A0A3Q0KTV4_SCHMA Loading...

Syntaxin, putative

AlphaFold DB , UniProt , Accession A0A3Q0KTV4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 294 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51	Low	53.6	Low	196 Å²	196	129.1 Å²	129.1	97%	0.966	65%	0.653	S	S	*	*				0	-24.6	0	-85.6	-158.1	-93.1	0	0	116.4
2	A	50.5	Low	53.4	Low	85 Å²	85	126.7 Å²	126.7	70%	0.702	64%	0.643	S	S	*	*	H	α-helix	trans	-77.2	-28.5	175.3	0	0	0	0	0	113.7
3	K	50.7	Low	53.1	Low	188 Å²	188	128.7 Å²	128.7	82%	0.817	66%	0.656	S	S	*	*	H	α-helix	trans	-70	-35.3	175.2	-75.5	-173.9	172.9	-175.5	0	112.7	A7	K3-A7 PolarHBondContact O-N 3.13Å
4	D	56.5	Low	52.8	Low	100 Å²	100	131.6 Å²	131.6	54%	0.535	67%	0.666	S	S	.	*	H	α-helix	trans	-70	-34.6	-178	-58.2	-51.2	0	0	0	113.3	F6 A7 V8	D4-F6 VanDerWaalsContact C-N 3.34Å; D4-F6 PolarHBondContact O-N 3.22Å; D4-A7 PolarHBondContact O-N 3.25Å; D4-V8 WeakPolarHBondContact O-CG2 3.35Å; D4-V8 PolarHBondContact O-N 3.29Å
5	L	52.4	Low	52.1	Low	96 Å²	96	129.3 Å²	129.3	50%	0.503	66%	0.655	S	S	.	*	H	α-helix	trans	-66.7	-37.2	-178.6	-171.8	66.3	0	0	0	112	L9	L5-L9 HydrophobicContact CG-CD1 4.31Å; L5-L9 VanDerWaalsContact O-CG 3.31Å; L5-L9 WeakPolarHBondContact O-CG 3.24Å; L5-L9 PolarHBondContact O-N 2.95Å; L5-L9 VanDerWaalsContact O-N 3.1Å
6	F	49.2	Very low	51.6	Low	164 Å²	164	127.9 Å²	127.9	72%	0.719	66%	0.658	S	S	*	*	H	α-helix	trans	-68.6	-35	174.9	-91.9	-80.8	0	0	0	112.2	D4 R10	D4-F6 VanDerWaalsContact C-N 3.34Å; D4-F6 PolarHBondContact O-N 3.22Å; F6-R10 PolarHBondContact O-N 3.06Å
7	A	61.6	Low	50.9	Low	62 Å²	62	129.8 Å²	129.8	51%	0.512	67%	0.669	S	S	.	*	H	α-helix	trans	-66.7	-43.8	175.5	0	0	0	0	0	111.8	K3 D4 L9 R10 Q11	K3-A7 PolarHBondContact O-N 3.13Å; D4-A7 PolarHBondContact O-N 3.25Å; A7-L9 PolarHBondContact O-N 3.4Å; A7-R10 PolarHBondContact O-N 3.25Å; A7-Q11 PolarHBondContact O-N 3.46Å
8	V	58.1	Low	50.3	Low	76 Å²	76	129.8 Å²	129.8	46%	0.461	67%	0.67	S	S	.	*	H	α-helix	trans	-64.8	-40.1	178.7	173.1	0	0	0	0	111.7	D4 R10 Q11 N12	D4-V8 WeakPolarHBondContact O-CG2 3.35Å; D4-V8 PolarHBondContact O-N 3.29Å; V8-R10 VanDerWaalsContact C-N 3.29Å; V8-R10 PolarHBondContact O-N 3.01Å; V8-Q11 PolarHBondContact O-N 3.45Å; V8-N12 PolarHBondContact O-N 3.35Å
9	L	48.3	Very low	49.6	Very low	76 Å²	76	127.7 Å²	127.7	40%	0.398	67%	0.666	S	S	.	*	H	α-helix	trans	-71.1	-23.5	178.3	-67.9	175.5	0	0	0	113.3	L5 A7 L15	L5-L9 HydrophobicContact CG-CD1 4.31Å; L5-L9 VanDerWaalsContact O-CG 3.31Å; L5-L9 WeakPolarHBondContact O-CG 3.24Å; L5-L9 PolarHBondContact O-N 2.95Å; L5-L9 VanDerWaalsContact O-N 3.1Å; A7-L9 PolarHBondContact O-N 3.4Å; L9-L15 HydrophobicContact CB-CD1 3.96Å; L9-L15 HydrophobicContact CD1-CD1 4.35Å
10	R	55.3	Low	49.1	Very low	216 Å²	216	125.2 Å²	125.2	82%	0.815	66%	0.659	S	S	*	*	H	α-helix	trans	-72.8	-32.4	172.3	-157.8	178.5	-161.9	167.8	6.1	112.1	F6 A7 V8 N12	F6-R10 PolarHBondContact O-N 3.06Å; A7-R10 PolarHBondContact O-N 3.25Å; V8-R10 VanDerWaalsContact C-N 3.29Å; V8-R10 PolarHBondContact O-N 3.01Å; R10-N12 VanDerWaalsContact C-N 3.34Å
11	Q	56.1	Low	49.1	Very low	161 Å²	161	124.1 Å²	124.1	75%	0.752	67%	0.669	S	S	*	*	H	α-helix	trans	-70.9	-30.6	179.3	-169.9	174.8	5.4	0	0	112.5	A7 V8 N13	A7-Q11 PolarHBondContact O-N 3.46Å; V8-Q11 PolarHBondContact O-N 3.45Å; Q11-N13 VanDerWaalsContact C-N 3.34Å; Q11-N13 PolarHBondContact O-N 3.36Å
12	N	51.2	Low	48.7	Very low	100 Å²	100	123.6 Å²	123.6	54%	0.535	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.3	9.9	-174.5	-74.7	-4.9	0	0	0	115	V8 R10 E14	V8-N12 PolarHBondContact O-N 3.35Å; R10-N12 VanDerWaalsContact C-N 3.34Å; N12-E14 WeakPolarHBondContact O-CG 3.43Å; N12-E14 PolarHBondContact O-N 2.97Å
13	N	49.6	Very low	48	Very low	153 Å²	153	126.1 Å²	126.1	82%	0.818	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.9	17.9	170	-150.2	32.7	0	0	0	116.5	Q11	Q11-N13 VanDerWaalsContact C-N 3.34Å; Q11-N13 PolarHBondContact O-N 3.36Å
14	E	49.1	Very low	47.6	Very low	170 Å²	170	120.2 Å²	120.2	79%	0.794	65%	0.647	S	S	*	*			trans	-105.2	15.9	-174.7	-82.5	-172.3	161.4	0	0	113.4	N12	N12-E14 WeakPolarHBondContact O-CG 3.43Å; N12-E14 PolarHBondContact O-N 2.97Å
15	L	41.4	Very low	46.8	Very low	96 Å²	96	122 Å²	122	50%	0.503	66%	0.661	S	S	.	*	S	Bend	trans	-114.1	115.1	166.2	-74.3	166.3	0	0	0	108.1	L9 N17	L9-L15 HydrophobicContact CB-CD1 3.96Å; L9-L15 HydrophobicContact CD1-CD1 4.35Å; L15-N17 PolarHBondContact O-N 3.47Å
16	P	44.4	Very low	46.4	Very low	107 Å²	107	122.5 Å²	122.5	70%	0.695	67%	0.668	S	S	*	*			trans	-51.3	133.9	168.2	9.2	-11.3	0	0	0	107	L18	P16-L18 PolarHBondContact O-N 3.08Å
17	N	40.6	Very low	46.2	Very low	160 Å²	160	120.7 Å²	120.7	86%	0.856	67%	0.67	S	S	*	*			trans	-52	82	-171.7	-155.1	13.5	0	0	0	110.2	L15 P19	L15-N17 PolarHBondContact O-N 3.47Å; N17-P19 WeakPolarHBondContact O-CD 3.32Å
18	L	39.6	Very low	45.9	Very low	131 Å²	131	122.9 Å²	122.9	69%	0.686	67%	0.674	S	S	*	*			trans	-74	112.1	174.7	-86.1	141.8	0	0	0	103.6	P16 S20	P16-L18 PolarHBondContact O-N 3.08Å; L18-S20 PolarHBondContact O-N 3.26Å
19	P	37.5	Very low	45.7	Very low	89 Å²	89	121.2 Å²	121.2	58%	0.578	67%	0.671	S	S	*	*			trans	-52.3	125.2	-175.3	19.1	-29.6	0	0	0	107.9	N17 A21	N17-P19 WeakPolarHBondContact O-CD 3.32Å; P19-A21 PolarHBondContact O-N 2.91Å
20	S	38.6	Very low	46.5	Very low	77 Å²	77	119.1 Å²	119.1	54%	0.538	67%	0.669	S	S	.	*			trans	-41.8	129.2	172.8	17.9	0	0	0	0	108.2	L18 E22 E23	L18-S20 PolarHBondContact O-N 3.26Å; S20-E22 PolarHBondContact O-N 3.39Å; S20-E23 PolarHBondContact O-N 2.95Å
21	A	49.1	Very low	47.7	Very low	104 Å²	104	111.8 Å²	111.8	86%	0.86	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	21.3	-176.6	0	0	0	0	0	115	P19	P19-A21 PolarHBondContact O-N 2.91Å
22	E	42.9	Very low	49.1	Very low	185 Å²	185	109 Å²	109	86%	0.864	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	-10.5	165.7	-81.3	177.5	155.4	0	0	113.1	S20 A24	S20-E22 PolarHBondContact O-N 3.39Å; E22-A24 PolarHBondContact O-N 3.26Å; E22-A24 VanDerWaalsContact O-N 3.16Å
23	E	35.5	Very low	50.7	Low	138 Å²	138	105 Å²	105	65%	0.645	62%	0.615	S	S	*	*			trans	-88.2	54.6	158.5	-72.7	178.8	-177.3	0	0	108.9	S20 V25	S20-E23 PolarHBondContact O-N 2.95Å; E23-V25 PolarHBondContact O-N 3.22Å
24	A	41.9	Very low	52.7	Low	64 Å²	64	102.9 Å²	102.9	53%	0.529	60%	0.604	S	S	.	*			trans	-63.5	84.7	153.7	0	0	0	0	0	106.5	E22 V26	E22-A24 PolarHBondContact O-N 3.26Å; E22-A24 VanDerWaalsContact O-N 3.16Å; A24-V26 HydrophobicContact CB-CG2 4.02Å; A24-V26 PolarHBondContact O-N 3.18Å
25	V	40.5	Very low	54.7	Low	136 Å²	136	100 Å²	100	82%	0.824	59%	0.594	S	S	*	*			trans	-66.6	72.6	163.8	-175.8	0	0	0	0	106.6	E23	E23-V25 PolarHBondContact O-N 3.22Å
26	V	43.6	Very low	57.1	Low	108 Å²	108	95.7 Å²	95.7	66%	0.655	57%	0.571	S	S	*	*			trans	-121.6	13.9	178.4	-173	0	0	0	0	109.9	A24	A24-V26 HydrophobicContact CB-CG2 4.02Å; A24-V26 PolarHBondContact O-N 3.18Å
27	V	46.4	Very low	59.5	Low	125 Å²	125	94.5 Å²	94.5	76%	0.758	56%	0.555	S	S	*	*	H	α-helix	trans	-85.5	-21.4	-170.9	-176	0	0	0	0	113.8
28	D	53.8	Low	62	Low	109 Å²	109	90.5 Å²	90.5	58%	0.583	54%	0.54	S	S	*	.	H	α-helix	trans	-86.5	-37.6	-179.9	-162.6	52.5	0	0	0	113.8	G30 S31 Q32	D28-G30 PolarHBondContact O-N 3.36Å; D28-S31 PolarHBondContact O-N 3.26Å; D28-Q32 PolarHBondContact O-N 2.95Å; D28-Q32 PolarHBondContact OD2-NE2 3.02Å
29	G	54	Low	64.7	Low	40 Å²	40	87.3 Å²	87.3	41%	0.412	52%	0.521	S	S	.	.	H	α-helix	trans	-64.5	-37.1	179.9	0	0	0	0	0	113.4	S31 Q32 M33	G29-S31 PolarHBondContact O-N 2.79Å; G29-Q32 PolarHBondContact O-N 2.92Å; G29-M33 WeakPolarHBondContact O-CB 2.98Å; G29-M33 PolarHBondContact O-N 3.23Å
30	G	66.2	Low	67.5	Low	33 Å²	33	83.1 Å²	83.1	34%	0.34	49%	0.494	S	S	.	.	H	α-helix	trans	-59.3	-46.7	175.4	0	0	0	0	0	111.9	D28 Q32 M33 D34	D28-G30 PolarHBondContact O-N 3.36Å; G30-Q32 PolarHBondContact O-N 3.43Å; G30-M33 PolarHBondContact O-N 2.91Å; G30-D34 WeakPolarHBondContact O-CB 3.29Å; G30-D34 PolarHBondContact O-N 3.32Å
31	S	80.4	Confident	70.2	Confident	62 Å²	62	83.2 Å²	83.2	43%	0.434	49%	0.486	S	S	.	.	H	α-helix	trans	-61.6	-46.1	179.7	-179.8	0	0	0	0	112.5	D28 G29 M33 D34 L35	D28-S31 PolarHBondContact O-N 3.26Å; G29-S31 PolarHBondContact O-N 2.79Å; S31-M33 VanDerWaalsContact C-N 3.3Å; S31-M33 PolarHBondContact O-N 3.4Å; S31-D34 PolarHBondContact O-N 2.96Å; S31-L35 WeakPolarHBondContact O-CG 3.33Å; S31-L35 PolarHBondContact O-N 3.1Å
32	Q	84.2	Confident	72.5	Confident	102 Å²	102	81.1 Å²	81.1	48%	0.477	46%	0.456	S	S	.	.	H	α-helix	trans	-66	-35.2	179.5	-64.9	-173.3	22.5	0	0	112.5	D28 G29 G30 F36 R119	D28-Q32 PolarHBondContact O-N 2.95Å; D28-Q32 PolarHBondContact OD2-NE2 3.02Å; G29-Q32 PolarHBondContact O-N 2.92Å; G30-Q32 PolarHBondContact O-N 3.43Å; Q32-F36 PolarHBondContact O-N 3.43Å; Q32-R119 PolarHBondContact O-NH2 2.9Å
33	M	86	Confident	75.1	Confident	15 Å²	15	72.3 Å²	72.3	7%	0.074	42%	0.415	C	S	.	.	H	α-helix	trans	-74.4	-35.9	177.8	-158.9	65.4	-176.8	0	0	112	G29 G30 S31 F36 F37 D115 I118 R119	G29-M33 WeakPolarHBondContact O-CB 2.98Å; G29-M33 PolarHBondContact O-N 3.23Å; G30-M33 PolarHBondContact O-N 2.91Å; S31-M33 VanDerWaalsContact C-N 3.3Å; S31-M33 PolarHBondContact O-N 3.4Å; M33-F36 HydrophobicContact CE-CD1 3.68Å; M33-F36 HydrophobicContact CE-CE1 3.93Å; M33-F36 WeakPolarHBondContact O-CB 3.42Å; M33-F36 PolarHBondContact O-N 2.97Å; M33-F36 HydrophobicContact SD-CD1 3.91Å; M33-F36 HydrophobicContact SD-CG 4.49Å; M33-F37 HydrophobicContact CB-CE2 4.42Å; M33-F37 HydrophobicContact CE-CE1 3.83Å; M33-F37 HydrophobicContact CE-CE2 3.76Å; M33-F37 HydrophobicContact CE-CZ 3.33Å; M33-F37 HydrophobicContact CG-CD2 3.84Å; M33-F37 HydrophobicContact CG-CE2 3.35Å; M33-F37 HydrophobicContact CG-CZ 3.98Å; M33-F37 WeakPolarHBondContact O-CD2 3.46Å; M33-F37 WeakPolarHBondContact O-CG 3.48Å; M33-F37 PolarHBondContact O-N 3.25Å; M33-F37 HydrophobicContact SD-CE2 4.37Å; M33-F37 HydrophobicContact SD-CZ 4.49Å; M33-D115 HydrophobicContact SD-CB 4.2Å; M33-I118 HydrophobicContact CE-CB 3.8Å; M33-I118 HydrophobicContact CE-CD1 4.18Å; M33-I118 HydrophobicContact CE-CG2 3.43Å; M33-I118 VanDerWaalsContact CE-CG2 3.43Å; M33-R119 HydrophobicContact CE-CG 4.45Å; M33-R119 HydrophobicContact SD-CG 4.46Å
