2.98Å; L191-S193 PolarHBondContact O-N 3.4Å
194	S	75.1	Confident	80.4	Confident	80 Å²	80	107.8 Å²	107.8	56%	0.559	56%	0.564	S	S	*	*	H	α-helix	trans	-80.7	-27.5	179.5	74.9	0	0	0	0	113.4	E190 L191 E196	E190-S194 WeakPolarHBondContact O-CB 3.41Å; E190-S194 PolarHBondContact O-N 3.26Å; E190-S194 PolarHBondContact O-OG 2.83Å; L191-S194 WeakPolarHBondContact CA-OG 3.42Å; L191-S194 PolarHBondContact O-N 3.12Å; L191-S194 VanDerWaalsContact O-N 3.09Å; L191-S194 PolarHBondContact O-OG 2.95Å; S194-E196 PolarHBondContact O-N 3.16Å
195	V	70.1	Confident	80.1	Confident	77 Å²	77	111.2 Å²	111.2	47%	0.467	58%	0.575	S	S	.	*	S	Bend	trans	-70.2	91.2	172.2	173.1	0	0	0	0	106.5	L191 K197 A198	L191-V195 VanDerWaalsContact O-CG2 3.3Å; L191-V195 WeakPolarHBondContact O-CG2 3.45Å; L191-V195 PolarHBondContact O-N 2.65Å; V195-K197 PolarHBondContact O-N 2.87Å; V195-A198 HydrophobicContact CG1-CB 3.96Å
196	E	62.3	Low	79.9	Confident	182 Å²	182	111.6 Å²	111.6	85%	0.85	58%	0.577	S	S	*	*			trans	-43.7	112	163	-165.4	171.6	-154.3	0	0	106.7	S194 A198	S194-E196 PolarHBondContact O-N 3.16Å; E196-A198 PolarHBondContact O-N 3.44Å
197	K	61.6	Low	79.8	Confident	200 Å²	200	112 Å²	112	87%	0.87	58%	0.578	S	S	*	*			trans	-21.8	99.3	-165.3	-66	177.2	-177.5	176.3	0	111	V195 P199	V195-K197 PolarHBondContact O-N 2.87Å; K197-P199 VanDerWaalsContact O-N 3.12Å
198	A	61.3	Low	79.8	Confident	70 Å²	70	114.8 Å²	114.8	58%	0.579	59%	0.589	S	S	*	*			trans	-44.2	126.3	-177.3	0	0	0	0	0	108.3	V195 E196 D200	V195-A198 HydrophobicContact CG1-CB 3.96Å; E196-A198 PolarHBondContact O-N 3.44Å; A198-D200 PolarHBondContact O-N 3.34Å; A198-D200 VanDerWaalsContact O-N 3.16Å
199	P	65.5	Low	79.9	Confident	72 Å²	72	116 Å²	116	47%	0.468	59%	0.59	S	S	.	*			trans	-51.7	128.8	-175.2	-25.3	31.3	0	0	0	109	K197 Q201	K197-P199 VanDerWaalsContact O-N 3.12Å; P199-Q201 PolarHBondContact O-N 3.15Å
200	D	74.7	Confident	80.2	Confident	98 Å²	98	118.5 Å²	118.5	52%	0.524	59%	0.594	S	S	.	*			trans	-45.6	132.5	-178.6	-179.9	15.4	0	0	0	108.7	A198 R202 L203 L204	A198-D200 PolarHBondContact O-N 3.34Å; A198-D200 VanDerWaalsContact O-N 3.16Å; D200-R202 CarbonylContact O-C 3.59Å; D200-R202 PolarHBondContact O-N 3.08Å; D200-L203 WeakPolarHBondContact O-CA 3.41Å; D200-L203 VanDerWaalsContact O-CB 3.25Å; D200-L203 WeakPolarHBondContact O-CB 3.31Å; D200-L203 PolarHBondContact O-N 2.86Å; D200-L204 PolarHBondContact O-N 3.44Å; D200-L204 VanDerWaalsContact O-N 3.15Å
201	Q	80.3	Confident	80.5	Confident	143 Å²	143	118.1 Å²	118.1	67%	0.668	60%	0.595	S	S	*	*	H	α-helix	trans	-51	-31.2	-174.4	-178.5	-178.7	-8.1	0	0	111.4	P199 L204 M205	P199-Q201 PolarHBondContact O-N 3.15Å; Q201-L204 PolarHBondContact O-N 2.84Å; Q201-M205 WeakPolarHBondContact O-CG 3.34Å; Q201-M205 PolarHBondContact O-N 2.83Å
202	R	80.3	Confident	80.9	Confident	189 Å²	189	117.5 Å²	117.5	71%	0.713	59%	0.589	S	S	*	*	H	α-helix	trans	-62.5	-43.4	174	-63.8	-178.4	171.9	-165.3	-1.7	113.1	D200 M205 L206	D200-R202 CarbonylContact O-C 3.59Å; D200-R202 PolarHBondContact O-N 3.08Å; R202-M205 PolarHBondContact O-N 3.4Å; R202-L206 PolarHBondContact O-N 2.96Å
203	L	84.9	Confident	81.5	Confident	77 Å²	77	115.9 Å²	115.9	40%	0.403	58%	0.578	S	S	.	*	H	α-helix	trans	-66.2	-40.7	177.9	-130.9	156	0	0	0	110.7	D200 M205 L206 W207	D200-L203 WeakPolarHBondContact O-CA 3.41Å; D200-L203 VanDerWaalsContact O-CB 3.25Å; D200-L203 WeakPolarHBondContact O-CB 3.31Å; D200-L203 PolarHBondContact O-N 2.86Å; L203-M205 VanDerWaalsContact C-N 3.33Å; L203-M205 PolarHBondContact O-N 2.92Å; L203-L206 WeakPolarHBondContact O-CB 3.44Å; L203-L206 PolarHBondContact O-N 2.88Å; L203-W207 HydrophobicContact CD2-CD2 4.11Å; L203-W207 VanDerWaalsContact CD2-CE2 3.4Å; L203-W207 HydrophobicContact CD2-CH2 4.32Å; L203-W207 HydrophobicContact CD2-CZ2 3.53Å; L203-W207 PolarHBondContact O-N 3.28Å
204	L	83.9	Confident	82.2	Confident	101 Å²	101	117 Å²	117	53%	0.529	57%	0.574	S	S	.	*	H	α-helix	trans	-62.9	-39.1	174.4	-158.3	80.7	0	0	0	112.1	D200 Q201 W207 K208	D200-L204 PolarHBondContact O-N 3.44Å; D200-L204 VanDerWaalsContact O-N 3.15Å; Q201-L204 PolarHBondContact O-N 2.84Å; L204-W207 HydrophobicContact CD1-CE3 4.48Å; L204-K208 WeakPolarHBondContact O-CB 3.22Å; L204-K208 PolarHBondContact O-N 3.47Å