34	D	90.8	Very high	78.1	Confident	109 Å²	109	70.4 Å²	70.4	58%	0.583	40%	0.402	S	S	*	.	H	α-helix	trans	-63.1	-42.6	174.4	-70.9	-23	0	0	0	111.7	G30 S31 F37 S38	G30-D34 WeakPolarHBondContact O-CB 3.29Å; G30-D34 PolarHBondContact O-N 3.32Å; S31-D34 PolarHBondContact O-N 2.96Å; D34-F37 PolarHBondContact O-N 3.05Å; D34-S38 WeakPolarHBondContact O-CB 3.44Å; D34-S38 PolarHBondContact O-N 3.15Å
35	L	90.9	Very high	80.8	Confident	111 Å²	111	73.9 Å²	73.9	58%	0.581	40%	0.401	S	S	*	.	H	α-helix	trans	-60.4	-45.6	173.4	-71	174.1	0	0	0	111.5	S31 F37 S38 E39	S31-L35 WeakPolarHBondContact O-CG 3.33Å; S31-L35 PolarHBondContact O-N 3.1Å; L35-F37 PolarHBondContact O-N 3.28Å; L35-S38 WeakPolarHBondContact O-CB 3.46Å; L35-S38 PolarHBondContact O-N 3.14Å; L35-E39 PolarHBondContact O-N 3.19Å
36	F	92.3	Very high	83.5	Confident	4 Å²	4	69 Å²	69	2%	0.018	37%	0.369	C	S	.	.	H	α-helix	trans	-60.2	-46.5	176.3	167.6	-99.1	0	0	0	112.6	Q32 M33 S38 E39 V40 L99 I118 R119 Q122	Q32-F36 PolarHBondContact O-N 3.43Å; M33-F36 HydrophobicContact CE-CD1 3.68Å; M33-F36 HydrophobicContact CE-CE1 3.93Å; M33-F36 WeakPolarHBondContact O-CB 3.42Å; M33-F36 PolarHBondContact O-N 2.97Å; M33-F36 HydrophobicContact SD-CD1 3.91Å; M33-F36 HydrophobicContact SD-CG 4.49Å; F36-S38 VanDerWaalsContact C-N 3.29Å; F36-S38 PolarHBondContact O-N 3.15Å; F36-E39 PolarHBondContact O-N 3.26Å; F36-V40 HydrophobicContact CD1-CG2 4.35Å; F36-V40 HydrophobicContact CD2-CG2 4.27Å; F36-V40 HydrophobicContact CE1-CG2 3.75Å; F36-V40 HydrophobicContact CE2-CG2 3.65Å; F36-V40 HydrophobicContact CZ-CG2 3.34Å; F36-V40 WeakPolarHBondContact O-CG2 3.32Å; F36-V40 PolarHBondContact O-N 3.15Å; F36-L99 HydrophobicContact CD2-CD2 3.55Å; F36-L99 HydrophobicContact CE2-CD1 4.34Å; F36-L99 HydrophobicContact CE2-CD2 3.69Å; F36-I118 HydrophobicContact CE1-CG2 4.42Å; F36-R119 HydrophobicContact CD1-CG 3.98Å; F36-R119 HydrophobicContact CD2-CG 3.83Å; F36-R119 HydrophobicContact CE1-CB 4.48Å; F36-R119 HydrophobicContact CE1-CG 3.84Å; F36-R119 HydrophobicContact CE2-CB 3.99Å; F36-R119 HydrophobicContact CE2-CG 3.69Å; F36-R119 HydrophobicContact CG-CG 3.98Å; F36-R119 VanDerWaalsContact CZ-CA 3.48Å; F36-R119 HydrophobicContact CZ-CB 3.96Å; F36-R119 HydrophobicContact CZ-CG 3.7Å; F36-Q122 HydrophobicContact CE1-CB 4.47Å; F36-Q122 HydrophobicContact CE1-CG 4.19Å; F36-Q122 HydrophobicContact CZ-CB 3.82Å; F36-Q122 HydrophobicContact CZ-CG 4.04Å
37	F	93.7	Very high	86.1	Confident	83 Å²	83	64.1 Å²	64.1	36%	0.364	34%	0.339	S	S	.	.	H	α-helix	trans	-63.9	-37.1	177.6	-73.4	-52.6	0	0	0	111.8	M33 D34 L35 E39 V40 E41 I118	M33-F37 HydrophobicContact CB-CE2 4.42Å; M33-F37 HydrophobicContact CE-CE1 3.83Å; M33-F37 HydrophobicContact CE-CE2 3.76Å; M33-F37 HydrophobicContact CE-CZ 3.33Å; M33-F37 HydrophobicContact CG-CD2 3.84Å; M33-F37 HydrophobicContact CG-CE2 3.35Å; M33-F37 HydrophobicContact CG-CZ 3.98Å; M33-F37 WeakPolarHBondContact O-CD2 3.46Å; M33-F37 WeakPolarHBondContact O-CG 3.48Å; M33-F37 PolarHBondContact O-N 3.25Å; M33-F37 HydrophobicContact SD-CE2 4.37Å; M33-F37 HydrophobicContact SD-CZ 4.49Å; D34-F37 PolarHBondContact O-N 3.05Å; L35-F37 PolarHBondContact O-N 3.28Å; F37-E39 VanDerWaalsContact C-N 3.34Å; F37-E39 PolarHBondContact O-N 2.98Å; F37-V40 PolarHBondContact O-N 3.44Å; F37-E41 WeakPolarHBondContact O-CB 3.36Å; F37-E41 WeakPolarHBondContact O-CG 3.28Å; F37-E41 PolarHBondContact O-N 3.46Å; F37-I118 HydrophobicContact CE1-CG2 4.04Å; F37-I118 HydrophobicContact CZ-CG2 4.2Å
38	S	94.8	Very high	88.6	Confident	76 Å²	76	62.1 Å²	62.1	53%	0.531	32%	0.322	S	S	.	.	H	α-helix	trans	-59.8	-43.8	173.5	-175.8	0	0	0	0	112	D34 L35 F36 E41 W42	D34-S38 WeakPolarHBondContact O-CB 3.44Å; D34-S38 PolarHBondContact O-N 3.15Å; L35-S38 WeakPolarHBondContact O-CB 3.46Å; L35-S38 PolarHBondContact O-N 3.14Å; F36-S38 VanDerWaalsContact C-N 3.29Å; F36-S38 PolarHBondContact O-N 3.15Å; S38-E41 PolarHBondContact O-N 3.05Å; S38-W42 WeakPolarHBondContact O-CB 3.45Å; S38-W42 PolarHBondContact O-N 3.13Å
39	E	94.9	Very high	90.7	Very high	64 Å²	64	60.7 Å²	60.7	30%	0.299	31%	0.31	S	S	.	.	H	α-helix	trans	-65.2	-44	175.6	-70.6	-172.3	165.9	0	0	112.4	L35 F36 F37 E41 W42 I43 L99	L35-E39 PolarHBondContact O-N 3.19Å; F36-E39 PolarHBondContact O-N 3.26Å; F37-E39 VanDerWaalsContact C-N 3.34Å; F37-E39 PolarHBondContact O-N 2.98Å; E39-E41 VanDerWaalsContact C-N 3.35Å; E39-E41 PolarHBondContact O-N 3.14Å; E39-W42 WeakPolarHBondContact O-CB 3.25Å; E39-W42 PolarHBondContact O-N 2.93Å; E39-I43 VanDerWaalsContact O-CG1 3.29Å; E39-I43 WeakPolarHBondContact O-CG1 3.2Å; E39-I43 PolarHBondContact O-N 2.65Å; E39-L99 HydrophobicContact CB-CD2 4.44Å; E39-L99 WeakPolarHBondContact OE2-CD2 3.15Å
40	V	96	Very high	92.8	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-58.5	-47	175.3	163.7	0	0	0	0	111	F36 F37 W42 I43 R44 L99 Q122 L126	F36-V40 HydrophobicContact CD1-CG2 4.35Å; F36-V40 HydrophobicContact CD2-CG2 4.27Å; F36-V40 HydrophobicContact CE1-CG2 3.75Å; F36-V40 HydrophobicContact CE2-CG2 3.65Å; F36-V40 HydrophobicContact CZ-CG2 3.34Å; F36-V40 WeakPolarHBondContact O-CG2 3.32Å; F36-V40 PolarHBondContact O-N 3.15Å; F37-V40 PolarHBondContact O-N 3.44Å; V40-W42 VanDerWaalsContact C-N 3.33Å; V40-W42 PolarHBondContact O-N 2.62Å; V40-I43 PolarHBondContact O-N 2.93Å; V40-R44 HydrophobicContact CG1-CG 4.49Å; V40-R44 VanDerWaalsContact O-CG 3.3Å; V40-R44 WeakPolarHBondContact O-CG 3.31Å; V40-R44 PolarHBondContact O-N 3.33Å; V40-L99 HydrophobicContact CG2-CD1 4.41Å; V40-Q122 HydrophobicContact CG1-CG 4.45Å; V40-Q122 HydrophobicContact CG2-CB 4.09Å; V40-Q122 HydrophobicContact CG2-CG 4.39Å; V40-L126 HydrophobicContact CB-CD1 4.42Å; V40-L126 HydrophobicContact CG1-CD1 4.18Å; V40-L126 HydrophobicContact CG2-CD1 4.16Å
41	E	96.3	Very high	94.3	Very high	79 Å²	79	61.8 Å²	61.8	37%	0.369	29%	0.292	S	S	.	.	H	α-helix	trans	-66.4	-35.9	179.3	-75	-56.3	130.4	0	0	112.1	F37 S38 E39 R44 R45	F37-E41 WeakPolarHBondContact O-CB 3.36Å; F37-E41 WeakPolarHBondContact O-CG 3.28Å; F37-E41 PolarHBondContact O-N 3.46Å; S38-E41 PolarHBondContact O-N 3.05Å; E39-E41 VanDerWaalsContact C-N 3.35Å; E39-E41 PolarHBondContact O-N 3.14Å; E41-R44 WeakPolarHBondContact OE1-CD 3.48Å; E41-R44 IonicContact OE1-CZ 2.66Å; E41-R44 IonicContact OE1-NE 3.41Å; E41-R44 IonicContact OE1-NH1 3.58Å; E41-R44 PolarHBondContact OE1-NH1 2.9Å; E41-R45 WeakPolarHBondContact O-CG 3.45Å; E41-R45 PolarHBondContact O-N 3.06Å; E41-R45 VanDerWaalsContact O-N 3.09Å; E41-R45 PolarHBondContact O-NH1 3.43Å
42	W	97.8	Very high	95.2	Very high	59 Å²	59	62.8 Å²	62.8	22%	0.223	29%	0.291	C	S	.	.	H	α-helix	trans	-61.3	-48.7	170.9	-174.5	99.3	0	0	0	111.3	S38 E39 V40 R44 R45 E46 E91 I92 K95	S38-W42 WeakPolarHBondContact O-CB 3.45Å; S38-W42 PolarHBondContact O-N 3.13Å; E39-W42 WeakPolarHBondContact O-CB 3.25Å; E39-W42 PolarHBondContact O-N 2.93Å; V40-W42 VanDerWaalsContact C-N 3.33Å; V40-W42 PolarHBondContact O-N 2.62Å; W42-R44 VanDerWaalsContact C-N 3.31Å; W42-R44 PolarHBondContact O-N 2.83Å; W42-R45 PolarHBondContact O-N 2.7Å; W42-E46 HydrophobicContact CD2-CG 4.05Å; W42-E46 HydrophobicContact CE3-CB 4.46Å; W42-E46 HydrophobicContact CE3-CG 3.99Å; W42-E46 HydrophobicContact CH2-CB 4.27Å; W42-E46 HydrophobicContact CH2-CG 3.51Å; W42-E46 HydrophobicContact CZ2-CG 3.58Å; W42-E46 HydrophobicContact CZ3-CB 4.08Å; W42-E46 HydrophobicContact CZ3-CG 3.69Å; W42-E46 PolarHBondContact O-N 2.99Å; W42-E91 HydrophobicContact CH2-CB 3.87Å; W42-I92 HydrophobicContact CZ3-CG1 4.25Å; W42-K95 HydrophobicContact CD2-CD 3.91Å; W42-K95 HydrophobicContact CE3-CD 3.23Å; W42-K95 HydrophobicContact CH2-CD 3.98Å; W42-K95 HydrophobicContact CZ3-CD 3.32Å; W42-K95 VanDerWaalsContact CZ3-CE 3.47Å; W42-K95 HydrophobicContact CZ3-CG 4.42Å
43	I	97.8	Very high	95.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-43.1	-179.2	-66.5	165.7	0	0	0	110.1	E39 V40 R45 E46 I47 I92 K95 L96 L99 L126	E39-I43 VanDerWaalsContact O-CG1 3.29Å; E39-I43 WeakPolarHBondContact O-CG1 3.2Å; E39-I43 PolarHBondContact O-N 2.65Å; V40-I43 PolarHBondContact O-N 2.93Å; I43-R45 VanDerWaalsContact C-N 3.33Å; I43-R45 PolarHBondContact O-N 3.45Å; I43-E46 PolarHBondContact O-N 3.44Å; I43-I47 HydrophobicContact CG2-CD1 3.65Å; I43-I47 HydrophobicContact CG2-CG1 4.13Å; I43-I47 WeakPolarHBondContact O-CB 3.43Å; I43-I47 WeakPolarHBondContact O-CG1 3.37Å; I43-I47 PolarHBondContact O-N 3.36Å; I43-I92 HydrophobicContact CG2-CG2 3.98Å; I43-K95 HydrophobicContact CD1-CB 3.9Å; I43-K95 HydrophobicContact CG1-CB 4.04Å; I43-K95 HydrophobicContact CG1-CD 4.19Å; I43-L96 HydrophobicContact CD1-CD2 4.13Å; I43-L96 HydrophobicContact CD1-CG 4.41Å; I43-L99 HydrophobicContact CD1-CD1 3.5Å; I43-L99 VanDerWaalsContact CD1-CD1 3.5Å; I43-L99 HydrophobicContact CD1-CG 4.47Å; I43-L126 HydrophobicContact CB-CD1 4.14Å; I43-L126 HydrophobicContact CD1-CD1 4.15Å; I43-L126 HydrophobicContact CG2-CB 4.26Å; I43-L126 HydrophobicContact CG2-CD1 3.96Å; I43-L126 HydrophobicContact CG2-CD2 4.12Å; I43-L126 HydrophobicContact CG2-CG 4.34Å