205	M	87.1	Confident	83	Confident	124 Å²	124	118.4 Å²	118.4	61%	0.611	57%	0.57	S	S	*	*	H	α-helix	trans	-66.9	-36.9	175	-76.5	-144	-78.8	0	0	112.8	Q201 R202 L203 K208 K209	Q201-M205 WeakPolarHBondContact O-CG 3.34Å; Q201-M205 PolarHBondContact O-N 2.83Å; R202-M205 PolarHBondContact O-N 3.4Å; L203-M205 VanDerWaalsContact C-N 3.33Å; L203-M205 PolarHBondContact O-N 2.92Å; M205-K208 PolarHBondContact O-N 3.35Å; M205-K209 PolarHBondContact O-N 2.88Å
206	L	90	Very high	84.1	Confident	112 Å²	112	120.6 Å²	120.6	59%	0.586	58%	0.575	S	S	*	*	H	α-helix	trans	-63.2	-49.5	174	-76.4	165.7	0	0	0	111.3	R202 L203 K208 K209 E210	R202-L206 PolarHBondContact O-N 2.96Å; L203-L206 WeakPolarHBondContact O-CB 3.44Å; L203-L206 PolarHBondContact O-N 2.88Å; L206-K208 VanDerWaalsContact C-N 3.3Å; L206-K208 PolarHBondContact O-N 2.88Å; L206-K209 WeakPolarHBondContact O-CB 3.39Å; L206-K209 PolarHBondContact O-N 2.92Å; L206-K209 VanDerWaalsContact O-N 3.1Å; L206-E210 PolarHBondContact O-N 3.33Å
207	W	91.1	Very high	85.6	Confident	129 Å²	129	120.6 Å²	120.6	49%	0.489	57%	0.567	S	S	.	*	H	α-helix	trans	-60.7	-39.4	176.6	-69.1	-14.5	0	0	0	112.4	L203 L204 K209 E210 I211	L203-W207 HydrophobicContact CD2-CD2 4.11Å; L203-W207 VanDerWaalsContact CD2-CE2 3.4Å; L203-W207 HydrophobicContact CD2-CH2 4.32Å; L203-W207 HydrophobicContact CD2-CZ2 3.53Å; L203-W207 PolarHBondContact O-N 3.28Å; L204-W207 HydrophobicContact CD1-CE3 4.48Å; W207-K209 VanDerWaalsContact C-N 3.31Å; W207-K209 PolarHBondContact O-N 3.42Å; W207-E210 PolarHBondContact O-N 3.48Å; W207-I211 WeakPolarHBondContact O-CB 3.38Å; W207-I211 WeakPolarHBondContact O-CG1 3.1Å; W207-I211 PolarHBondContact O-N 3.26Å
208	K	92.2	Very high	87	Confident	152 Å²	152	118.6 Å²	118.6	66%	0.661	56%	0.559	S	S	*	*	H	α-helix	trans	-58.9	-44.4	174.3	-177.8	-179.8	177.6	-176.9	0	111.4	L204 M205 L206 E212	L204-K208 WeakPolarHBondContact O-CB 3.22Å; L204-K208 PolarHBondContact O-N 3.47Å; M205-K208 PolarHBondContact O-N 3.35Å; L206-K208 VanDerWaalsContact C-N 3.3Å; L206-K208 PolarHBondContact O-N 2.88Å; K208-E212 PolarHBondContact O-N 3.36Å; K208-E212 VanDerWaalsContact O-N 3.1Å
209	K	92.8	Very high	88.3	Confident	128 Å²	128	119.8 Å²	119.8	56%	0.557	56%	0.559	S	S	*	*	H	α-helix	trans	-64.1	-45.6	178.4	-169.2	-171	177.6	-152.2	0	111.4	M205 L206 W207 I211 E212 E213	M205-K209 PolarHBondContact O-N 2.88Å; L206-K209 WeakPolarHBondContact O-CB 3.39Å; L206-K209 PolarHBondContact O-N 2.92Å; L206-K209 VanDerWaalsContact O-N 3.1Å; W207-K209 VanDerWaalsContact C-N 3.31Å; W207-K209 PolarHBondContact O-N 3.42Å; K209-I211 PolarHBondContact O-N 3.33Å; K209-E212 WeakPolarHBondContact O-CB 3.46Å; K209-E212 PolarHBondContact O-N 3.26Å; K209-E212 VanDerWaalsContact O-N 3.11Å; K209-E213 WeakPolarHBondContact CE-OE1 3.3Å; K209-E213 IonicContact NZ-OE1 3.25Å; K209-E213 PolarHBondContact NZ-OE1 3.41Å; K209-E213 PolarHBondContact O-N 3.34Å
210	E	95.1	Very high	89.4	Confident	118 Å²	118	121.7 Å²	121.7	55%	0.551	56%	0.564	S	S	*	*	H	α-helix	trans	-63	-40.5	178.7	-175	170.1	-157.3	0	0	112.2	L206 W207 E212 E213 M214	L206-E210 PolarHBondContact O-N 3.33Å; W207-E210 PolarHBondContact O-N 3.48Å; E210-E212 VanDerWaalsContact C-N 3.27Å; E210-E212 PolarHBondContact O-N 2.96Å; E210-E213 PolarHBondContact O-N 2.86Å; E210-M214 WeakPolarHBondContact O-CB 3.45Å; E210-M214 VanDerWaalsContact O-CG 3.23Å; E210-M214 WeakPolarHBondContact O-CG 3.33Å; E210-M214 PolarHBondContact O-N 3.42Å
211	I	94.3	Very high	90	Very high	96 Å²	96	121.6 Å²	121.6	49%	0.492	56%	0.563	S	S	.	*	H	α-helix	trans	-60.5	-40.1	173.2	-72.4	166.5	0	0	0	110.8	W207 K209 M214 K215	W207-I211 WeakPolarHBondContact O-CB 3.38Å; W207-I211 WeakPolarHBondContact O-CG1 3.1Å; W207-I211 PolarHBondContact O-N 3.26Å; K209-I211 PolarHBondContact O-N 3.33Å; I211-M214 PolarHBondContact O-N 2.83Å; I211-K215 HydrophobicContact CG2-CD 4.4Å; I211-K215 WeakPolarHBondContact O-CG 3.42Å; I211-K215 PolarHBondContact O-N 3.21Å
212	E	94.9	Very high	90.1	Very high	90 Å²	90	117.6 Å²	117.6	42%	0.421	55%	0.551	S	S	.	*	H	α-helix	trans	-69.3	-44.4	179.9	-151.3	61.2	-157	0	0	111.5	K208 K209 E210 M214 K215 E216	K208-E212 PolarHBondContact O-N 3.36Å; K208-E212 VanDerWaalsContact O-N 3.1Å; K209-E212 WeakPolarHBondContact O-CB 3.46Å; K209-E212 PolarHBondContact O-N 3.26Å; K209-E212 VanDerWaalsContact O-N 3.11Å; E210-E212 VanDerWaalsContact C-N 3.27Å; E210-E212 PolarHBondContact O-N 2.96Å; E212-M214 VanDerWaalsContact C-N 3.29Å; E212-M214 PolarHBondContact O-N 2.82Å; E212-K215 WeakPolarHBondContact O-CB 3.4Å; E212-K215 PolarHBondContact O-N 3.1Å; E212-K215 VanDerWaalsContact O-N 3.12Å; E212-K215 IonicContact OE2-NZ 3.19Å; E212-K215 PolarHBondContact OE2-NZ 3.45Å; E212-E216 WeakPolarHBondContact O-CG 3.48Å; E212-E216 PolarHBondContact O-N 2.93Å
213	E	95.1	Very high	90.1	Very high	100 Å²	100	111.3 Å²	111.3	47%	0.467	54%	0.536	S	S	.	.	H	α-helix	trans	-58.9	-40.6	172.7	-73	177.6	-169.9	0	0	111.5	K209 E210 E216 R217	K209-E213 WeakPolarHBondContact CE-OE1 3.3Å; K209-E213 IonicContact NZ-OE1 3.25Å; K209-E213 PolarHBondContact NZ-OE1 3.41Å; K209-E213 PolarHBondContact O-N 3.34Å; E210-E213 PolarHBondContact O-N 2.86Å; E213-E216 PolarHBondContact O-N 2.89Å; E213-R217 WeakPolarHBondContact O-CB 3.09Å; E213-R217 PolarHBondContact O-N 2.86Å
214	M	94.7	Very high	89.9	Confident	120 Å²	120	113.8 Å²	113.8	59%	0.591	54%	0.54	S	S	*	.	H	α-helix	trans	-67.1	-36.1	176.3	-75.4	-68.2	-76.1	0	0	112.5	E210 I211 E212 R217 K218	E210-M214 WeakPolarHBondContact O-CB 3.45Å; E210-M214 VanDerWaalsContact O-CG 3.23Å; E210-M214 WeakPolarHBondContact O-CG 3.33Å; E210-M214 PolarHBondContact O-N 3.42Å; I211-M214 PolarHBondContact O-N 2.83Å; E212-M214 VanDerWaalsContact C-N 3.29Å; E212-M214 PolarHBondContact O-N 2.82Å; M214-R217 PolarHBondContact O-N 3.36Å; M214-K218 WeakPolarHBondContact O-CB 3.41Å; M214-K218 PolarHBondContact O-N 3.23Å
215	K	91.6	Very high	89.5	Confident	108 Å²	108	111.5 Å²	111.5	47%	0.47	53%	0.53	S	S	.	.	H	α-helix	trans	-65.9	-44.2	173.4	-77.4	173.8	-174.2	168	0	111.5	I211 E212 R217 K218 T219	I211-K215 HydrophobicContact CG2-CD 4.4Å; I211-K215 WeakPolarHBondContact O-CG 3.42Å; I211-K215 PolarHBondContact O-N 3.21Å; E212-K215 WeakPolarHBondContact O-CB 3.4Å; E212-K215 PolarHBondContact O-N 3.1Å; E212-K215 VanDerWaalsContact O-N 3.12Å; E212-K215 IonicContact OE2-NZ 3.19Å; E212-K215 PolarHBondContact OE2-NZ 3.45Å; K215-R217 VanDerWaalsContact C-N 3.33Å; K215-R217 PolarHBondContact O-N 2.98Å; K215-K218 WeakPolarHBondContact O-CB 3.34Å; K215-K218 PolarHBondContact O-N 3.44Å; K215-T219 VanDerWaalsContact O-CG2 3.22Å; K215-T219 WeakPolarHBondContact O-CG2 3.49Å; K215-T219 PolarHBondContact O-N 2.9Å
216	E	93.7	Very high	88.8	Confident	123 Å²	123	111.2 Å²	111.2	58%	0.575	53%	0.531	S	S	*	.	H	α-helix	trans	-61.2	-43.4	175.2	-70.8	179.1	176	0	0	111.4	E212 E213 K218 T219 L220	E212-E216 WeakPolarHBondContact O-CG 3.48Å; E212-E216 PolarHBondContact O-N 2.93Å; E213-E216 PolarHBondContact O-N 2.89Å; E216-K218 VanDerWaalsContact C-N 3.31Å; E216-K218 PolarHBondContact O-N 3.04Å; E216-T219 PolarHBondContact O-N 3.15Å; E216-T219 PolarHBondContact O-OG1 3.09Å; E216-L220 WeakPolarHBondContact O-CB 3.5Å; E216-L220 PolarHBondContact O-N 3.47Å
217	R	93.8	Very high	88	Confident	183 Å²	183	112.5 Å²	112.5	69%	0.691	53%	0.534	S	S	*	.	H	α-helix	trans	-63.4	-39.2	175.7	-167.7	176.3	178.6	105.6	-1.5	111.6	E213 M214 K215 L221	E213-R217 WeakPolarHBondContact O-CB 3.09Å; E213-R217 PolarHBondContact O-N 2.86Å; M214-R217 PolarHBondContact O-N 3.36Å; K215-R217 VanDerWaalsContact C-N 3.33Å; K215-R217 PolarHBondContact O-N 2.98Å; R217-L221 VanDerWaalsContact O-CB 3.29Å; R217-L221 WeakPolarHBondContact O-CB 3.3Å; R217-L221 PolarHBondContact O-N 3.36Å
218	K	90.9	Very high	86.8	Confident	158 Å²	158	113.2 Å²	113.2	69%	0.687	54%	0.538	S	S	*	.	H	α-helix	trans	-63.8	-44.1	175.3	-178.7	-179.3	176.5	-179.8	0	111.4	M214 K215 E216 L221 S222	M214-K218 WeakPolarHBondContact O-CB 3.41Å; M214-K218 PolarHBondContact O-N 3.23Å; K215-K218 WeakPolarHBondContact O-CB 3.34Å; K215-K218 PolarHBondContact O-N 3.44Å; E216-K218 VanDerWaalsContact C-N 3.31Å; E216-K218 PolarHBondContact O-N 3.04Å; K218-L221 PolarHBondContact O-N 3.28Å; K218-S222 VanDerWaalsContact O-CB 3.26Å; K218-S222 WeakPolarHBondContact O-CB 3.42Å; K218-S222 PolarHBondContact O-N 2.97Å
219	T	88	Confident	85.2	Confident	94 Å²	94	114.6 Å²	114.6	58%	0.577	55%	0.549	S	S	*	.	H	α-helix	trans	-66.5	-41.8	179.9	62.8	0	0	0	0	111.3	K215 E216 S222 S223	K215-T219 VanDerWaalsContact O-CG2 3.22Å; K215-T219 WeakPolarHBondContact O-CG2 3.49Å; K215-T219 PolarHBondContact O-N 2.9Å; E216-T219 PolarHBondContact O-N 3.15Å; E216-T219 PolarHBondContact O-OG1 3.09Å; T219-S222 PolarHBondContact O-N 3.34Å; T219-S223 WeakPolarHBondContact O-CB 3.24Å; T219-S223 PolarHBondContact O-N 2.76Å
220	L	88.5	Confident	83.8	Confident	112 Å²	112	111.8 Å²	111.8	59%	0.586	56%	0.556	S	S	*	*	H	α-helix	trans	-61.4	-46.6	174.5	-179.5	67.5	0	0	0	111.9	E216 S223 R224	E216-L220 WeakPolarHBondContact O-CB 3.5Å; E216-L220 PolarHBondContact O-N 3.47Å; L220-S223 PolarHBondContact O-N 2.86Å; L220-R224 PolarHBondContact O-N 2.96Å