44	R	97.7	Very high	96.4	Very high	99 Å²	99	58.5 Å²	58.5	37%	0.374	27%	0.271	S	S	.	.	H	α-helix	trans	-57.7	-45.2	176.7	-74.3	172.6	175.1	-169.4	-5.5	112.2	V40 E41 W42 I47 E48 L126	V40-R44 HydrophobicContact CG1-CG 4.49Å; V40-R44 VanDerWaalsContact O-CG 3.3Å; V40-R44 WeakPolarHBondContact O-CG 3.31Å; V40-R44 PolarHBondContact O-N 3.33Å; E41-R44 WeakPolarHBondContact OE1-CD 3.48Å; E41-R44 IonicContact OE1-CZ 2.66Å; E41-R44 IonicContact OE1-NE 3.41Å; E41-R44 IonicContact OE1-NH1 3.58Å; E41-R44 PolarHBondContact OE1-NH1 2.9Å; W42-R44 VanDerWaalsContact C-N 3.31Å; W42-R44 PolarHBondContact O-N 2.83Å; R44-I47 PolarHBondContact O-N 3.03Å; R44-E48 PolarHBondContact O-N 3.16Å; R44-L126 HydrophobicContact CG-CD2 3.5Å
45	R	98.1	Very high	96.7	Very high	137 Å²	137	56.8 Å²	56.8	52%	0.517	27%	0.268	S	S	.	.	H	α-helix	trans	-64.4	-44.9	178.6	-73.4	-170.2	-57.8	-89	1.9	112.1	E41 W42 I43 E48 K49	E41-R45 WeakPolarHBondContact O-CG 3.45Å; E41-R45 PolarHBondContact O-N 3.06Å; E41-R45 VanDerWaalsContact O-N 3.09Å; E41-R45 PolarHBondContact O-NH1 3.43Å; W42-R45 PolarHBondContact O-N 2.7Å; I43-R45 VanDerWaalsContact C-N 3.33Å; I43-R45 PolarHBondContact O-N 3.45Å; R45-E48 PolarHBondContact O-N 3.37Å; R45-K49 WeakPolarHBondContact O-CB 3.47Å; R45-K49 PolarHBondContact O-N 3.44Å
46	E	98.1	Very high	97.1	Very high	33 Å²	33	56 Å²	56	15%	0.154	26%	0.261	C	S	.	.	H	α-helix	trans	-68.2	-35.5	178.4	-72.7	-53.8	120.6	0	0	112.4	W42 I43 E48 K49 T50 I92	W42-E46 HydrophobicContact CD2-CG 4.05Å; W42-E46 HydrophobicContact CE3-CB 4.46Å; W42-E46 HydrophobicContact CE3-CG 3.99Å; W42-E46 HydrophobicContact CH2-CB 4.27Å; W42-E46 HydrophobicContact CH2-CG 3.51Å; W42-E46 HydrophobicContact CZ2-CG 3.58Å; W42-E46 HydrophobicContact CZ3-CB 4.08Å; W42-E46 HydrophobicContact CZ3-CG 3.69Å; W42-E46 PolarHBondContact O-N 2.99Å; I43-E46 PolarHBondContact O-N 3.44Å; E46-E48 VanDerWaalsContact C-N 3.33Å; E46-E48 PolarHBondContact O-N 3.25Å; E46-K49 PolarHBondContact O-N 3.11Å; E46-K49 IonicContact OE2-NZ 3.06Å; E46-K49 PolarHBondContact OE2-NZ 2.91Å; E46-T50 WeakPolarHBondContact O-CB 3.22Å; E46-T50 PolarHBondContact O-N 2.9Å; E46-T50 PolarHBondContact O-OG1 3.22Å; E46-I92 HydrophobicContact CB-CD1 3.86Å; E46-I92 HydrophobicContact CB-CG1 3.87Å
47	I	98	Very high	97.3	Very high	5 Å²	5	55.8 Å²	55.8	3%	0.026	26%	0.26	C	S	.	.	H	α-helix	trans	-59.1	-45.6	171.6	-75.4	177.3	0	0	0	110.5	I43 R44 T50 R51 I92 L126 T129 I130 I133	I43-I47 HydrophobicContact CG2-CD1 3.65Å; I43-I47 HydrophobicContact CG2-CG1 4.13Å; I43-I47 WeakPolarHBondContact O-CB 3.43Å; I43-I47 WeakPolarHBondContact O-CG1 3.37Å; I43-I47 PolarHBondContact O-N 3.36Å; R44-I47 PolarHBondContact O-N 3.03Å; I47-T50 PolarHBondContact O-N 2.67Å; I47-R51 WeakPolarHBondContact O-CB 3.47Å; I47-R51 PolarHBondContact O-N 2.95Å; I47-I92 HydrophobicContact CG1-CD1 3.86Å; I47-I92 HydrophobicContact CG1-CG2 4.36Å; I47-L126 HydrophobicContact CD1-CB 4.43Å; I47-L126 HydrophobicContact CD1-CD2 4.15Å; I47-T129 HydrophobicContact CG2-CG2 3.71Å; I47-I130 HydrophobicContact CD1-CB 4.05Å; I47-I130 HydrophobicContact CG1-CB 4.19Å; I47-I130 HydrophobicContact CG1-CD1 4.31Å; I47-I133 HydrophobicContact CG2-CD1 3.31Å
48	E	98.1	Very high	97.4	Very high	83 Å²	83	57.6 Å²	57.6	39%	0.388	27%	0.268	S	S	.	.	H	α-helix	trans	-67.7	-43.1	179.5	-174.8	56.2	-154.6	0	0	112.1	R44 R45 E46 T50 R51 I52	R44-E48 PolarHBondContact O-N 3.16Å; R45-E48 PolarHBondContact O-N 3.37Å; E46-E48 VanDerWaalsContact C-N 3.33Å; E46-E48 PolarHBondContact O-N 3.25Å; E48-T50 VanDerWaalsContact C-N 3.34Å; E48-T50 PolarHBondContact O-N 2.93Å; E48-R51 WeakPolarHBondContact O-CB 3.38Å; E48-R51 PolarHBondContact O-N 3.38Å; E48-R51 IonicContact OE2-CZ 3.59Å; E48-R51 IonicContact OE2-NH1 2.91Å; E48-R51 PolarHBondContact OE2-NH1 3.15Å; E48-I52 HydrophobicContact CG-CD1 4.32Å; E48-I52 WeakPolarHBondContact O-CG1 3.34Å; E48-I52 PolarHBondContact O-N 2.95Å
49	K	98.2	Very high	97.4	Very high	80 Å²	80	57.8 Å²	57.8	35%	0.348	27%	0.266	S	S	.	.	H	α-helix	trans	-56.6	-48.3	172.6	177.1	-175.5	150.4	-143	0	111.3	R45 E46 R51 I52 E53	R45-K49 WeakPolarHBondContact O-CB 3.47Å; R45-K49 PolarHBondContact O-N 3.44Å; E46-K49 PolarHBondContact O-N 3.11Å; E46-K49 IonicContact OE2-NZ 3.06Å; E46-K49 PolarHBondContact OE2-NZ 2.91Å; K49-R51 VanDerWaalsContact C-N 3.3Å; K49-R51 PolarHBondContact O-N 3.36Å; K49-I52 WeakPolarHBondContact O-CB 3.47Å; K49-I52 PolarHBondContact O-N 3.06Å; K49-I52 VanDerWaalsContact O-N 3.1Å; K49-E53 VanDerWaalsContact CE-OE1 3.27Å; K49-E53 WeakPolarHBondContact CE-OE1 3.49Å; K49-E53 WeakPolarHBondContact O-CG 3.39Å; K49-E53 PolarHBondContact O-N 3.1Å
50	T	97.9	Very high	97.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59.1	-41.9	177.8	-54.8	0	0	0	0	111	E46 I47 E48 I52 E53 I54 I85 S88 M134	E46-T50 WeakPolarHBondContact O-CB 3.22Å; E46-T50 PolarHBondContact O-N 2.9Å; E46-T50 PolarHBondContact O-OG1 3.22Å; I47-T50 PolarHBondContact O-N 2.67Å; E48-T50 VanDerWaalsContact C-N 3.34Å; E48-T50 PolarHBondContact O-N 2.93Å; T50-I52 VanDerWaalsContact C-N 3.34Å; T50-I52 PolarHBondContact O-N 3.05Å; T50-E53 PolarHBondContact O-N 3.48Å; T50-I54 HydrophobicContact CG2-CD1 3.92Å; T50-I54 WeakPolarHBondContact O-CD1 3.31Å; T50-I54 VanDerWaalsContact O-CG1 3.23Å; T50-I54 WeakPolarHBondContact O-CG1 3.16Å; T50-I54 PolarHBondContact O-N 3.45Å; T50-I85 HydrophobicContact CG2-CG1 4.41Å; T50-I85 HydrophobicContact CG2-CG2 4.04Å; T50-S88 WeakPolarHBondContact OG1-CB 3.5Å; T50-M134 HydrophobicContact CG2-SD 4.25Å
51	R	98.2	Very high	97.2	Very high	95 Å²	95	56.8 Å²	56.8	36%	0.358	26%	0.261	S	S	.	.	H	α-helix	trans	-59.9	-43.1	175.3	176.1	-175.7	-76.4	129.3	-4.1	112	I47 E48 K49 I54 S55 I133	I47-R51 WeakPolarHBondContact O-CB 3.47Å; I47-R51 PolarHBondContact O-N 2.95Å; E48-R51 WeakPolarHBondContact O-CB 3.38Å; E48-R51 PolarHBondContact O-N 3.38Å; E48-R51 IonicContact OE2-CZ 3.59Å; E48-R51 IonicContact OE2-NH1 2.91Å; E48-R51 PolarHBondContact OE2-NH1 3.15Å; K49-R51 VanDerWaalsContact C-N 3.3Å; K49-R51 PolarHBondContact O-N 3.36Å; R51-I54 PolarHBondContact O-N 3.49Å; R51-S55 PolarHBondContact O-N 3.19Å; R51-S55 VanDerWaalsContact O-N 3.14Å; R51-I133 HydrophobicContact CB-CD1 4.09Å; R51-I133 HydrophobicContact CB-CG1 4.38Å; R51-I133 HydrophobicContact CB-CG2 4.45Å; R51-I133 VanDerWaalsContact NH2-CD1 3.31Å
52	I	98.4	Very high	97	Very high	83 Å²	83	54.4 Å²	54.4	43%	0.426	26%	0.257	S	S	.	.	H	α-helix	trans	-64.1	-46	177.1	-66.8	165.4	0	0	0	110.4	E48 K49 T50 I54 S55 Q56	E48-I52 HydrophobicContact CG-CD1 4.32Å; E48-I52 WeakPolarHBondContact O-CG1 3.34Å; E48-I52 PolarHBondContact O-N 2.95Å; K49-I52 WeakPolarHBondContact O-CB 3.47Å; K49-I52 PolarHBondContact O-N 3.06Å; K49-I52 VanDerWaalsContact O-N 3.1Å; T50-I52 VanDerWaalsContact C-N 3.34Å; T50-I52 PolarHBondContact O-N 3.05Å; I52-I54 VanDerWaalsContact C-N 3.32Å; I52-I54 PolarHBondContact O-N 2.94Å; I52-S55 VanDerWaalsContact O-CB 3.31Å; I52-S55 WeakPolarHBondContact O-CB 3.29Å; I52-S55 PolarHBondContact O-N 3.35Å; I52-S55 VanDerWaalsContact O-N 3.11Å; I52-Q56 WeakPolarHBondContact O-CG 3.39Å; I52-Q56 PolarHBondContact O-N 2.97Å
53	E	98.3	Very high	96.7	Very high	20 Å²	20	55.1 Å²	55.1	9%	0.093	26%	0.263	C	S	.	.	H	α-helix	trans	-59.7	-41.4	177.5	-69.3	173.2	161	0	0	111.6	K49 T50 S55 Q56 V57 L81 S84 I85	K49-E53 VanDerWaalsContact CE-OE1 3.27Å; K49-E53 WeakPolarHBondContact CE-OE1 3.49Å; K49-E53 WeakPolarHBondContact O-CG 3.39Å; K49-E53 PolarHBondContact O-N 3.1Å; T50-E53 PolarHBondContact O-N 3.48Å; E53-S55 VanDerWaalsContact C-N 3.3Å; E53-S55 PolarHBondContact O-N 3.39Å; E53-Q56 CarbonylContact O-C 3.48Å; E53-Q56 WeakPolarHBondContact O-CA 3.42Å; E53-Q56 WeakPolarHBondContact O-CB 3.43Å; E53-Q56 PolarHBondContact O-N 2.99Å; E53-Q56 VanDerWaalsContact O-N 3.09Å; E53-V57 WeakPolarHBondContact O-CG2 3.5Å; E53-V57 PolarHBondContact O-N 2.99Å; E53-L81 HydrophobicContact CB-CD2 4.01Å; E53-L81 HydrophobicContact CG-CD2 4Å; E53-S84 VanDerWaalsContact CD-OG 3.31Å; E53-S84 WeakPolarHBondContact OE1-CB 3.47Å; E53-S84 PolarHBondContact OE1-OG 3.24Å; E53-S84 PolarHBondContact OE2-OG 3.35Å; E53-I85 HydrophobicContact CB-CD1 3.95Å; E53-I85 HydrophobicContact CB-CG1 3.67Å
54	I	98	Very high	96.2	Very high	7 Å²	7	55.5 Å²	55.5	4%	0.036	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-39.4	175.2	-70.6	161.1	0	0	0	111.7	T50 R51 I52 Q56 V57 K58 I85 I133 Y137 I140	T50-I54 HydrophobicContact CG2-CD1 3.92Å; T50-I54 WeakPolarHBondContact O-CD1 3.31Å; T50-I54 VanDerWaalsContact O-CG1 3.23Å; T50-I54 WeakPolarHBondContact O-CG1 3.16Å; T50-I54 PolarHBondContact O-N 3.45Å; R51-I54 PolarHBondContact O-N 3.49Å; I52-I54 VanDerWaalsContact C-N 3.32Å; I52-I54 PolarHBondContact O-N 2.94Å; I54-Q56 VanDerWaalsContact C-N 3.33Å; I54-V57 WeakPolarHBondContact O-CB 3.44Å; I54-V57 PolarHBondContact O-N 3.47Å; I54-K58 PolarHBondContact O-N 3.49Å; I54-K58 VanDerWaalsContact O-N 3.12Å; I54-I85 HydrophobicContact CG1-CD1 3.76Å; I54-I85 HydrophobicContact CG1-CG1 4.25Å; I54-I85 HydrophobicContact CG1-CG2 4.44Å; I54-I133 HydrophobicContact CD1-CG2 3.15Å; I54-Y137 HydrophobicContact CB-CD2 4.47Å; I54-Y137 HydrophobicContact CD1-CD2 4.48Å; I54-Y137 HydrophobicContact CD1-CG 4.28Å; I54-Y137 HydrophobicContact CG1-CD2 3.74Å; I54-Y137 HydrophobicContact CG1-CG 4.03Å; I54-Y137 HydrophobicContact CG2-CD2 4.23Å; I54-I140 HydrophobicContact CG2-CD1 3.56Å
55	S	97.9	Very high	95.7	Very high	74 Å²	74	52.6 Å²	52.6	52%	0.517	26%	0.257	S	S	.	.	H	α-helix	trans	-63.5	-41.1	174	-169.9	0	0	0	0	111.4	R51 I52 E53 K58 T59	R51-S55 PolarHBondContact O-N 3.19Å; R51-S55 VanDerWaalsContact O-N 3.14Å; I52-S55 VanDerWaalsContact O-CB 3.31Å; I52-S55 WeakPolarHBondContact O-CB 3.29Å; I52-S55 PolarHBondContact O-N 3.35Å; I52-S55 VanDerWaalsContact O-N 3.11Å; E53-S55 VanDerWaalsContact C-N 3.3Å; E53-S55 PolarHBondContact O-N 3.39Å; S55-K58 WeakPolarHBondContact O-CB 3.49Å; S55-K58 PolarHBondContact O-N 2.84Å; S55-T59 PolarHBondContact O-N 3.09Å; S55-T59 VanDerWaalsContact O-N 3.16Å; S55-T59 PolarHBondContact O-OG1 3.41Å