221	L	86.7	Confident	82.4	Confident	96 Å²	96	110.1 Å²	110.1	50%	0.503	55%	0.55	S	S	.	.	H	α-helix	trans	-68.8	-39.3	-178.7	-167.5	63.4	0	0	0	111.4	R217 K218 S223 R224 V225	R217-L221 VanDerWaalsContact O-CB 3.29Å; R217-L221 WeakPolarHBondContact O-CB 3.3Å; R217-L221 PolarHBondContact O-N 3.36Å; K218-L221 PolarHBondContact O-N 3.28Å; L221-S223 VanDerWaalsContact C-N 3.32Å; L221-S223 PolarHBondContact O-N 3.35Å; L221-R224 PolarHBondContact O-N 3.08Å; L221-V225 WeakPolarHBondContact O-CG2 3.42Å; L221-V225 PolarHBondContact O-N 3.48Å
222	S	82	Confident	80.8	Confident	60 Å²	60	108.6 Å²	108.6	42%	0.42	54%	0.543	S	S	.	.	H	α-helix	trans	-57.4	-46.5	171.8	-164.6	0	0	0	0	110.8	K218 T219 R224 V225 D226	K218-S222 VanDerWaalsContact O-CB 3.26Å; K218-S222 WeakPolarHBondContact O-CB 3.42Å; K218-S222 PolarHBondContact O-N 2.97Å; T219-S222 PolarHBondContact O-N 3.34Å; S222-R224 VanDerWaalsContact C-N 3.3Å; S222-R224 PolarHBondContact O-N 2.81Å; S222-V225 WeakPolarHBondContact O-CB 3.37Å; S222-V225 PolarHBondContact O-N 2.98Å; S222-V225 VanDerWaalsContact O-N 3.12Å; S222-D226 PolarHBondContact O-N 3.03Å
223	S	81.6	Confident	79.4	Confident	56 Å²	56	110.8 Å²	110.8	39%	0.392	56%	0.556	S	S	.	*	H	α-helix	trans	-60.9	-37.9	176.9	-178.2	0	0	0	0	112.7	T219 L220 L221 D226 Q227	T219-S223 WeakPolarHBondContact O-CB 3.24Å; T219-S223 PolarHBondContact O-N 2.76Å; L220-S223 PolarHBondContact O-N 2.86Å; L221-S223 VanDerWaalsContact C-N 3.32Å; L221-S223 PolarHBondContact O-N 3.35Å; S223-D226 PolarHBondContact O-N 3.21Å; S223-Q227 WeakPolarHBondContact O-CG 3.29Å; S223-Q227 PolarHBondContact O-N 3.19Å; S223-Q227 VanDerWaalsContact O-N 3.17Å
224	R	80.3	Confident	78.2	Confident	130 Å²	130	109.4 Å²	109.4	49%	0.491	55%	0.552	S	S	.	*	H	α-helix	trans	-66.9	-39.6	174.6	-74.8	178.8	61.7	178.7	-1.9	112.3	L220 L221 S222 D226 Q227 Y228	L220-R224 PolarHBondContact O-N 2.96Å; L221-R224 PolarHBondContact O-N 3.08Å; S222-R224 VanDerWaalsContact C-N 3.3Å; S222-R224 PolarHBondContact O-N 2.81Å; R224-D226 VanDerWaalsContact C-N 3.32Å; R224-Q227 WeakPolarHBondContact O-CB 3.48Å; R224-Q227 PolarHBondContact O-N 2.94Å; R224-Y228 WeakPolarHBondContact O-CD2 3.45Å
225	V	74.4	Confident	77.2	Confident	53 Å²	53	108.4 Å²	108.4	32%	0.321	55%	0.552	S	S	.	*	H	α-helix	trans	-63.3	-42.6	175.5	170.2	0	0	0	0	110.1	L221 S222 Q227 Y228 I233	L221-V225 WeakPolarHBondContact O-CG2 3.42Å; L221-V225 PolarHBondContact O-N 3.48Å; S222-V225 WeakPolarHBondContact O-CB 3.37Å; S222-V225 PolarHBondContact O-N 2.98Å; S222-V225 VanDerWaalsContact O-N 3.12Å; V225-Q227 PolarHBondContact O-N 3.35Å; V225-Y228 PolarHBondContact O-N 3.26Å; V225-I233 HydrophobicContact CG1-CD1 4.02Å; V225-I233 HydrophobicContact CG1-CG1 3.74Å
226	D	73.4	Confident	76.5	Confident	117 Å²	117	107.4 Å²	107.4	63%	0.626	56%	0.556	S	S	*	*	H	α-helix	trans	-61.7	-29.5	176.6	-62.3	-29	0	0	0	112.5	S222 S223 R224 Y228	S222-D226 PolarHBondContact O-N 3.03Å; S223-D226 PolarHBondContact O-N 3.21Å; R224-D226 VanDerWaalsContact C-N 3.32Å; D226-Y228 VanDerWaalsContact C-N 3.31Å; D226-Y228 PolarHBondContact O-N 3.36Å
227	Q	72.2	Confident	75.4	Confident	139 Å²	139	106.7 Å²	106.7	65%	0.65	55%	0.551	S	S	*	*	H	α-helix	trans	-68.8	-24.2	175.2	-72.4	171.1	19.9	0	0	113.7	S223 R224 V225 M229	S223-Q227 WeakPolarHBondContact O-CG 3.29Å; S223-Q227 PolarHBondContact O-N 3.19Å; S223-Q227 VanDerWaalsContact O-N 3.17Å; R224-Q227 WeakPolarHBondContact O-CB 3.48Å; R224-Q227 PolarHBondContact O-N 2.94Å; V225-Q227 PolarHBondContact O-N 3.35Å; Q227-M229 PolarHBondContact O-N 3.24Å
228	Y	66.5	Low	74.3	Confident	145 Å²	145	98.9 Å²	98.9	57%	0.569	53%	0.525	S	S	*	.	S	Bend	trans	-77.2	35.4	177.1	-71.6	-75.2	0	0	0	112.9	R224 V225 D226 G230 I231	R224-Y228 WeakPolarHBondContact O-CD2 3.45Å; V225-Y228 PolarHBondContact O-N 3.26Å; D226-Y228 VanDerWaalsContact C-N 3.31Å; D226-Y228 PolarHBondContact O-N 3.36Å; Y228-G230 VanDerWaalsContact C-N 3.33Å; Y228-G230 PolarHBondContact O-N 2.9Å; Y228-I231 WeakPolarHBondContact O-CG1 3.47Å; Y228-I231 PolarHBondContact O-N 3.38Å
229	M	58.9	Low	73.6	Confident	181 Å²	181	97.8 Å²	97.8	89%	0.892	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	34.5	55.2	165.9	-69.2	-146.8	176	0	0	115.4	Q227 I231	Q227-M229 PolarHBondContact O-N 3.24Å; M229-I231 VanDerWaalsContact C-N 3.33Å; M229-I231 PolarHBondContact O-N 2.86Å
230	G	64.2	Low	73.1	Confident	68 Å²	68	99.9 Å²	99.9	70%	0.701	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	12.1	169.1	0	0	0	0	0	115.7	Y228 D232	Y228-G230 VanDerWaalsContact C-N 3.33Å; Y228-G230 PolarHBondContact O-N 2.9Å; G230-D232 PolarHBondContact O-N 2.87Å
231	I	64.9	Low	72.5	Confident	83 Å²	83	98.6 Å²	98.6	43%	0.426	51%	0.514	S	S	.	.			trans	-68.7	126.3	165.5	-58.7	173.6	0	0	0	107.9	Y228 M229 A238	Y228-I231 WeakPolarHBondContact O-CG1 3.47Å; Y228-I231 PolarHBondContact O-N 3.38Å; M229-I231 VanDerWaalsContact C-N 3.33Å; M229-I231 PolarHBondContact O-N 2.86Å; I231-A238 HydrophobicContact CG2-CB 3.36Å
232	D	61.3	Low	72.1	Confident	65 Å²	65	98.8 Å²	98.8	35%	0.348	52%	0.515	S	S	.	.			trans	-63.4	145	-178.3	-157.5	-18.7	0	0	0	110.8	G230 D234 K237	G230-D232 PolarHBondContact O-N 2.87Å; D232-D234 PolarHBondContact O-N 2.96Å; D232-K237 HydrophobicContact CB-CB 4.02Å; D232-K237 HydrophobicContact CB-CD 4.43Å; D232-K237 WeakPolarHBondContact OD2-CD 3.36Å; D232-K237 IonicContact OD2-NZ 3.32Å; D232-K237 PolarHBondContact OD2-NZ 3.49Å
233	I	64.4	Low	72.1	Confident	136 Å²	136	99.4 Å²	99.4	70%	0.697	52%	0.52	S	S	*	.	S	Bend	trans	-65.5	-28.4	-175.8	-62.5	168.7	0	0	0	111	V225 T235	V225-I233 HydrophobicContact CG1-CD1 4.02Å; V225-I233 HydrophobicContact CG1-CG1 3.74Å; I233-T235 PolarHBondContact O-N 3.47Å
234	D	69.6	Low	72.1	Confident	71 Å²	71	100.7 Å²	100.7	38%	0.38	52%	0.522	S	S	.	.	S	Bend	trans	-70.8	114.3	176.1	-172	-24.8	0	0	0	110	D232 T236 K237 A238	D232-D234 PolarHBondContact O-N 2.96Å; D234-T236 PolarHBondContact O-N 3.47Å; D234-T236 VanDerWaalsContact O-N 3.12Å; D234-T236 PolarHBondContact OD1-N 2.9Å; D234-T236 VanDerWaalsContact OD1-N 3.08Å; D234-T236 PolarHBondContact OD1-OG1 3.4Å; D234-K237 HydrophobicContact CB-CB 4.27Å; D234-K237 HydrophobicContact CB-CD 4.22Å; D234-K237 HydrophobicContact CB-CG 4.29Å; D234-K237 PolarHBondContact O-N 3.39Å; D234-A238 PolarHBondContact O-N 2.94Å
235	T	74	Confident	72.1	Confident	98 Å²	98	96.8 Å²	96.8	60%	0.601	52%	0.518	S	S	*	.	H	α-helix	trans	-53.1	-36.7	-177	53.6	0	0	0	0	112.3	I233 A238 E239	I233-T235 PolarHBondContact O-N 3.47Å; T235-A238 PolarHBondContact O-N 2.96Å; T235-E239 WeakPolarHBondContact O-CB 3.12Å; T235-E239 VanDerWaalsContact O-CG 3.28Å; T235-E239 WeakPolarHBondContact O-CG 3.36Å; T235-E239 PolarHBondContact O-N 3.41Å
236	T	76.6	Confident	72.6	Confident	88 Å²	88	99 Å²	99	54%	0.54	53%	0.528	S	S	.	.	H	α-helix	trans	-69.6	-35.8	-179	63.9	0	0	0	0	112.3	D234 K240	D234-T236 PolarHBondContact O-N 3.47Å; D234-T236 VanDerWaalsContact O-N 3.12Å; D234-T236 PolarHBondContact OD1-N 2.9Å; D234-T236 VanDerWaalsContact OD1-N 3.08Å; D234-T236 PolarHBondContact OD1-OG1 3.4Å; T236-K240 PolarHBondContact O-N 3.36Å
237	K	71.3	Confident	73	Confident	108 Å²	108	97.1 Å²	97.1	47%	0.47	52%	0.523	S	S	.	.	H	α-helix	trans	-77.8	-38.1	175.5	-70	-177.9	-177.8	173.2	0	111.7	D232 D234 E239 K240 Q241	D232-K237 HydrophobicContact CB-CB 4.02Å; D232-K237 HydrophobicContact CB-CD 4.43Å; D232-K237 WeakPolarHBondContact OD2-CD 3.36Å; D232-K237 IonicContact OD2-NZ 3.32Å; D232-K237 PolarHBondContact OD2-NZ 3.49Å; D234-K237 HydrophobicContact CB-CB 4.27Å; D234-K237 HydrophobicContact CB-CD 4.22Å; D234-K237 HydrophobicContact CB-CG 4.29Å; D234-K237 PolarHBondContact O-N 3.39Å; K237-E239 VanDerWaalsContact C-N 3.33Å; K237-E239 PolarHBondContact O-N 3.46Å; K237-K240 PolarHBondContact O-N 3.01Å; K237-Q241 WeakPolarHBondContact O-CG 3.43Å; K237-Q241 PolarHBondContact O-N 3.4Å
238	A	70.7	Confident	73.4	Confident	19 Å²	19	97.2 Å²	97.2	16%	0.157	52%	0.524	C	S	.	.	H	α-helix	trans	-57.4	-46.8	173.9	0	0	0	0	0	111.4	I231 D234 T235 K240 Q241 L242	I231-A238 HydrophobicContact CG2-CB 3.36Å; D234-A238 PolarHBondContact O-N 2.94Å; T235-A238 PolarHBondContact O-N 2.96Å; A238-K240 VanDerWaalsContact C-N 3.31Å; A238-K240 PolarHBondContact O-N 3.48Å; A238-Q241 PolarHBondContact O-N 3.41Å; A238-L242 WeakPolarHBondContact O-CB 3.32Å; A238-L242 PolarHBondContact O-N 3.23Å
239	E	77	Confident	74.2	Confident	134 Å²	134	96.9 Å²	96.9	63%	0.626	53%	0.529	S	S	*	.	H	α-helix	trans	-60.2	-41.3	175.6	-77.1	173.5	-176.2	0	0	111.8	T235 K237 L242 S243	T235-E239 WeakPolarHBondContact O-CB 3.12Å; T235-E239 VanDerWaalsContact O-CG 3.28Å; T235-E239 WeakPolarHBondContact O-CG 3.36Å; T235-E239 PolarHBondContact O-N 3.41Å; K237-E239 VanDerWaalsContact C-N 3.33Å; K237-E239 PolarHBondContact O-N 3.46Å; E239-L242 PolarHBondContact O-N 2.84Å; E239-S243 VanDerWaalsContact O-CB 3.26Å; E239-S243 WeakPolarHBondContact O-CB 3.41Å; E239-S243 PolarHBondContact O-N 3.15Å