56	Q	97.9	Very high	95	Very high	93 Å²	93	50.9 Å²	50.9	44%	0.435	27%	0.266	S	S	.	.	H	α-helix	trans	-64.3	-41.9	175.7	-67	174	-6.9	0	0	111.9	I52 E53 I54 K58 T59 K60 L81	I52-Q56 WeakPolarHBondContact O-CG 3.39Å; I52-Q56 PolarHBondContact O-N 2.97Å; E53-Q56 CarbonylContact O-C 3.48Å; E53-Q56 WeakPolarHBondContact O-CA 3.42Å; E53-Q56 WeakPolarHBondContact O-CB 3.43Å; E53-Q56 PolarHBondContact O-N 2.99Å; E53-Q56 VanDerWaalsContact O-N 3.09Å; I54-Q56 VanDerWaalsContact C-N 3.33Å; Q56-K58 VanDerWaalsContact C-N 3.3Å; Q56-K58 PolarHBondContact O-N 3.14Å; Q56-T59 WeakPolarHBondContact O-CB 3.33Å; Q56-T59 PolarHBondContact O-N 3Å; Q56-T59 VanDerWaalsContact O-N 3.11Å; Q56-K60 VanDerWaalsContact O-CG 3.29Å; Q56-K60 WeakPolarHBondContact O-CG 3.25Å; Q56-K60 PolarHBondContact O-N 2.98Å; Q56-L81 HydrophobicContact CB-CD1 3.8Å; Q56-L81 HydrophobicContact CB-CD2 4.24Å; Q56-L81 VanDerWaalsContact OE1-CD2 3.24Å
57	V	97.1	Very high	94.1	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-54.3	-47.2	173.2	165	0	0	0	0	110.8	E53 I54 T59 K60 H61 L78 L81 I85 Y137 I140	E53-V57 WeakPolarHBondContact O-CG2 3.5Å; E53-V57 PolarHBondContact O-N 2.99Å; I54-V57 WeakPolarHBondContact O-CB 3.44Å; I54-V57 PolarHBondContact O-N 3.47Å; V57-T59 VanDerWaalsContact C-N 3.31Å; V57-T59 PolarHBondContact O-N 3.42Å; V57-K60 PolarHBondContact O-N 3.47Å; V57-K60 VanDerWaalsContact O-N 3.16Å; V57-H61 WeakPolarHBondContact CG1-NE2 3.16Å; V57-H61 PolarHBondContact O-N 3.35Å; V57-L78 HydrophobicContact CB-CD1 4.24Å; V57-L78 HydrophobicContact CG1-CD1 3.81Å; V57-L78 HydrophobicContact CG2-CD1 4.08Å; V57-L81 HydrophobicContact CG2-CB 3.66Å; V57-L81 HydrophobicContact CG2-CD1 4.1Å; V57-L81 HydrophobicContact CG2-CG 4.46Å; V57-I85 HydrophobicContact CG2-CD1 3.69Å; V57-Y137 HydrophobicContact CG1-CE2 4.26Å; V57-Y137 HydrophobicContact CG2-CE2 4.47Å; V57-I140 HydrophobicContact CG1-CG2 4.37Å
58	K	96	Very high	92.5	Very high	122 Å²	122	58.9 Å²	58.9	53%	0.53	31%	0.314	S	S	.	.	H	α-helix	trans	-59.2	-41.8	177.7	-172.7	177.2	-179.3	176.5	0	112.3	I54 S55 Q56 G62 I140	I54-K58 PolarHBondContact O-N 3.49Å; I54-K58 VanDerWaalsContact O-N 3.12Å; S55-K58 WeakPolarHBondContact O-CB 3.49Å; S55-K58 PolarHBondContact O-N 2.84Å; Q56-K58 VanDerWaalsContact C-N 3.3Å; Q56-K58 PolarHBondContact O-N 3.14Å; K58-G62 PolarHBondContact O-N 3.47Å; K58-G62 VanDerWaalsContact O-N 3.15Å; K58-I140 HydrophobicContact CB-CD1 4.32Å; K58-I140 HydrophobicContact CB-CG2 4.16Å; K58-I140 HydrophobicContact CD-CD1 4.33Å; K58-I140 HydrophobicContact CD-CG1 4.44Å; K58-I140 HydrophobicContact CG-CG2 4.46Å
59	T	95.7	Very high	91.2	Very high	80 Å²	80	62 Å²	62	49%	0.491	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-45.4	175.3	-59.6	0	0	0	0	111.4	S55 Q56 V57 H61 G62 E63	S55-T59 PolarHBondContact O-N 3.09Å; S55-T59 VanDerWaalsContact O-N 3.16Å; S55-T59 PolarHBondContact O-OG1 3.41Å; Q56-T59 WeakPolarHBondContact O-CB 3.33Å; Q56-T59 PolarHBondContact O-N 3Å; Q56-T59 VanDerWaalsContact O-N 3.11Å; V57-T59 VanDerWaalsContact C-N 3.31Å; V57-T59 PolarHBondContact O-N 3.42Å; T59-H61 VanDerWaalsContact C-N 3.35Å; T59-H61 PolarHBondContact O-N 3Å; T59-G62 WeakPolarHBondContact O-CA 3.35Å; T59-G62 PolarHBondContact O-N 3.01Å; T59-E63 PolarHBondContact O-N 3.3Å
60	K	93.6	Very high	90	Very high	36 Å²	36	60.8 Å²	60.8	16%	0.157	32%	0.324	C	S	.	.	H	α-helix	trans	-63.5	-38.8	178.9	-65.3	-70	156.1	-164.1	0	112.3	Q56 V57 G62 E63 I64 T74 L78 L81	Q56-K60 VanDerWaalsContact O-CG 3.29Å; Q56-K60 WeakPolarHBondContact O-CG 3.25Å; Q56-K60 PolarHBondContact O-N 2.98Å; V57-K60 PolarHBondContact O-N 3.47Å; V57-K60 VanDerWaalsContact O-N 3.16Å; K60-G62 VanDerWaalsContact C-N 3.31Å; K60-G62 PolarHBondContact O-N 3.03Å; K60-E63 WeakPolarHBondContact CD-OE2 3.34Å; K60-E63 IonicContact NZ-OE1 3.73Å; K60-E63 PolarHBondContact NZ-OE1 2.94Å; K60-E63 VanDerWaalsContact NZ-OE1 3.09Å; K60-E63 IonicContact NZ-OE2 2.71Å; K60-E63 PolarHBondContact NZ-OE2 3.44Å; K60-E63 WeakPolarHBondContact O-CB 3.48Å; K60-E63 PolarHBondContact O-N 2.95Å; K60-I64 WeakPolarHBondContact O-CG1 3.44Å; K60-I64 PolarHBondContact O-N 2.93Å; K60-T74 HydrophobicContact CB-CG2 4.37Å; K60-T74 HydrophobicContact CD-CG2 3.78Å; K60-L78 HydrophobicContact CB-CB 4.43Å; K60-L78 HydrophobicContact CB-CD1 4.26Å; K60-L81 HydrophobicContact CG-CD1 4.15Å
61	H	93.1	Very high	89.2	Confident	7 Å²	7	64.4 Å²	64.4	3%	0.032	34%	0.344	C	S	.	.	H	α-helix	trans	-58.4	-42.6	169.9	-72.4	-24.5	0	0	0	112.2	V57 T59 I64 L65 H144	V57-H61 WeakPolarHBondContact CG1-NE2 3.16Å; V57-H61 PolarHBondContact O-N 3.35Å; T59-H61 VanDerWaalsContact C-N 3.35Å; T59-H61 PolarHBondContact O-N 3Å; H61-I64 PolarHBondContact O-N 3.2Å; H61-L65 VanDerWaalsContact O-CG 3.28Å; H61-L65 WeakPolarHBondContact O-CG 3.44Å; H61-L65 PolarHBondContact O-N 3.01Å; H61-L65 VanDerWaalsContact O-N 3.08Å; H61-H144 HydrophobicContact CB-CB 4.36Å; H61-H144 AromaticContact CD2-CD2 3.79Å; H61-H144 AromaticContact CD2-CG 3.67Å; H61-H144 AromaticContact CE1-CD2 3.19Å; H61-H144 PolarHBondContact CE1-CD2 2.66Å; H61-H144 AromaticContact CE1-CG 3.86Å; H61-H144 AromaticContact CE1-NE2 3.76Å; H61-H144 AromaticContact CG-CD2 3.39Å; H61-H144 AromaticContact CG-CE1 3.88Å; H61-H144 AromaticContact CG-CG 3.42Å; H61-H144 VanDerWaalsContact CG-CG 3.42Å; H61-H144 AromaticContact CG-ND1 3.75Å; H61-H144 AromaticContact CG-NE2 3.67Å; H61-H144 AromaticContact ND1-CD2 2.98Å; H61-H144 PolarHBondContact ND1-CD2 3.33Å; H61-H144 AromaticContact ND1-CE1 3.77Å; H61-H144 AromaticContact ND1-CG 3.56Å; H61-H144 AromaticContact ND1-NE2 3.13Å; H61-H144 PolarHBondContact ND1-NE2 3.08Å; H61-H144 VanDerWaalsContact ND1-NE2 3.13Å; H61-H144 AromaticContact NE2-CD2 3.69Å; H61-H144 AromaticContact NE2-CG 3.95Å
62	G	91.9	Very high	88.6	Confident	29 Å²	29	64.4 Å²	64.4	30%	0.299	36%	0.356	S	S	.	.	H	α-helix	trans	-59.9	-47.1	173.6	0	0	0	0	0	112.7	K58 T59 K60 I64 L65 S66	K58-G62 PolarHBondContact O-N 3.47Å; K58-G62 VanDerWaalsContact O-N 3.15Å; T59-G62 WeakPolarHBondContact O-CA 3.35Å; T59-G62 PolarHBondContact O-N 3.01Å; K60-G62 VanDerWaalsContact C-N 3.31Å; K60-G62 PolarHBondContact O-N 3.03Å; G62-I64 VanDerWaalsContact C-N 3.35Å; G62-I64 PolarHBondContact O-N 3.35Å; G62-L65 PolarHBondContact O-N 3.4Å; G62-S66 PolarHBondContact O-N 2.97Å; G62-S66 PolarHBondContact O-OG 3.36Å
63	E	90.5	Very high	88.1	Confident	75 Å²	75	67.2 Å²	67.2	35%	0.35	37%	0.365	S	S	.	.	H	α-helix	trans	-57.5	-44.9	176.6	-68.5	172.5	-160.8	0	0	111.9	T59 K60 L65 S66 A67 T74	T59-E63 PolarHBondContact O-N 3.3Å; K60-E63 WeakPolarHBondContact CD-OE2 3.34Å; K60-E63 IonicContact NZ-OE1 3.73Å; K60-E63 PolarHBondContact NZ-OE1 2.94Å; K60-E63 VanDerWaalsContact NZ-OE1 3.09Å; K60-E63 IonicContact NZ-OE2 2.71Å; K60-E63 PolarHBondContact NZ-OE2 3.44Å; K60-E63 WeakPolarHBondContact O-CB 3.48Å; K60-E63 PolarHBondContact O-N 2.95Å; E63-L65 VanDerWaalsContact C-N 3.35Å; E63-L65 PolarHBondContact O-N 3.45Å; E63-S66 PolarHBondContact O-N 3.2Å; E63-A67 VanDerWaalsContact O-CB 3.28Å; E63-A67 WeakPolarHBondContact O-CB 3.49Å; E63-A67 PolarHBondContact O-N 3.43Å; E63-T74 HydrophobicContact CB-CG2 4.05Å; E63-T74 WeakPolarHBondContact OE2-CG2 3.46Å; E63-T74 PolarHBondContact OE2-OG1 2.93Å
64	I	87.6	Confident	87.7	Confident	8 Å²	8	66.6 Å²	66.6	4%	0.041	36%	0.363	C	S	.	.	H	α-helix	trans	-66.2	-36.1	-179.9	-68	167.3	0	0	0	112	K60 H61 G62 T74 L78 R201	K60-I64 WeakPolarHBondContact O-CG1 3.44Å; K60-I64 PolarHBondContact O-N 2.93Å; H61-I64 PolarHBondContact O-N 3.2Å; G62-I64 VanDerWaalsContact C-N 3.35Å; G62-I64 PolarHBondContact O-N 3.35Å; I64-T74 HydrophobicContact CD1-CG2 4.16Å; I64-T74 HydrophobicContact CG1-CG2 3.7Å; I64-L78 HydrophobicContact CD1-CD2 3.53Å; I64-R201 PolarHBondContact O-NH2 3.43Å
65	L	86.5	Confident	87.3	Confident	37 Å²	37	67.3 Å²	67.3	19%	0.194	37%	0.365	C	S	.	.	H	α-helix	trans	-73.5	-33.5	177.5	-68.8	172.5	0	0	0	112.5	H61 G62 E63 R147 L151	H61-L65 VanDerWaalsContact O-CG 3.28Å; H61-L65 WeakPolarHBondContact O-CG 3.44Å; H61-L65 PolarHBondContact O-N 3.01Å; H61-L65 VanDerWaalsContact O-N 3.08Å; G62-L65 PolarHBondContact O-N 3.4Å; E63-L65 VanDerWaalsContact C-N 3.35Å; E63-L65 PolarHBondContact O-N 3.45Å; L65-R147 HydrophobicContact CD1-CB 3.98Å; L65-R147 HydrophobicContact CD1-CG 4.4Å; L65-R147 HydrophobicContact CD2-CB 4.08Å; L65-L151 HydrophobicContact CD2-CD1 3.49Å; L65-L151 VanDerWaalsContact CD2-CD1 3.49Å
66	S	84.4	Confident	87	Confident	102 Å²	102	67 Å²	67	71%	0.713	36%	0.361	S	S	*	.	H	α-helix	trans	-86.2	-22.7	-179.1	-63.5	0	0	0	0	113.9	G62 E63 L68	G62-S66 PolarHBondContact O-N 2.97Å; G62-S66 PolarHBondContact O-OG 3.36Å; E63-S66 PolarHBondContact O-N 3.2Å; S66-L68 PolarHBondContact O-N 3.02Å
67	A	78.3	Confident	86.8	Confident	36 Å²	36	65.6 Å²	65.6	30%	0.298	35%	0.354	S	S	.	.			trans	-70.9	127.4	-179.7	0	0	0	0	0	111.4	E63 Q69	E63-A67 VanDerWaalsContact O-CB 3.28Å; E63-A67 WeakPolarHBondContact O-CB 3.49Å; E63-A67 PolarHBondContact O-N 3.43Å; A67-Q69 VanDerWaalsContact C-N 3.26Å; A67-Q69 WeakPolarHBondContact CB-O 3.28Å; A67-Q69 PolarHBondContact O-N 3.32Å
68	L	64.8	Low	86.6	Confident	170 Å²	170	66.3 Å²	66.3	89%	0.89	36%	0.358	S	S	*	.	S	Bend	trans	-63.7	-32.8	173.3	-93.7	103.8	0	0	0	112.5	S66	S66-L68 PolarHBondContact O-N 3.02Å
69	Q	70.3	Confident	86.4	Confident	149 Å²	149	63.9 Å²	63.9	70%	0.696	35%	0.348	S	S	*	.	S	Bend	trans	-123.8	145.1	178.3	-70.1	-178.1	-29.4	0	0	109.3	A67 N71	A67-Q69 VanDerWaalsContact C-N 3.26Å; A67-Q69 WeakPolarHBondContact CB-O 3.28Å; A67-Q69 PolarHBondContact O-N 3.32Å; Q69-N71 PolarHBondContact O-N 3.32Å