240	K	77.5	Confident	75.3	Confident	139 Å²	139	91.2 Å²	91.2	60%	0.604	51%	0.511	S	S	*	.	H	α-helix	trans	-66.5	-45.2	176.8	-168.5	175.3	179.5	178.1	0	112.1	T236 K237 A238 L242 S243 D244	T236-K240 PolarHBondContact O-N 3.36Å; K237-K240 PolarHBondContact O-N 3.01Å; A238-K240 VanDerWaalsContact C-N 3.31Å; A238-K240 PolarHBondContact O-N 3.48Å; K240-L242 VanDerWaalsContact C-N 3.32Å; K240-L242 PolarHBondContact O-N 2.92Å; K240-S243 PolarHBondContact O-N 3.28Å; K240-D244 WeakPolarHBondContact O-CB 2.92Å; K240-D244 PolarHBondContact O-N 2.8Å
241	Q	75.8	Confident	76.1	Confident	84 Å²	84	91.1 Å²	91.1	39%	0.393	50%	0.5	S	S	.	.	H	α-helix	trans	-61.4	-41.1	175.7	-74.9	177.7	-33	0	0	111.7	K237 A238 D244 A245	K237-Q241 WeakPolarHBondContact O-CG 3.43Å; K237-Q241 PolarHBondContact O-N 3.4Å; A238-Q241 PolarHBondContact O-N 3.41Å; Q241-D244 PolarHBondContact O-N 3.49Å; Q241-A245 VanDerWaalsContact O-CB 3.23Å; Q241-A245 WeakPolarHBondContact O-CB 3.32Å; Q241-A245 PolarHBondContact O-N 2.87Å
242	L	78.7	Confident	76.8	Confident	100 Å²	100	90.7 Å²	90.7	52%	0.524	50%	0.501	S	S	.	.	H	α-helix	trans	-64.4	-45.8	175.1	-170.2	83.1	0	0	0	110.9	A238 E239 K240 A245 L246	A238-L242 WeakPolarHBondContact O-CB 3.32Å; A238-L242 PolarHBondContact O-N 3.23Å; E239-L242 PolarHBondContact O-N 2.84Å; K240-L242 VanDerWaalsContact C-N 3.32Å; K240-L242 PolarHBondContact O-N 2.92Å; L242-A245 PolarHBondContact O-N 3.08Å; L242-L246 HydrophobicContact CD2-CD1 4.23Å; L242-L246 HydrophobicContact CG-CD1 4.03Å; L242-L246 HydrophobicContact CG-CG 4.44Å; L242-L246 WeakPolarHBondContact O-CB 3.33Å; L242-L246 VanDerWaalsContact O-CG 3.23Å; L242-L246 WeakPolarHBondContact O-CG 3.39Å; L242-L246 PolarHBondContact O-N 3.03Å
243	S	81.7	Confident	77.7	Confident	73 Å²	73	92.6 Å²	92.6	51%	0.51	51%	0.511	S	S	.	.	H	α-helix	trans	-61.5	-44.2	177.2	-174.7	0	0	0	0	111.6	E239 K240 L246 S247	E239-S243 VanDerWaalsContact O-CB 3.26Å; E239-S243 WeakPolarHBondContact O-CB 3.41Å; E239-S243 PolarHBondContact O-N 3.15Å; K240-S243 PolarHBondContact O-N 3.28Å; S243-L246 PolarHBondContact O-N 3.13Å; S243-S247 WeakPolarHBondContact O-CB 3.39Å; S243-S247 PolarHBondContact O-N 2.84Å
244	D	81.6	Confident	78.2	Confident	83 Å²	83	89.4 Å²	89.4	44%	0.444	50%	0.5	S	S	.	.	H	α-helix	trans	-63.9	-42.8	176.4	-70.7	-16.2	0	0	0	110.6	K240 Q241 S247 Q248	K240-D244 WeakPolarHBondContact O-CB 2.92Å; K240-D244 PolarHBondContact O-N 2.8Å; Q241-D244 PolarHBondContact O-N 3.49Å; D244-S247 PolarHBondContact O-N 3.43Å; D244-Q248 WeakPolarHBondContact O-CG 3.31Å; D244-Q248 PolarHBondContact O-N 3.13Å
245	A	80.5	Confident	78.4	Confident	49 Å²	49	91.5 Å²	91.5	41%	0.405	51%	0.508	S	S	.	.	H	α-helix	trans	-65.1	-41.6	175.8	0	0	0	0	0	112.3	Q241 L242 Q248 M249	Q241-A245 VanDerWaalsContact O-CB 3.23Å; Q241-A245 WeakPolarHBondContact O-CB 3.32Å; Q241-A245 PolarHBondContact O-N 2.87Å; L242-A245 PolarHBondContact O-N 3.08Å; A245-Q248 PolarHBondContact O-N 3.45Å; A245-M249 WeakPolarHBondContact O-CB 3.41Å; A245-M249 PolarHBondContact O-N 2.87Å
246	L	83.5	Confident	78.2	Confident	99 Å²	99	90.3 Å²	90.3	52%	0.518	50%	0.498	S	S	.	.	H	α-helix	trans	-65.6	-38.3	175	-74.7	170.2	0	0	0	111.5	L242 S243 M249 A250	L242-L246 HydrophobicContact CD2-CD1 4.23Å; L242-L246 HydrophobicContact CG-CD1 4.03Å; L242-L246 HydrophobicContact CG-CG 4.44Å; L242-L246 WeakPolarHBondContact O-CB 3.33Å; L242-L246 VanDerWaalsContact O-CG 3.23Å; L242-L246 WeakPolarHBondContact O-CG 3.39Å; L242-L246 PolarHBondContact O-N 3.03Å; S243-L246 PolarHBondContact O-N 3.13Å; L246-M249 WeakPolarHBondContact O-CB 3.33Å; L246-M249 PolarHBondContact O-N 3.18Å; L246-A250 WeakPolarHBondContact O-CB 3.44Å; L246-A250 PolarHBondContact O-N 3.45Å
247	S	81.8	Confident	77.7	Confident	77 Å²	77	91 Å²	91	54%	0.538	50%	0.495	S	S	.	.	H	α-helix	trans	-66.1	-41	175.1	-170.4	0	0	0	0	111.5	S243 D244 A250 S251	S243-S247 WeakPolarHBondContact O-CB 3.39Å; S243-S247 PolarHBondContact O-N 2.84Å; D244-S247 PolarHBondContact O-N 3.43Å; S247-A250 PolarHBondContact O-N 3.3Å; S247-S251 WeakPolarHBondContact O-CB 3.32Å; S247-S251 PolarHBondContact O-N 3.27Å
248	Q	82.1	Confident	77.5	Confident	141 Å²	141	94.9 Å²	94.9	66%	0.659	51%	0.512	S	S	*	.	H	α-helix	trans	-62.4	-43.7	171.5	-73.2	-179.9	23	0	0	111.5	D244 A245 S251 V252	D244-Q248 WeakPolarHBondContact O-CG 3.31Å; D244-Q248 PolarHBondContact O-N 3.13Å; A245-Q248 PolarHBondContact O-N 3.45Å; Q248-S251 WeakPolarHBondContact O-CB 3.35Å; Q248-S251 PolarHBondContact O-N 3.1Å; Q248-V252 WeakPolarHBondContact O-CG2 3.48Å; Q248-V252 PolarHBondContact O-N 2.92Å
249	M	81.6	Confident	77.2	Confident	139 Å²	139	100.6 Å²	100.6	69%	0.685	54%	0.538	S	S	*	.	H	α-helix	trans	-58.5	-49.8	174.9	-115.9	-179.4	172.7	0	0	111.1	A245 L246 S251 V252 D253	A245-M249 WeakPolarHBondContact O-CB 3.41Å; A245-M249 PolarHBondContact O-N 2.87Å; L246-M249 WeakPolarHBondContact O-CB 3.33Å; L246-M249 PolarHBondContact O-N 3.18Å; M249-S251 VanDerWaalsContact C-N 3.29Å; M249-S251 PolarHBondContact O-N 2.78Å; M249-V252 CarbonylContact O-C 3.59Å; M249-V252 PolarHBondContact O-N 3.27Å; M249-D253 WeakPolarHBondContact O-CB 3.48Å; M249-D253 PolarHBondContact O-N 3.05Å
250	A	82.6	Confident	76.2	Confident	61 Å²	61	100 Å²	100	50%	0.504	54%	0.537	S	S	.	.	H	α-helix	trans	-62.8	-34.9	178.7	0	0	0	0	0	112.7	L246 S247 D253 S254	L246-A250 WeakPolarHBondContact O-CB 3.44Å; L246-A250 PolarHBondContact O-N 3.45Å; S247-A250 PolarHBondContact O-N 3.3Å; A250-D253 PolarHBondContact O-N 3.21Å; A250-S254 VanDerWaalsContact O-CB 3.32Å; A250-S254 WeakPolarHBondContact O-CB 3.47Å; A250-S254 PolarHBondContact O-N 3.02Å
251	S	80.3	Confident	75	Confident	66 Å²	66	96.4 Å²	96.4	46%	0.462	54%	0.539	S	S	.	.	H	α-helix	trans	-65.5	-47.1	173.4	-177.8	0	0	0	0	111.5	S247 Q248 M249 D253 S254 Q255	S247-S251 WeakPolarHBondContact O-CB 3.32Å; S247-S251 PolarHBondContact O-N 3.27Å; Q248-S251 WeakPolarHBondContact O-CB 3.35Å; Q248-S251 PolarHBondContact O-N 3.1Å; M249-S251 VanDerWaalsContact C-N 3.29Å; M249-S251 PolarHBondContact O-N 2.78Å; S251-D253 VanDerWaalsContact C-N 3.31Å; S251-D253 PolarHBondContact O-N 3.19Å; S251-S254 PolarHBondContact O-N 3.4Å; S251-Q255 WeakPolarHBondContact O-CG 3.36Å; S251-Q255 PolarHBondContact O-N 3.46Å
252	V	80.5	Confident	73.8	Confident	74 Å²	74	97.7 Å²	97.7	45%	0.448	54%	0.544	S	S	.	.	H	α-helix	trans	-62.6	-40.4	175.1	172.2	0	0	0	0	110.7	Q248 M249 Q255 L256	Q248-V252 WeakPolarHBondContact O-CG2 3.48Å; Q248-V252 PolarHBondContact O-N 2.92Å; M249-V252 CarbonylContact O-C 3.59Å; M249-V252 PolarHBondContact O-N 3.27Å; V252-Q255 CarbonylContact O-C 3.59Å; V252-Q255 WeakPolarHBondContact O-CB 3.24Å; V252-Q255 PolarHBondContact O-N 2.91Å; V252-L256 HydrophobicContact CG1-CD1 3.96Å; V252-L256 HydrophobicContact CG1-CG 4.28Å; V252-L256 WeakPolarHBondContact O-CB 3.47Å; V252-L256 WeakPolarHBondContact O-CG 3.4Å; V252-L256 PolarHBondContact O-N 3.37Å
253	D	80.3	Confident	72.4	Confident	106 Å²	106	100.6 Å²	100.6	57%	0.567	56%	0.56	S	S	*	*	H	α-helix	trans	-67.1	-40.7	179	-140.3	25.8	0	0	0	110.7	M249 A250 S251 Q255 L256 Q257	M249-D253 WeakPolarHBondContact O-CB 3.48Å; M249-D253 PolarHBondContact O-N 3.05Å; A250-D253 PolarHBondContact O-N 3.21Å; S251-D253 VanDerWaalsContact C-N 3.31Å; S251-D253 PolarHBondContact O-N 3.19Å; D253-Q255 VanDerWaalsContact C-N 3.34Å; D253-Q255 PolarHBondContact O-N 3.48Å; D253-L256 PolarHBondContact O-N 2.89Å; D253-Q257 WeakPolarHBondContact O-CB 3.37Å; D253-Q257 PolarHBondContact O-N 3.4Å
254	S	74.2	Confident	70.6	Confident	68 Å²	68	100.4 Å²	100.4	48%	0.476	56%	0.563	S	S	.	*	H	α-helix	trans	-63.7	-38.6	172.2	-170.9	0	0	0	0	112.2	A250 S251 Q257 K258	A250-S254 VanDerWaalsContact O-CB 3.32Å; A250-S254 WeakPolarHBondContact O-CB 3.47Å; A250-S254 PolarHBondContact O-N 3.02Å; S251-S254 PolarHBondContact O-N 3.4Å; S254-Q257 PolarHBondContact O-N 3.48Å; S254-K258 WeakPolarHBondContact O-CB 3.48Å; S254-K258 PolarHBondContact O-N 3.17Å
255	Q	74.4	Confident	68.9	Low	116 Å²	116	107.2 Å²	107.2	54%	0.542	58%	0.582	S	S	.	*	H	α-helix	trans	-65.6	-45.2	173.6	-75.2	-177.4	-19.9	0	0	111.8	S251 V252 D253 Q257 K258 I259	S251-Q255 WeakPolarHBondContact O-CG 3.36Å; S251-Q255 PolarHBondContact O-N 3.46Å; V252-Q255 CarbonylContact O-C 3.59Å; V252-Q255 WeakPolarHBondContact O-CB 3.24Å; V252-Q255 PolarHBondContact O-N 2.91Å; D253-Q255 VanDerWaalsContact C-N 3.34Å; D253-Q255 PolarHBondContact O-N 3.48Å; Q255-Q257 VanDerWaalsContact C-N 3.32Å; Q255-Q257 PolarHBondContact O-N 2.99Å; Q255-K258 WeakPolarHBondContact O-CB 3.44Å; Q255-K258 PolarHBondContact O-N 3.5Å; Q255-I259 WeakPolarHBondContact O-CB 3.31Å; Q255-I259 VanDerWaalsContact O-CG1 3.24Å; Q255-I259 WeakPolarHBondContact O-CG1 3.46Å; Q255-I259 PolarHBondContact O-N 2.95Å