70	Q	73.4	Confident	86.4	Confident	53 Å²	53	65.7 Å²	65.7	25%	0.248	35%	0.351	C	S	.	.			trans	-59.5	124.5	177.1	-67.2	-73.2	8.2	0	0	109.9	P72 A200 D204	Q70-P72 VanDerWaalsContact O-CD 3.32Å; Q70-P72 WeakPolarHBondContact O-CD 3.29Å; Q70-A200 HydrophobicContact CG-CB 3.77Å; Q70-D204 PolarHBondContact NE2-OD2 2.87Å
71	N	81.6	Confident	86.5	Confident	77 Å²	77	65 Å²	65	41%	0.412	35%	0.349	S	S	.	.			trans	-95.8	105	174.1	-176.7	-16.4	0	0	0	108.8	Q69 K73 T74 K75	Q69-N71 PolarHBondContact O-N 3.32Å; N71-K73 PolarHBondContact O-N 2.93Å; N71-K73 VanDerWaalsContact O-N 3.15Å; N71-K73 WeakPolarHBondContact OD1-CB 3.43Å; N71-K73 PolarHBondContact OD1-N 3.28Å; N71-K73 VanDerWaalsContact OD1-N 3.1Å; N71-T74 PolarHBondContact ND2-OG1 3.27Å; N71-T74 PolarHBondContact O-N 3.44Å; N71-K75 PolarHBondContact O-N 2.9Å; N71-K75 VanDerWaalsContact O-N 3.15Å
72	P	85.3	Confident	86.6	Confident	94 Å²	94	65.6 Å²	65.6	61%	0.61	35%	0.353	S	S	*	.	H	α-helix	trans	-59	-31.6	-176.2	-23.4	34.6	0	0	0	112.6	Q70 K75 T76	Q70-P72 VanDerWaalsContact O-CD 3.32Å; Q70-P72 WeakPolarHBondContact O-CD 3.29Å; P72-K75 PolarHBondContact O-N 3.49Å; P72-T76 PolarHBondContact O-N 3.46Å; P72-T76 PolarHBondContact O-OG1 2.88Å
73	K	89	Confident	86.8	Confident	142 Å²	142	69.8 Å²	69.8	62%	0.617	36%	0.364	S	S	*	.	H	α-helix	trans	-66	-44	177.3	-172.9	179.1	179.2	178.4	0	111.4	N71 K75 T76 Q77	N71-K73 PolarHBondContact O-N 2.93Å; N71-K73 VanDerWaalsContact O-N 3.15Å; N71-K73 WeakPolarHBondContact OD1-CB 3.43Å; N71-K73 PolarHBondContact OD1-N 3.28Å; N71-K73 VanDerWaalsContact OD1-N 3.1Å; K73-K75 VanDerWaalsContact C-N 3.34Å; K73-T76 PolarHBondContact O-N 2.99Å; K73-Q77 VanDerWaalsContact O-CG 3.29Å; K73-Q77 WeakPolarHBondContact O-CG 3.42Å; K73-Q77 PolarHBondContact O-N 3.16Å
74	T	89.8	Confident	87	Confident	8 Å²	8	67.2 Å²	67.2	5%	0.049	36%	0.355	C	S	.	.	H	α-helix	trans	-64.5	-39.7	177.7	-59.9	0	0	0	0	111.2	K60 E63 I64 N71 Q77 L78	K60-T74 HydrophobicContact CB-CG2 4.37Å; K60-T74 HydrophobicContact CD-CG2 3.78Å; E63-T74 HydrophobicContact CB-CG2 4.05Å; E63-T74 WeakPolarHBondContact OE2-CG2 3.46Å; E63-T74 PolarHBondContact OE2-OG1 2.93Å; I64-T74 HydrophobicContact CD1-CG2 4.16Å; I64-T74 HydrophobicContact CG1-CG2 3.7Å; N71-T74 PolarHBondContact ND2-OG1 3.27Å; N71-T74 PolarHBondContact O-N 3.44Å; T74-Q77 PolarHBondContact O-N 3.11Å; T74-L78 WeakPolarHBondContact O-CB 3.39Å; T74-L78 PolarHBondContact O-N 3.13Å
75	K	88.2	Confident	87.5	Confident	21 Å²	21	66.9 Å²	66.9	9%	0.091	35%	0.353	C	S	.	.	H	α-helix	trans	-62.7	-46.6	175	-67.2	-161.1	-176.8	-161	0	112.2	N71 P72 K73 Q77 L78 E79 E203 D204	N71-K75 PolarHBondContact O-N 2.9Å; N71-K75 VanDerWaalsContact O-N 3.15Å; P72-K75 PolarHBondContact O-N 3.49Å; K73-K75 VanDerWaalsContact C-N 3.34Å; K75-Q77 PolarHBondContact O-N 3.37Å; K75-L78 WeakPolarHBondContact O-CB 3.21Å; K75-L78 PolarHBondContact O-N 3.41Å; K75-L78 VanDerWaalsContact O-N 3.14Å; K75-E79 WeakPolarHBondContact O-CG 3.39Å; K75-E79 PolarHBondContact O-N 3.01Å; K75-E203 IonicContact NZ-OE2 2.74Å; K75-D204 WeakPolarHBondContact CE-OD1 3.22Å; K75-D204 IonicContact NZ-OD1 3.49Å; K75-D204 PolarHBondContact NZ-OD1 3.16Å; K75-D204 IonicContact NZ-OD2 3.81Å
76	T	91.5	Very high	87.9	Confident	69 Å²	69	65.5 Å²	65.5	42%	0.423	35%	0.346	S	S	.	.	H	α-helix	trans	-60.6	-45.7	178.5	-51.7	0	0	0	0	111	P72 K73 L78 E79 E80	P72-T76 PolarHBondContact O-N 3.46Å; P72-T76 PolarHBondContact O-OG1 2.88Å; K73-T76 PolarHBondContact O-N 2.99Å; T76-L78 VanDerWaalsContact C-N 3.29Å; T76-L78 PolarHBondContact O-N 3.13Å; T76-E79 PolarHBondContact O-N 2.98Å; T76-E80 WeakPolarHBondContact O-CG 3.44Å; T76-E80 PolarHBondContact O-N 3.06Å
77	Q	93.7	Very high	88.4	Confident	62 Å²	62	67.2 Å²	67.2	29%	0.29	34%	0.337	S	S	.	.	H	α-helix	trans	-60.5	-38.1	175.6	-73.1	179.5	-26.7	0	0	112.6	K73 T74 K75 L81	K73-Q77 VanDerWaalsContact O-CG 3.29Å; K73-Q77 WeakPolarHBondContact O-CG 3.42Å; K73-Q77 PolarHBondContact O-N 3.16Å; T74-Q77 PolarHBondContact O-N 3.11Å; K75-Q77 PolarHBondContact O-N 3.37Å; Q77-L81 WeakPolarHBondContact O-CB 3.41Å; Q77-L81 WeakPolarHBondContact O-CG 3.42Å; Q77-L81 PolarHBondContact O-N 3.04Å
78	L	93.2	Very high	89.3	Confident	16 Å²	16	65.6 Å²	65.6	8%	0.084	32%	0.323	C	S	.	.	H	α-helix	trans	-66.1	-41	176.8	176.7	63.1	0	0	0	111.6	V57 K60 I64 T74 K75 T76 L81 N82	V57-L78 HydrophobicContact CB-CD1 4.24Å; V57-L78 HydrophobicContact CG1-CD1 3.81Å; V57-L78 HydrophobicContact CG2-CD1 4.08Å; K60-L78 HydrophobicContact CB-CB 4.43Å; K60-L78 HydrophobicContact CB-CD1 4.26Å; I64-L78 HydrophobicContact CD1-CD2 3.53Å; T74-L78 WeakPolarHBondContact O-CB 3.39Å; T74-L78 PolarHBondContact O-N 3.13Å; K75-L78 WeakPolarHBondContact O-CB 3.21Å; K75-L78 PolarHBondContact O-N 3.41Å; K75-L78 VanDerWaalsContact O-N 3.14Å; T76-L78 VanDerWaalsContact C-N 3.29Å; T76-L78 PolarHBondContact O-N 3.13Å; L78-L81 PolarHBondContact O-N 3.15Å; L78-N82 VanDerWaalsContact O-CG 3.3Å; L78-N82 PolarHBondContact O-N 3.25Å; L78-N82 PolarHBondContact O-ND2 3.35Å
79	E	92.3	Very high	90.8	Very high	70 Å²	70	57.5 Å²	57.5	33%	0.327	28%	0.281	S	S	.	.	H	α-helix	trans	-63.4	-47.1	175.3	-72.2	169.3	-161	0	0	111.4	K75 T76 L81 N82 E83 K207	K75-E79 WeakPolarHBondContact O-CG 3.39Å; K75-E79 PolarHBondContact O-N 3.01Å; T76-E79 PolarHBondContact O-N 2.98Å; E79-L81 VanDerWaalsContact C-N 3.3Å; E79-L81 PolarHBondContact O-N 2.95Å; E79-N82 PolarHBondContact O-N 3.27Å; E79-E83 WeakPolarHBondContact O-CG 3.39Å; E79-E83 PolarHBondContact O-N 3.26Å; E79-K207 WeakPolarHBondContact OE1-CD 3.43Å; E79-K207 WeakPolarHBondContact OE1-CE 3.33Å; E79-K207 IonicContact OE1-NZ 2.65Å; E79-K207 PolarHBondContact OE1-NZ 2.98Å
80	E	95.7	Very high	91.9	Very high	119 Å²	119	55.3 Å²	55.3	56%	0.556	27%	0.269	S	S	*	.	H	α-helix	trans	-57.1	-42.2	175.1	-71.8	171.8	178.4	0	0	112.2	T76 E83 S84	T76-E80 WeakPolarHBondContact O-CG 3.44Å; T76-E80 PolarHBondContact O-N 3.06Å; E80-E83 PolarHBondContact O-N 3.16Å; E80-S84 WeakPolarHBondContact O-CB 3.29Å; E80-S84 PolarHBondContact O-N 3.44Å
81	L	96.5	Very high	93	Very high	20 Å²	20	56.6 Å²	56.6	11%	0.105	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-45.8	176.5	-73.8	168.4	0	0	0	111.9	E53 Q56 V57 K60 Q77 L78 E79 E83 S84 I85	E53-L81 HydrophobicContact CB-CD2 4.01Å; E53-L81 HydrophobicContact CG-CD2 4Å; Q56-L81 HydrophobicContact CB-CD1 3.8Å; Q56-L81 HydrophobicContact CB-CD2 4.24Å; Q56-L81 VanDerWaalsContact OE1-CD2 3.24Å; V57-L81 HydrophobicContact CG2-CB 3.66Å; V57-L81 HydrophobicContact CG2-CD1 4.1Å; V57-L81 HydrophobicContact CG2-CG 4.46Å; K60-L81 HydrophobicContact CG-CD1 4.15Å; Q77-L81 WeakPolarHBondContact O-CB 3.41Å; Q77-L81 WeakPolarHBondContact O-CG 3.42Å; Q77-L81 PolarHBondContact O-N 3.04Å; L78-L81 PolarHBondContact O-N 3.15Å; E79-L81 VanDerWaalsContact C-N 3.3Å; E79-L81 PolarHBondContact O-N 2.95Å; L81-E83 VanDerWaalsContact C-N 3.33Å; L81-E83 PolarHBondContact O-N 3.41Å; L81-S84 PolarHBondContact O-N 3.04Å; L81-I85 WeakPolarHBondContact O-CB 3.28Å; L81-I85 WeakPolarHBondContact O-CD1 3.24Å; L81-I85 WeakPolarHBondContact O-CG1 3.5Å; L81-I85 PolarHBondContact O-N 2.87Å
82	N	95	Very high	93.8	Very high	21 Å²	21	53 Å²	53	11%	0.112	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-42.2	178	-71.9	-31.3	0	0	0	111.3	L78 E79 I85 T86 Y137 Q141	L78-N82 VanDerWaalsContact O-CG 3.3Å; L78-N82 PolarHBondContact O-N 3.25Å; L78-N82 PolarHBondContact O-ND2 3.35Å; E79-N82 PolarHBondContact O-N 3.27Å; N82-I85 PolarHBondContact O-N 3.08Å; N82-T86 WeakPolarHBondContact O-CB 3.45Å; N82-T86 PolarHBondContact O-N 3.45Å; N82-T86 PolarHBondContact O-OG1 2.85Å; N82-Y137 PolarHBondContact OD1-OH 3.46Å; N82-Q141 PolarHBondContact OD1-NE2 3.26Å
83	E	94.5	Very high	94.2	Very high	116 Å²	116	51.1 Å²	51.1	54%	0.542	24%	0.237	S	C	.	.	H	α-helix	trans	-63.8	-42.3	175.4	-71.8	-175.3	-178.1	0	0	112.4	E79 E80 L81 T86 R87	E79-E83 WeakPolarHBondContact O-CG 3.39Å; E79-E83 PolarHBondContact O-N 3.26Å; E80-E83 PolarHBondContact O-N 3.16Å; L81-E83 VanDerWaalsContact C-N 3.33Å; L81-E83 PolarHBondContact O-N 3.41Å; E83-T86 PolarHBondContact O-N 3.29Å; E83-R87 WeakPolarHBondContact O-CB 3.27Å; E83-R87 PolarHBondContact O-N 2.82Å
84	S	96.5	Very high	94.5	Very high	22 Å²	22	49.1 Å²	49.1	15%	0.154	23%	0.232	C	C	.	.	H	α-helix	trans	-63.2	-44.9	177	-168.3	0	0	0	0	111.9	E53 E80 L81 R87 S88	E53-S84 VanDerWaalsContact CD-OG 3.31Å; E53-S84 WeakPolarHBondContact OE1-CB 3.47Å; E53-S84 PolarHBondContact OE1-OG 3.24Å; E53-S84 PolarHBondContact OE2-OG 3.35Å; E80-S84 WeakPolarHBondContact O-CB 3.29Å; E80-S84 PolarHBondContact O-N 3.44Å; L81-S84 PolarHBondContact O-N 3.04Å; S84-R87 PolarHBondContact O-N 3.3Å; S84-S88 WeakPolarHBondContact O-CB 3.48Å; S84-S88 PolarHBondContact O-N 2.82Å; S84-S88 PolarHBondContact O-OG 2.99Å
85	I	97.1	Very high	94.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.2	-49.3	177.1	-70.6	162.6	0	0	0	110.1	T50 E53 I54 V57 L81 N82 R87 S88 A89 M134 Y137	T50-I85 HydrophobicContact CG2-CG1 4.41Å; T50-I85 HydrophobicContact CG2-CG2 4.04Å; E53-I85 HydrophobicContact CB-CD1 3.95Å; E53-I85 HydrophobicContact CB-CG1 3.67Å; I54-I85 HydrophobicContact CG1-CD1 3.76Å; I54-I85 HydrophobicContact CG1-CG1 4.25Å; I54-I85 HydrophobicContact CG1-CG2 4.44Å; V57-I85 HydrophobicContact CG2-CD1 3.69Å; L81-I85 WeakPolarHBondContact O-CB 3.28Å; L81-I85 WeakPolarHBondContact O-CD1 3.24Å; L81-I85 WeakPolarHBondContact O-CG1 3.5Å; L81-I85 PolarHBondContact O-N 2.87Å; N82-I85 PolarHBondContact O-N 3.08Å; I85-R87 VanDerWaalsContact C-N 3.31Å; I85-R87 PolarHBondContact O-N 3.48Å; I85-S88 PolarHBondContact O-N 3.06Å; I85-A89 VanDerWaalsContact O-CB 3.31Å; I85-A89 WeakPolarHBondContact O-CB 3.3Å; I85-A89 PolarHBondContact O-N 2.99Å; I85-M134 HydrophobicContact CG2-CE 4.25Å; I85-M134 HydrophobicContact CG2-SD 4.32Å; I85-Y137 HydrophobicContact CD1-CD2 4.26Å; I85-Y137 HydrophobicContact CD1-CE2 3.77Å; I85-Y137 HydrophobicContact CG2-CD1 4.15Å; I85-Y137 HydrophobicContact CG2-CE1 3.95Å; I85-Y137 HydrophobicContact CG2-CE2 4.4Å; I85-Y137 HydrophobicContact CG2-CG 4.48Å