256	L	69.9	Low	66.8	Low	72 Å²	72	116.2 Å²	116.2	38%	0.377	62%	0.624	S	S	.	*	H	α-helix	trans	-62.7	-39.8	174.9	-75.1	172.9	0	0	0	111	V252 D253 K258 I259 M260	V252-L256 HydrophobicContact CG1-CD1 3.96Å; V252-L256 HydrophobicContact CG1-CG 4.28Å; V252-L256 WeakPolarHBondContact O-CB 3.47Å; V252-L256 WeakPolarHBondContact O-CG 3.4Å; V252-L256 PolarHBondContact O-N 3.37Å; D253-L256 PolarHBondContact O-N 2.89Å; L256-K258 VanDerWaalsContact C-N 3.32Å; L256-K258 PolarHBondContact O-N 3.37Å; L256-I259 PolarHBondContact O-N 3.36Å; L256-M260 HydrophobicContact CB-CE 4.33Å; L256-M260 HydrophobicContact CD2-CE 4.2Å; L256-M260 WeakPolarHBondContact O-CB 3.49Å; L256-M260 PolarHBondContact O-N 3.08Å
257	Q	66.3	Low	65.9	Low	104 Å²	104	117.1 Å²	117.1	49%	0.486	63%	0.629	S	S	.	*	H	α-helix	trans	-65.6	-36.7	176.5	-163.2	169.9	22.3	0	0	111.4	D253 S254 Q255 G261 F262	D253-Q257 WeakPolarHBondContact O-CB 3.37Å; D253-Q257 PolarHBondContact O-N 3.4Å; S254-Q257 PolarHBondContact O-N 3.48Å; Q255-Q257 VanDerWaalsContact C-N 3.32Å; Q255-Q257 PolarHBondContact O-N 2.99Å; Q257-G261 PolarHBondContact O-N 3.23Å; Q257-F262 PolarHBondContact NE2-O 3.06Å
258	K	66.4	Low	65.1	Low	189 Å²	189	119.2 Å²	119.2	82%	0.822	63%	0.634	S	S	*	*	H	α-helix	trans	-67.5	-37.6	171.6	-118.6	175.4	-178.6	172.7	0	113.1	S254 Q255 L256	S254-K258 WeakPolarHBondContact O-CB 3.48Å; S254-K258 PolarHBondContact O-N 3.17Å; Q255-K258 WeakPolarHBondContact O-CB 3.44Å; Q255-K258 PolarHBondContact O-N 3.5Å; L256-K258 VanDerWaalsContact C-N 3.32Å; L256-K258 PolarHBondContact O-N 3.37Å
259	I	65.3	Low	64.2	Low	138 Å²	138	118 Å²	118	71%	0.708	63%	0.632	S	S	*	*	H	α-helix	trans	-80.5	-36.2	-177.4	-68.5	166.6	0	0	0	111.4	Q255 L256	Q255-I259 WeakPolarHBondContact O-CB 3.31Å; Q255-I259 VanDerWaalsContact O-CG1 3.24Å; Q255-I259 WeakPolarHBondContact O-CG1 3.46Å; Q255-I259 PolarHBondContact O-N 2.95Å; L256-I259 PolarHBondContact O-N 3.36Å
260	M	55	Low	63.1	Low	121 Å²	121	116.8 Å²	116.8	60%	0.596	63%	0.629	S	S	*	*	H	α-helix	trans	-105.3	-2	-174.5	-63.2	-161.3	-68.1	0	0	114.9	L256 F262	L256-M260 HydrophobicContact CB-CE 4.33Å; L256-M260 HydrophobicContact CD2-CE 4.2Å; L256-M260 WeakPolarHBondContact O-CB 3.49Å; L256-M260 PolarHBondContact O-N 3.08Å; M260-F262 VanDerWaalsContact C-N 3.33Å; M260-F262 HydrophobicContact CB-CD2 4.44Å; M260-F262 PolarHBondContact O-N 3.47Å
261	G	53.5	Low	61.9	Low	64 Å²	64	120.3 Å²	120.3	66%	0.66	64%	0.637	S	S	*	*			trans	61.2	31.6	166.2	0	0	0	0	0	115.7	Q257 N263	Q257-G261 PolarHBondContact O-N 3.23Å; G261-N263 PolarHBondContact O-N 3.46Å
262	F	48.8	Very low	60.7	Low	111 Å²	111	123.9 Å²	123.9	49%	0.487	65%	0.649	S	S	.	*			trans	-88	90.4	-179	-101.2	-80.3	0	0	0	112	Q257 M260 A264 W265	Q257-F262 PolarHBondContact NE2-O 3.06Å; M260-F262 VanDerWaalsContact C-N 3.33Å; M260-F262 HydrophobicContact CB-CD2 4.44Å; M260-F262 PolarHBondContact O-N 3.47Å; F262-A264 VanDerWaalsContact C-N 3.33Å; F262-A264 HydrophobicContact CD1-CB 4.4Å; F262-W265 AromaticContact CD1-CD1 3.45Å; F262-W265 VanDerWaalsContact CD1-CD1 3.45Å; F262-W265 AromaticContact CD1-NE1 3.67Å; F262-W265 AromaticContact CE1-CD1 3.55Å; F262-W265 AromaticContact CE1-NE1 3.26Å; F262-W265 VanDerWaalsContact CE1-NE1 3.26Å
263	N	49.5	Very low	59.3	Low	161 Å²	161	127.4 Å²	127.4	86%	0.861	66%	0.663	S	S	*	*			trans	-98.4	37.7	158.3	-71.3	-10.5	0	0	0	110.9	G261	G261-N263 PolarHBondContact O-N 3.46Å
264	A	44.2	Very low	57.7	Low	69 Å²	69	129.1 Å²	129.1	57%	0.57	67%	0.671	S	S	*	*			trans	-143.3	51.5	-174.1	0	0	0	0	0	113.1	F262	F262-A264 VanDerWaalsContact C-N 3.33Å; F262-A264 HydrophobicContact CD1-CB 4.4Å
265	W	46	Very low	56.3	Low	226 Å²	226	134.2 Å²	134.2	86%	0.856	69%	0.687	S	S	*	*			trans	-137	67.7	156.2	-74.9	67.5	0	0	0	107.9	F262	F262-W265 AromaticContact CD1-CD1 3.45Å; F262-W265 VanDerWaalsContact CD1-CD1 3.45Å; F262-W265 AromaticContact CD1-NE1 3.67Å; F262-W265 AromaticContact CE1-CD1 3.55Å; F262-W265 AromaticContact CE1-NE1 3.26Å; F262-W265 VanDerWaalsContact CE1-NE1 3.26Å
266	N	36.3	Very low	54.6	Low	239 Å²	239	135.8 Å²	135.8	100%	1.278	70%	0.7	S	S	*	*			trans	-97.6	0	143.7	-85.8	-12.4	0	0	0	106.6

Retrieved 266 of 266 residues in 578.4 ms (Link to these results)

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