86	T	94.5	Very high	95.1	Very high	9 Å²	9	50.9 Å²	50.9	6%	0.055	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-40.7	179.3	-68.4	0	0	0	0	111.5	N82 E83 K90	N82-T86 WeakPolarHBondContact O-CB 3.45Å; N82-T86 PolarHBondContact O-N 3.45Å; N82-T86 PolarHBondContact O-OG1 2.85Å; E83-T86 PolarHBondContact O-N 3.29Å; T86-K90 HydrophobicContact CG2-CD 4.21Å; T86-K90 VanDerWaalsContact O-CG 3.28Å; T86-K90 WeakPolarHBondContact O-CG 3.38Å; T86-K90 PolarHBondContact O-N 2.98Å; T86-K90 VanDerWaalsContact O-N 3.14Å
87	R	95.6	Very high	95.1	Very high	137 Å²	137	53.5 Å²	53.5	52%	0.517	25%	0.245	S	C	.	.	H	α-helix	trans	-64.9	-50.8	176.8	-170.9	-177.6	-59	131.9	5.7	111.4	E83 S84 I85 A89 K90 E91	E83-R87 WeakPolarHBondContact O-CB 3.27Å; E83-R87 PolarHBondContact O-N 2.82Å; S84-R87 PolarHBondContact O-N 3.3Å; I85-R87 VanDerWaalsContact C-N 3.31Å; I85-R87 PolarHBondContact O-N 3.48Å; R87-A89 VanDerWaalsContact C-N 3.32Å; R87-A89 PolarHBondContact O-N 3.26Å; R87-K90 PolarHBondContact O-N 3.31Å; R87-K90 VanDerWaalsContact O-N 3.13Å; R87-E91 WeakPolarHBondContact O-CG 3.44Å; R87-E91 PolarHBondContact O-N 2.85Å
88	S	96.8	Very high	95.1	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.014	25%	0.249	C	C	.	.	H	α-helix	trans	-59.7	-43.4	-179.8	-54.8	0	0	0	0	111.1	T50 S84 I85 K90 E91 I92	T50-S88 WeakPolarHBondContact OG1-CB 3.5Å; S84-S88 WeakPolarHBondContact O-CB 3.48Å; S84-S88 PolarHBondContact O-N 2.82Å; S84-S88 PolarHBondContact O-OG 2.99Å; I85-S88 PolarHBondContact O-N 3.06Å; S88-K90 PolarHBondContact O-N 3.24Å; S88-E91 PolarHBondContact O-N 3.46Å; S88-I92 WeakPolarHBondContact O-CB 3.36Å; S88-I92 WeakPolarHBondContact O-CD1 3.49Å; S88-I92 WeakPolarHBondContact O-CG1 3.44Å; S88-I92 PolarHBondContact O-N 3.15Å
89	A	95.8	Very high	95.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.8	-42.1	176	0	0	0	0	0	112.7	I85 R87 R93 M134 L218 M222	I85-A89 VanDerWaalsContact O-CB 3.31Å; I85-A89 WeakPolarHBondContact O-CB 3.3Å; I85-A89 PolarHBondContact O-N 2.99Å; R87-A89 VanDerWaalsContact C-N 3.32Å; R87-A89 PolarHBondContact O-N 3.26Å; A89-R93 VanDerWaalsContact O-CB 3.29Å; A89-R93 WeakPolarHBondContact O-CB 3.43Å; A89-R93 PolarHBondContact O-N 3.42Å; A89-M134 HydrophobicContact CB-CE 4.04Å; A89-M134 HydrophobicContact CB-SD 4.06Å; A89-L218 HydrophobicContact CB-CD1 3.79Å; A89-L218 HydrophobicContact CB-CD2 4.22Å; A89-M222 HydrophobicContact CB-CE 4.24Å
90	K	94.9	Very high	95	Very high	104 Å²	104	50 Å²	50	45%	0.452	23%	0.234	S	C	.	.	H	α-helix	trans	-64.8	-42.5	176.7	-74.1	172.4	-178.4	173	0	112	T86 R87 S88 R93 L94 L218	T86-K90 HydrophobicContact CG2-CD 4.21Å; T86-K90 VanDerWaalsContact O-CG 3.28Å; T86-K90 WeakPolarHBondContact O-CG 3.38Å; T86-K90 PolarHBondContact O-N 2.98Å; T86-K90 VanDerWaalsContact O-N 3.14Å; R87-K90 PolarHBondContact O-N 3.31Å; R87-K90 VanDerWaalsContact O-N 3.13Å; S88-K90 PolarHBondContact O-N 3.24Å; K90-R93 PolarHBondContact O-N 3.1Å; K90-L94 WeakPolarHBondContact O-CG 3.33Å; K90-L94 PolarHBondContact O-N 2.71Å; K90-L218 HydrophobicContact CG-CD2 3.93Å
91	E	96.4	Very high	94.7	Very high	79 Å²	79	49.8 Å²	49.8	37%	0.369	23%	0.233	S	C	.	.	H	α-helix	trans	-68.3	-44.8	178.8	-68.6	-179.9	-172.8	0	0	112.2	W42 R87 S88 R93 L94 K95	W42-E91 HydrophobicContact CH2-CB 3.87Å; R87-E91 WeakPolarHBondContact O-CG 3.44Å; R87-E91 PolarHBondContact O-N 2.85Å; S88-E91 PolarHBondContact O-N 3.46Å; E91-R93 VanDerWaalsContact C-N 3.28Å; E91-R93 PolarHBondContact O-N 3.43Å; E91-L94 PolarHBondContact O-N 3.06Å; E91-K95 PolarHBondContact O-N 3.39Å
92	I	96.8	Very high	94.4	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-56.2	-46.6	173.9	-70.5	162	0	0	0	109.9	W42 I43 E46 I47 S88 L94 K95 L96 I130	W42-I92 HydrophobicContact CZ3-CG1 4.25Å; I43-I92 HydrophobicContact CG2-CG2 3.98Å; E46-I92 HydrophobicContact CB-CD1 3.86Å; E46-I92 HydrophobicContact CB-CG1 3.87Å; I47-I92 HydrophobicContact CG1-CD1 3.86Å; I47-I92 HydrophobicContact CG1-CG2 4.36Å; S88-I92 WeakPolarHBondContact O-CB 3.36Å; S88-I92 WeakPolarHBondContact O-CD1 3.49Å; S88-I92 WeakPolarHBondContact O-CG1 3.44Å; S88-I92 PolarHBondContact O-N 3.15Å; I92-L94 PolarHBondContact O-N 2.9Å; I92-K95 PolarHBondContact O-N 2.94Å; I92-L96 HydrophobicContact CG2-CD1 3.76Å; I92-L96 HydrophobicContact CG2-CG 4.23Å; I92-L96 WeakPolarHBondContact O-CB 3.46Å; I92-L96 WeakPolarHBondContact O-CG 3.25Å; I92-L96 PolarHBondContact O-N 3.16Å; I92-I130 HydrophobicContact CD1-CD1 3.93Å; I92-I130 HydrophobicContact CG2-CB 4.24Å; I92-I130 HydrophobicContact CG2-CD1 4.46Å; I92-I130 HydrophobicContact CG2-CG1 3.97Å; I92-I130 HydrophobicContact CG2-CG2 4.39Å
93	R	94.7	Very high	94.1	Very high	56 Å²	56	50.2 Å²	50.2	21%	0.211	24%	0.237	C	C	.	.	H	α-helix	trans	-59.6	-44.6	177.7	-176.3	-157.3	67.6	112.3	3	112.2	A89 K90 E91 K95 L96 K97 D221 L225	A89-R93 VanDerWaalsContact O-CB 3.29Å; A89-R93 WeakPolarHBondContact O-CB 3.43Å; A89-R93 PolarHBondContact O-N 3.42Å; K90-R93 PolarHBondContact O-N 3.1Å; E91-R93 VanDerWaalsContact C-N 3.28Å; E91-R93 PolarHBondContact O-N 3.43Å; R93-K95 VanDerWaalsContact C-N 3.34Å; R93-K95 PolarHBondContact O-N 3.48Å; R93-L96 PolarHBondContact O-N 2.97Å; R93-K97 WeakPolarHBondContact O-CB 3.46Å; R93-K97 PolarHBondContact O-N 3.47Å; R93-D221 VanDerWaalsContact CD-CB 3.45Å; R93-D221 WeakPolarHBondContact CD-OD2 3.42Å; R93-D221 HydrophobicContact CG-CB 4.36Å; R93-D221 IonicContact CZ-OD2 2.71Å; R93-D221 IonicContact NE-OD2 2.7Å; R93-D221 PolarHBondContact NE-OD2 2.88Å; R93-D221 IonicContact NH1-OD1 3.4Å; R93-D221 PolarHBondContact NH1-OD1 3.16Å; R93-D221 IonicContact NH1-OD2 3.78Å; R93-D221 PolarHBondContact NH1-OD2 2.86Å; R93-L225 HydrophobicContact CG-CD1 4.01Å
94	L	94.7	Very high	93.8	Very high	100 Å²	100	51.1 Å²	51.1	52%	0.524	24%	0.236	S	C	.	.	H	α-helix	trans	-60.4	-43.7	177.9	-74	171.9	0	0	0	111.7	K90 E91 I92 K97 S98	K90-L94 WeakPolarHBondContact O-CG 3.33Å; K90-L94 PolarHBondContact O-N 2.71Å; E91-L94 PolarHBondContact O-N 3.06Å; I92-L94 PolarHBondContact O-N 2.9Å; L94-K97 PolarHBondContact O-N 3.31Å; L94-S98 PolarHBondContact O-N 3.11Å
95	K	95.5	Very high	93.3	Very high	66 Å²	66	54.9 Å²	54.9	29%	0.287	25%	0.251	S	S	.	.	H	α-helix	trans	-69.7	-39.3	177.1	-72.7	-176.9	-177.3	-75.8	0	112.9	W42 I43 E91 I92 R93 K97 S98 L99	W42-K95 HydrophobicContact CD2-CD 3.91Å; W42-K95 HydrophobicContact CE3-CD 3.23Å; W42-K95 HydrophobicContact CH2-CD 3.98Å; W42-K95 HydrophobicContact CZ3-CD 3.32Å; W42-K95 VanDerWaalsContact CZ3-CE 3.47Å; W42-K95 HydrophobicContact CZ3-CG 4.42Å; I43-K95 HydrophobicContact CD1-CB 3.9Å; I43-K95 HydrophobicContact CG1-CB 4.04Å; I43-K95 HydrophobicContact CG1-CD 4.19Å; E91-K95 PolarHBondContact O-N 3.39Å; I92-K95 PolarHBondContact O-N 2.94Å; R93-K95 VanDerWaalsContact C-N 3.34Å; R93-K95 PolarHBondContact O-N 3.48Å; K95-K97 VanDerWaalsContact C-N 3.29Å; K95-K97 PolarHBondContact O-N 3.46Å; K95-S98 WeakPolarHBondContact O-CB 3.49Å; K95-S98 PolarHBondContact O-N 3.23Å; K95-L99 WeakPolarHBondContact O-CG 3.43Å; K95-L99 PolarHBondContact O-N 3.49Å
96	L	95	Very high	92.7	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.3	-41.8	173.7	-76.3	174.1	0	0	0	111.4	I43 I92 R93 S98 L99 E100 F123 L126 I130 L225	I43-L96 HydrophobicContact CD1-CD2 4.13Å; I43-L96 HydrophobicContact CD1-CG 4.41Å; I92-L96 HydrophobicContact CG2-CD1 3.76Å; I92-L96 HydrophobicContact CG2-CG 4.23Å; I92-L96 WeakPolarHBondContact O-CB 3.46Å; I92-L96 WeakPolarHBondContact O-CG 3.25Å; I92-L96 PolarHBondContact O-N 3.16Å; R93-L96 PolarHBondContact O-N 2.97Å; L96-S98 VanDerWaalsContact C-N 3.33Å; L96-S98 PolarHBondContact O-N 2.81Å; L96-L99 PolarHBondContact O-N 3.21Å; L96-E100 WeakPolarHBondContact O-CB 3.22Å; L96-E100 PolarHBondContact O-N 3.41Å; L96-F123 HydrophobicContact CB-CE2 4.26Å; L96-F123 HydrophobicContact CD2-CD2 4.09Å; L96-F123 HydrophobicContact CD2-CE2 4.39Å; L96-F123 VanDerWaalsContact O-CE2 3.3Å; L96-F123 WeakPolarHBondContact O-CE2 3.37Å; L96-L126 HydrophobicContact CD2-CB 3.81Å; L96-L126 HydrophobicContact CD2-CD1 4.4Å; L96-I130 HydrophobicContact CD1-CG2 3.77Å; L96-L225 HydrophobicContact CB-CD1 4.06Å; L96-L225 HydrophobicContact CB-CD2 4.36Å; L96-L225 HydrophobicContact CD1-CD1 4.04Å
97	K	92.9	Very high	92.2	Very high	123 Å²	123	57.6 Å²	57.6	54%	0.535	26%	0.263	S	S	.	.	H	α-helix	trans	-63.3	-38.8	174.8	-171	174.6	-178.6	177	0	112.4	R93 L94 K95 E100 Q101	R93-K97 WeakPolarHBondContact O-CB 3.46Å; R93-K97 PolarHBondContact O-N 3.47Å; L94-K97 PolarHBondContact O-N 3.31Å; K95-K97 VanDerWaalsContact C-N 3.29Å; K95-K97 PolarHBondContact O-N 3.46Å; K97-E100 WeakPolarHBondContact O-CB 3.45Å; K97-E100 PolarHBondContact O-N 2.88Å; K97-Q101 PolarHBondContact O-N 2.95Å
98	S	93	Very high	91.6	Very high	54 Å²	54	55.3 Å²	55.3	38%	0.378	27%	0.273	S	S	.	.	H	α-helix	trans	-62.2	-47.2	173.4	-168.5	0	0	0	0	111.5	L94 K95 L96 E100 Q101 T102	L94-S98 PolarHBondContact O-N 3.11Å; K95-S98 WeakPolarHBondContact O-CB 3.49Å; K95-S98 PolarHBondContact O-N 3.23Å; L96-S98 VanDerWaalsContact C-N 3.33Å; L96-S98 PolarHBondContact O-N 2.81Å; S98-E100 VanDerWaalsContact C-N 3.32Å; S98-E100 PolarHBondContact O-N 2.99Å; S98-Q101 WeakPolarHBondContact O-CB 3.47Å; S98-Q101 PolarHBondContact O-N 3.41Å; S98-T102 PolarHBondContact O-N 2.91Å; S98-T102 PolarHBondContact O-OG1 3.37Å
99	L	92.1	Very high	90.9	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-60.4	-41.9	176.3	-73.4	-177.8	0	0	0	112.1	F36 E39 V40 I43 K95 L96 Q101 T102 I103 F123	F36-L99 HydrophobicContact CD2-CD2 3.55Å; F36-L99 HydrophobicContact CE2-CD1 4.34Å; F36-L99 HydrophobicContact CE2-CD2 3.69Å; E39-L99 HydrophobicContact CB-CD2 4.44Å; E39-L99 WeakPolarHBondContact OE2-CD2 3.15Å; V40-L99 HydrophobicContact CG2-CD1 4.41Å; I43-L99 HydrophobicContact CD1-CD1 3.5Å; I43-L99 VanDerWaalsContact CD1-CD1 3.5Å; I43-L99 HydrophobicContact CD1-CG 4.47Å; K95-L99 WeakPolarHBondContact O-CG 3.43Å; K95-L99 PolarHBondContact O-N 3.49Å; L96-L99 PolarHBondContact O-N 3.21Å; L99-Q101 VanDerWaalsContact C-N 3.32Å; L99-Q101 PolarHBondContact O-N 3.41Å; L99-T102 PolarHBondContact O-N 2.9Å; L99-I103 WeakPolarHBondContact O-CB 3.37Å; L99-I103 WeakPolarHBondContact O-CD1 3.43Å; L99-I103 WeakPolarHBondContact O-CG1 3.41Å; L99-I103 PolarHBondContact O-N 2.63Å; L99-F123 HydrophobicContact CB-CD2 4.33Å
100	E	90.8	Very high	90.1	Very high	18 Å²	18	65.5 Å²	65.5	8%	0.084	33%	0.328	C	S	.	.	H	α-helix	trans	-58.4	-45.1	175.4	-172	-176.6	-171.2	0	0	111.4	L96 K97 S98 I103 R104 F123 T228	L96-E100 WeakPolarHBondContact O-CB 3.22Å; L96-E100 PolarHBondContact O-N 3.41Å; K97-E100 WeakPolarHBondContact O-CB 3.45Å; K97-E100 PolarHBondContact O-N 2.88Å; S98-E100 VanDerWaalsContact C-N 3.32Å; S98-E100 PolarHBondContact O-N 2.99Å; E100-I103 WeakPolarHBondContact O-CB 3.44Å; E100-I103 PolarHBondContact O-N 2.82Å; E100-R104 WeakPolarHBondContact O-CG 3.47Å; E100-R104 PolarHBondContact O-N 3.2Å; E100-R104 IonicContact OE1-CZ 3.62Å; E100-R104 IonicContact OE1-NE 2.63Å; E100-R104 IonicContact OE1-NH2 3.41Å; E100-R104 PolarHBondContact OE1-NH2 3.19Å; E100-F123 HydrophobicContact CB-CD2 4.35Å; E100-F123 HydrophobicContact CB-CE2 3.68Å; E100-F123 HydrophobicContact CB-CZ 3.8Å; E100-F123 HydrophobicContact CG-CE1 4.36Å; E100-F123 HydrophobicContact CG-CE2 4.29Å; E100-F123 HydrophobicContact CG-CZ 3.88Å; E100-T228 WeakPolarHBondContact OE1-CB 3.2Å; E100-T228 VanDerWaalsContact OE1-CG2 3.26Å; E100-T228 WeakPolarHBondContact OE1-CG2 3.35Å; E100-T228 PolarHBondContact OE1-OG1 3.13Å
101	Q	90.2	Very high	89.1	Confident	115 Å²	115	62.8 Å²	62.8	54%	0.537	32%	0.324	S	S	.	.	H	α-helix	trans	-61.7	-49.5	177.8	-179.9	177.1	-13.2	0	0	111.5	K97 S98 L99 I103 R104 E105	K97-Q101 PolarHBondContact O-N 2.95Å; S98-Q101 WeakPolarHBondContact O-CB 3.47Å; S98-Q101 PolarHBondContact O-N 3.41Å; L99-Q101 VanDerWaalsContact C-N 3.32Å; L99-Q101 PolarHBondContact O-N 3.41Å; Q101-I103 VanDerWaalsContact C-N 3.26Å; Q101-I103 PolarHBondContact O-N 3.28Å; Q101-R104 PolarHBondContact O-N 3.36Å; Q101-R104 VanDerWaalsContact O-N 3.09Å; Q101-E105 VanDerWaalsContact CG-OE1 3.32Å; Q101-E105 WeakPolarHBondContact CG-OE1 3.31Å; Q101-E105 PolarHBondContact NE2-OE1 2.7Å; Q101-E105 WeakPolarHBondContact O-CG 3.5Å; Q101-E105 PolarHBondContact O-N 3.19Å
102	T	89.4	Confident	87.9	Confident	49 Å²	49	63.9 Å²	63.9	30%	0.301	34%	0.337	S	S	.	.	H	α-helix	trans	-60.5	-36.4	177.8	-53.7	0	0	0	0	112.1	S98 L99 Q106	S98-T102 PolarHBondContact O-N 2.91Å; S98-T102 PolarHBondContact O-OG1 3.37Å; L99-T102 PolarHBondContact O-N 2.9Å; T102-Q106 WeakPolarHBondContact O-CB 3.27Å; T102-Q106 PolarHBondContact O-N 2.9Å
103	I	89	Confident	87.1	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-62.4	-44.9	174.6	-76.1	163.7	0	0	0	111.2	L99 E100 Q101 Q106 E107 L116 R119 K120 F123 L232	L99-I103 WeakPolarHBondContact O-CB 3.37Å; L99-I103 WeakPolarHBondContact O-CD1 3.43Å; L99-I103 WeakPolarHBondContact O-CG1 3.41Å; L99-I103 PolarHBondContact O-N 2.63Å; E100-I103 WeakPolarHBondContact O-CB 3.44Å; E100-I103 PolarHBondContact O-N 2.82Å; Q101-I103 VanDerWaalsContact C-N 3.26Å; Q101-I103 PolarHBondContact O-N 3.28Å; I103-Q106 PolarHBondContact O-N 3.21Å; I103-E107 WeakPolarHBondContact O-CB 3.42Å; I103-E107 PolarHBondContact O-N 2.69Å; I103-L116 HydrophobicContact CG2-CD1 4.03Å; I103-L116 WeakPolarHBondContact O-CD1 3.49Å; I103-R119 HydrophobicContact CD1-CB 4.16Å; I103-R119 HydrophobicContact CG1-CB 3.78Å; I103-K120 HydrophobicContact CG2-CD 4.34Å; I103-K120 HydrophobicContact CG2-CG 3.54Å; I103-F123 HydrophobicContact CD1-CB 3.45Å; I103-F123 VanDerWaalsContact CD1-CB 3.45Å; I103-F123 HydrophobicContact CD1-CD1 4.39Å; I103-F123 HydrophobicContact CD1-CG 3.88Å; I103-L232 HydrophobicContact CG2-CD2 4.2Å
104	R	87.2	Confident	86.5	Confident	136 Å²	136	64.4 Å²	64.4	51%	0.513	35%	0.352	S	S	.	.	H	α-helix	trans	-66.1	-41	179.4	-70.1	178.6	-174.4	-156.3	3.4	112	E100 Q101 E107 A108 T228	E100-R104 WeakPolarHBondContact O-CG 3.47Å; E100-R104 PolarHBondContact O-N 3.2Å; E100-R104 IonicContact OE1-CZ 3.62Å; E100-R104 IonicContact OE1-NE 2.63Å; E100-R104 IonicContact OE1-NH2 3.41Å; E100-R104 PolarHBondContact OE1-NH2 3.19Å; Q101-R104 PolarHBondContact O-N 3.36Å; Q101-R104 VanDerWaalsContact O-N 3.09Å; R104-E107 PolarHBondContact O-N 2.91Å; R104-A108 PolarHBondContact O-N 3Å; R104-A108 VanDerWaalsContact O-N 3.08Å; R104-T228 VanDerWaalsContact NH2-CG2 3.31Å
105	E	88	Confident	86	Confident	100 Å²	100	62.8 Å²	62.8	47%	0.467	34%	0.344	S	S	.	.	H	α-helix	trans	-62.7	-44.2	175.9	-71.1	168.3	-175.1	0	0	111.3	Q101 A108 N109	Q101-E105 VanDerWaalsContact CG-OE1 3.32Å; Q101-E105 WeakPolarHBondContact CG-OE1 3.31Å; Q101-E105 PolarHBondContact NE2-OE1 2.7Å; Q101-E105 WeakPolarHBondContact O-CG 3.5Å; Q101-E105 PolarHBondContact O-N 3.19Å; E105-A108 PolarHBondContact O-N 3.32Å; E105-N109 PolarHBondContact O-N 3.38Å; E105-N109 PolarHBondContact O-ND2 3.44Å
106	Q	84	Confident	85.5	Confident	40 Å²	40	59.8 Å²	59.8	19%	0.187	33%	0.331	C	S	.	.	H	α-helix	trans	-67.9	-35.9	176.6	-174.9	172.3	-4.7	0	0	112.2	T102 I103 A108 N109 D110 S113 L116	T102-Q106 WeakPolarHBondContact O-CB 3.27Å; T102-Q106 PolarHBondContact O-N 2.9Å; I103-Q106 PolarHBondContact O-N 3.21Å; Q106-A108 VanDerWaalsContact C-N 3.33Å; Q106-A108 PolarHBondContact O-N 2.94Å; Q106-N109 PolarHBondContact O-N 3.14Å; Q106-D110 CarbonylContact O-C 3.15Å; Q106-D110 PolarHBondContact O-N 3.16Å; Q106-S113 PolarHBondContact NE2-OG 3.19Å; Q106-L116 HydrophobicContact CB-CD1 4.11Å; Q106-L116 HydrophobicContact CG-CB 4.36Å; Q106-L116 HydrophobicContact CG-CD1 4.16Å
107	E	84.1	Confident	85	Confident	27 Å²	27	61.8 Å²	61.8	13%	0.126	34%	0.338	C	S	.	.	H	α-helix	trans	-64.7	-34.9	175.6	178.1	156.2	-137.9	0	0	113.2	I103 R104 N109 A111 L116 K120 R235	I103-E107 WeakPolarHBondContact O-CB 3.42Å; I103-E107 PolarHBondContact O-N 2.69Å; R104-E107 PolarHBondContact O-N 2.91Å; E107-N109 PolarHBondContact O-N 3.11Å; E107-A111 HydrophobicContact CG-CB 4.43Å; E107-A111 PolarHBondContact O-N 3.32Å; E107-L116 HydrophobicContact CB-CD1 4.24Å; E107-L116 HydrophobicContact CB-CD2 3.91Å; E107-L116 HydrophobicContact CG-CD2 4.31Å; E107-K120 IonicContact OE1-NZ 3.49Å; E107-K120 PolarHBondContact OE1-NZ 3.41Å; E107-K120 WeakPolarHBondContact OE2-CE 3.28Å; E107-K120 IonicContact OE2-NZ 2.62Å; E107-K120 PolarHBondContact OE2-NZ 3.27Å; E107-R235 WeakPolarHBondContact OE1-CD 3.31Å; E107-R235 IonicContact OE1-CZ 3.41Å; E107-R235 VanDerWaalsContact OE1-CZ 3.3Å; E107-R235 IonicContact OE1-NE 3.57Å; E107-R235 IonicContact OE1-NH1 3.74Å; E107-R235 PolarHBondContact OE1-NH1 3.47Å; E107-R235 IonicContact OE2-NH1 3.3Å
108	A	83.4	Confident	84.6	Confident	88 Å²	88	59.1 Å²	59.1	73%	0.727	33%	0.329	S	S	*	.	H	α-helix	trans	-66.4	-27.4	174.3	0	0	0	0	0	112.8	R104 E105 Q106	R104-A108 PolarHBondContact O-N 3Å; R104-A108 VanDerWaalsContact O-N 3.08Å; E105-A108 PolarHBondContact O-N 3.32Å; Q106-A108 VanDerWaalsContact C-N 3.33Å; Q106-A108 PolarHBondContact O-N 2.94Å
109	N	81.6	Confident	84.5	Confident	146 Å²	146	57.3 Å²	57.3	78%	0.781	31%	0.314	S	S	*	.	H	α-helix	trans	-92.7	-46.2	-178.4	-66.3	-31.9	0	0	0	112.8	E105 Q106 E107	E105-N109 PolarHBondContact O-N 3.38Å; E105-N109 PolarHBondContact O-ND2 3.44Å; Q106-N109 PolarHBondContact O-N 3.14Å; E107-N109 PolarHBondContact O-N 3.11Å
110	D	78.1	Confident	84.3	Confident	71 Å²	71	57.3 Å²	57.3	38%	0.38	31%	0.314	S	S	.	.			trans	-149.1	92.8	178.2	-178.3	-1.4	0	0	0	111.6	Q106 T112 S113 L116	Q106-D110 CarbonylContact O-C 3.15Å; Q106-D110 PolarHBondContact O-N 3.16Å; D110-T112 PolarHBondContact O-N 3.41Å; D110-T112 VanDerWaalsContact O-N 3.15Å; D110-T112 PolarHBondContact OD1-N 3.09Å; D110-T112 PolarHBondContact OD1-OG1 2.85Å; D110-S113 PolarHBondContact O-OG 2.94Å; D110-S113 PolarHBondContact OD1-N 3.36Å; D110-S113 VanDerWaalsContact OD1-N 3.15Å; D110-S113 WeakPolarHBondContact OD2-CB 3.44Å; D110-L116 WeakPolarHBondContact O-CD2 3.44Å
111	A	74.1	Confident	84.1	Confident	46 Å²	46	59 Å²	59	38%	0.38	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-10.5	179	0	0	0	0	0	114.8	E107	E107-A111 HydrophobicContact CG-CB 4.43Å; E107-A111 PolarHBondContact O-N 3.32Å
112	T	71.9	Confident	84.1	Confident	103 Å²	103	55.2 Å²	55.2	63%	0.632	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	-3.3	-170.6	58.8	0	0	0	0	114.2	D110 R117	D110-T112 PolarHBondContact O-N 3.41Å; D110-T112 VanDerWaalsContact O-N 3.15Å; D110-T112 PolarHBondContact OD1-N 3.09Å; D110-T112 PolarHBondContact OD1-OG1 2.85Å; T112-R117 PolarHBondContact O-NH1 3.16Å
113	S	80.7	Confident	84.2	Confident	20 Å²	20	52.9 Å²	52.9	14%	0.14	29%	0.293	C	S	.	.			trans	-60.2	144.1	179.2	60.4	0	0	0	0	113.2	Q106 D110 D115 L116 R117	Q106-S113 PolarHBondContact NE2-OG 3.19Å; D110-S113 PolarHBondContact O-OG 2.94Å; D110-S113 PolarHBondContact OD1-N 3.36Å; D110-S113 VanDerWaalsContact OD1-N 3.15Å; D110-S113 WeakPolarHBondContact OD2-CB 3.44Å; S113-D115 VanDerWaalsContact C-N 3.27Å; S113-D115 PolarHBondContact O-N 3.28Å; S113-L116 PolarHBondContact O-N 3.34Å; S113-L116 WeakPolarHBondContact OG-CB 3.3Å; S113-L116 PolarHBondContact OG-N 3.34Å; S113-R117 PolarHBondContact O-N 3.5Å; S113-R117 PolarHBondContact O-NH1 3.12Å
114	A	80.3	Confident	84.2	Confident	47 Å²	47	53.8 Å²	53.8	39%	0.388	30%	0.298	S	S	.	.	H	α-helix	trans	-61.8	-38.5	173.1	0	0	0	0	0	111.8	L116 R117 I118	A114-L116 PolarHBondContact O-N 2.99Å; A114-R117 VanDerWaalsContact CA-CZ 3.44Å; A114-R117 WeakPolarHBondContact O-CB 3.49Å; A114-R117 PolarHBondContact O-N 3.3Å; A114-R117 VanDerWaalsContact O-N 3.15Å; A114-I118 WeakPolarHBondContact O-CG1 3.37Å; A114-I118 PolarHBondContact O-N 3.43Å
115	D	84.7	Confident	84.3	Confident	67 Å²	67	50.7 Å²	50.7	36%	0.358	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-42.4	178.8	-62.4	-11.1	0	0	0	111.4	M33 S113 R117 I118 R119	M33-D115 HydrophobicContact SD-CB 4.2Å; S113-D115 VanDerWaalsContact C-N 3.27Å; S113-D115 PolarHBondContact O-N 3.28Å; D115-R117 VanDerWaalsContact C-N 3.31Å; D115-R117 PolarHBondContact O-N 3.39Å; D115-I118 PolarHBondContact O-N 2.66Å; D115-R119 WeakPolarHBondContact O-CB 3.39Å; D115-R119 VanDerWaalsContact O-CG 3.27Å; D115-R119 WeakPolarHBondContact O-CG 3.2Å; D115-R119 PolarHBondContact O-N 2.98Å
116	L	85.5	Confident	84.6	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-59.2	-42.2	174.6	-179.8	65.1	0	0	0	111.6	I103 Q106 E107 D110 S113 A114 I118 R119 K120	I103-L116 HydrophobicContact CG2-CD1 4.03Å; I103-L116 WeakPolarHBondContact O-CD1 3.49Å; Q106-L116 HydrophobicContact CB-CD1 4.11Å; Q106-L116 HydrophobicContact CG-CB 4.36Å; Q106-L116 HydrophobicContact CG-CD1 4.16Å; E107-L116 HydrophobicContact CB-CD1 4.24Å; E107-L116 HydrophobicContact CB-CD2 3.91Å; E107-L116 HydrophobicContact CG-CD2 4.31Å; D110-L116 WeakPolarHBondContact O-CD2 3.44Å; S113-L116 PolarHBondContact O-N 3.34Å; S113-L116 WeakPolarHBondContact OG-CB 3.3Å; S113-L116 PolarHBondContact OG-N 3.34Å; A114-L116 PolarHBondContact O-N 2.99Å; L116-I118 PolarHBondContact O-N 3.28Å; L116-R119 PolarHBondContact O-N 3.41Å; L116-K120 HydrophobicContact CD1-CD 4.38Å; L116-K120 HydrophobicContact CD1-CG 4.21Å; L116-K120 HydrophobicContact CG-CD 4.2Å; L116-K120 HydrophobicContact CG-CG 4.39Å; L116-K120 WeakPolarHBondContact O-CB 3.39Å; L116-K120 VanDerWaalsContact O-CG 3.3Å; L116-K120 WeakPolarHBondContact O-CG 3.35Å; L116-K120 PolarHBondContact O-N 2.93Å
117	R	83.6	Confident	85.1	Confident	42 Å²	42	44.2 Å²	44.2	16%	0.158	26%	0.264	C	S	.	.	H	α-helix	trans	-63.1	-42.9	177.2	-65.2	-171.4	-64.7	-85.7	14.3	112.3	T112 S113 A114 D115 R119 T121 N239 T243	T112-R117 PolarHBondContact O-NH1 3.16Å; S113-R117 PolarHBondContact O-N 3.5Å; S113-R117 PolarHBondContact O-NH1 3.12Å; A114-R117 VanDerWaalsContact CA-CZ 3.44Å; A114-R117 WeakPolarHBondContact O-CB 3.49Å; A114-R117 PolarHBondContact O-N 3.3Å; A114-R117 VanDerWaalsContact O-N 3.15Å; D115-R117 VanDerWaalsContact C-N 3.31Å; D115-R117 PolarHBondContact O-N 3.39Å; R117-R119 VanDerWaalsContact C-N 3.34Å; R117-T121 WeakPolarHBondContact O-CB 3.45Å; R117-T121 PolarHBondContact O-N 2.63Å; R117-T121 PolarHBondContact O-OG1 3.25Å; R117-N239 HydrophobicContact CG-CB 4.15Å; R117-T243 PolarHBondContact NE-OG1 3.26Å; R117-T243 PolarHBondContact NH2-OG1 3.45Å
118	I	85.7	Confident	85.4	Confident	67 Å²	67	49.6 Å²	49.6	34%	0.344	29%	0.287	S	S	.	.	H	α-helix	trans	-61.5	-48.2	177	-65.3	167.2	0	0	0	109	M33 F36 F37 A114 D115 L116 K120 T121 Q122	M33-I118 HydrophobicContact CE-CB 3.8Å; M33-I118 HydrophobicContact CE-CD1 4.18Å; M33-I118 HydrophobicContact CE-CG2 3.43Å; M33-I118 VanDerWaalsContact CE-CG2 3.43Å; F36-I118 HydrophobicContact CE1-CG2 4.42Å; F37-I118 HydrophobicContact CE1-CG2 4.04Å; F37-I118 HydrophobicContact CZ-CG2 4.2Å; A114-I118 WeakPolarHBondContact O-CG1 3.37Å; A114-I118 PolarHBondContact O-N 3.43Å; D115-I118 PolarHBondContact O-N 2.66Å; L116-I118 PolarHBondContact O-N 3.28Å; I118-K120 PolarHBondContact O-N 3.41Å; I118-T121 PolarHBondContact O-N 3.35Å; I118-Q122 HydrophobicContact CG2-CG 4.41Å; I118-Q122 WeakPolarHBondContact O-CG 3.39Å; I118-Q122 PolarHBondContact O-N 3.13Å
119	R	90.2	Very high	85.9	Confident	15 Å²	15	47.4 Å²	47.4	6%	0.057	27%	0.265	C	S	.	.	H	α-helix	trans	-58.4	-50.7	179.5	-70.4	170.4	177.3	-93.2	-2.9	112.5	Q32 M33 F36 I103 D115 L116 R117 T121 Q122 F123	Q32-R119 PolarHBondContact O-NH2 2.9Å; M33-R119 HydrophobicContact CE-CG 4.45Å; M33-R119 HydrophobicContact SD-CG 4.46Å; F36-R119 HydrophobicContact CD1-CG 3.98Å; F36-R119 HydrophobicContact CD2-CG 3.83Å; F36-R119 HydrophobicContact CE1-CB 4.48Å; F36-R119 HydrophobicContact CE1-CG 3.84Å; F36-R119 HydrophobicContact CE2-CB 3.99Å; F36-R119 HydrophobicContact CE2-CG 3.69Å; F36-R119 HydrophobicContact CG-CG 3.98Å; F36-R119 VanDerWaalsContact CZ-CA 3.48Å; F36-R119 HydrophobicContact CZ-CB 3.96Å; F36-R119 HydrophobicContact CZ-CG 3.7Å; I103-R119 HydrophobicContact CD1-CB 4.16Å; I103-R119 HydrophobicContact CG1-CB 3.78Å; D115-R119 WeakPolarHBondContact O-CB 3.39Å; D115-R119 VanDerWaalsContact O-CG 3.27Å; D115-R119 WeakPolarHBondContact O-CG 3.2Å; D115-R119 PolarHBondContact O-N 2.98Å; L116-R119 PolarHBondContact O-N 3.41Å; R117-R119 VanDerWaalsContact C-N 3.34Å; R119-T121 PolarHBondContact O-N 2.86Å; R119-Q122 PolarHBondContact O-N 3.39Å; R119-F123 WeakPolarHBondContact O-CB 3.47Å; R119-F123 PolarHBondContact O-N 3.32Å
120	K	88	Confident	86.5	Confident	3 Å²	3	40.6 Å²	40.6	1%	0.013	23%	0.228	C	C	.	.	H	α-helix	trans	-58.5	-49.1	176.4	-69.1	-177.5	171.4	-160.3	0	111.6	I103 E107 L116 I118 Q122 F123 L124 L232 I236	I103-K120 HydrophobicContact CG2-CD 4.34Å; I103-K120 HydrophobicContact CG2-CG 3.54Å; E107-K120 IonicContact OE1-NZ 3.49Å; E107-K120 PolarHBondContact OE1-NZ 3.41Å; E107-K120 WeakPolarHBondContact OE2-CE 3.28Å; E107-K120 IonicContact OE2-NZ 2.62Å; E107-K120 PolarHBondContact OE2-NZ 3.27Å; L116-K120 HydrophobicContact CD1-CD 4.38Å; L116-K120 HydrophobicContact CD1-CG 4.21Å; L116-K120 HydrophobicContact CG-CD 4.2Å; L116-K120 HydrophobicContact CG-CG 4.39Å; L116-K120 WeakPolarHBondContact O-CB 3.39Å; L116-K120 VanDerWaalsContact O-CG 3.3Å; L116-K120 WeakPolarHBondContact O-CG 3.35Å; L116-K120 PolarHBondContact O-N 2.93Å; I118-K120 PolarHBondContact O-N 3.41Å; K120-Q122 VanDerWaalsContact C-N 3.31Å; K120-Q122 PolarHBondContact O-N 3.39Å; K120-F123 PolarHBondContact O-N 3.14Å; K120-L124 VanDerWaalsContact O-CG 3.24Å; K120-L124 WeakPolarHBondContact O-CG 3.23Å; K120-L124 PolarHBondContact O-N 2.88Å; K120-L232 HydrophobicContact CD-CD2 3.79Å; K120-L232 VanDerWaalsContact CE-CD2 3.4Å; K120-L232 HydrophobicContact CG-CD2 4.1Å; K120-I236 HydrophobicContact CB-CD1 3.29Å; K120-I236 HydrophobicContact CB-CG1 3.74Å; K120-I236 HydrophobicContact CD-CD1 4.28Å; K120-I236 HydrophobicContact CD-CG1 3.97Å; K120-I236 HydrophobicContact CG-CD1 4.39Å
121	T	86	Confident	87.2	Confident	52 Å²	52	37.6 Å²	37.6	32%	0.319	21%	0.213	S	C	.	.	H	α-helix	trans	-57.8	-43.9	-179.6	-59.9	0	0	0	0	112.1	R117 I118 R119 T125	R117-T121 WeakPolarHBondContact O-CB 3.45Å; R117-T121 PolarHBondContact O-N 2.63Å; R117-T121 PolarHBondContact O-OG1 3.25Å; I118-T121 PolarHBondContact O-N 3.35Å; R119-T121 PolarHBondContact O-N 2.86Å; T121-T125 WeakPolarHBondContact O-CB 3.48Å; T121-T125 PolarHBondContact O-N 2.7Å; T121-T125 PolarHBondContact O-OG1 2.99Å
122	Q	90.6	Very high	88.2	Confident	36 Å²	36	38.6 Å²	38.6	17%	0.168	21%	0.214	C	C	.	.	H	α-helix	trans	-66.1	-48.4	176.5	-67.8	-59.3	-23.1	0	0	111.6	F36 V40 I118 R119 K120 L124 T125 L126	F36-Q122 HydrophobicContact CE1-CB 4.47Å; F36-Q122 HydrophobicContact CE1-CG 4.19Å; F36-Q122 HydrophobicContact CZ-CB 3.82Å; F36-Q122 HydrophobicContact CZ-CG 4.04Å; V40-Q122 HydrophobicContact CG1-CG 4.45Å; V40-Q122 HydrophobicContact CG2-CB 4.09Å; V40-Q122 HydrophobicContact CG2-CG 4.39Å; I118-Q122 HydrophobicContact CG2-CG 4.41Å; I118-Q122 WeakPolarHBondContact O-CG 3.39Å; I118-Q122 PolarHBondContact O-N 3.13Å; R119-Q122 PolarHBondContact O-N 3.39Å; K120-Q122 VanDerWaalsContact C-N 3.31Å; K120-Q122 PolarHBondContact O-N 3.39Å; Q122-L124 VanDerWaalsContact C-N 3.3Å; Q122-L124 PolarHBondContact O-N 2.89Å; Q122-T125 PolarHBondContact O-N 3.38Å; Q122-T125 VanDerWaalsContact O-N 3.16Å; Q122-L126 WeakPolarHBondContact O-CB 3.46Å; Q122-L126 VanDerWaalsContact O-CG 3.25Å; Q122-L126 WeakPolarHBondContact O-CG 3.33Å; Q122-L126 PolarHBondContact O-N 2.97Å
123	F	91.6	Very high	89.3	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-54.2	-47	178.2	168.3	-101.2	0	0	0	111.9	L96 L99 E100 I103 R119 K120 S127 L225 Q229 L232	L96-F123 HydrophobicContact CB-CE2 4.26Å; L96-F123 HydrophobicContact CD2-CD2 4.09Å; L96-F123 HydrophobicContact CD2-CE2 4.39Å; L96-F123 VanDerWaalsContact O-CE2 3.3Å; L96-F123 WeakPolarHBondContact O-CE2 3.37Å; L99-F123 HydrophobicContact CB-CD2 4.33Å; E100-F123 HydrophobicContact CB-CD2 4.35Å; E100-F123 HydrophobicContact CB-CE2 3.68Å; E100-F123 HydrophobicContact CB-CZ 3.8Å; E100-F123 HydrophobicContact CG-CE1 4.36Å; E100-F123 HydrophobicContact CG-CE2 4.29Å; E100-F123 HydrophobicContact CG-CZ 3.88Å; I103-F123 HydrophobicContact CD1-CB 3.45Å; I103-F123 VanDerWaalsContact CD1-CB 3.45Å; I103-F123 HydrophobicContact CD1-CD1 4.39Å; I103-F123 HydrophobicContact CD1-CG 3.88Å; R119-F123 WeakPolarHBondContact O-CB 3.47Å; R119-F123 PolarHBondContact O-N 3.32Å; K120-F123 PolarHBondContact O-N 3.14Å; F123-S127 WeakPolarHBondContact O-CB 3.44Å; F123-S127 PolarHBondContact O-N 3.34Å; F123-S127 PolarHBondContact O-OG 2.92Å; F123-L225 HydrophobicContact CE2-CD2 4.41Å; F123-L225 HydrophobicContact CZ-CD2 4.38Å; F123-Q229 HydrophobicContact CE1-CG 4.24Å; F123-L232 HydrophobicContact CD1-CD1 4.02Å; F123-L232 HydrophobicContact CE1-CD1 3.86Å
124	L	88.5	Confident	90	Very high	21 Å²	21	32.8 Å²	32.8	11%	0.11	18%	0.178	C	C	.	.	H	α-helix	trans	-60.1	-49.5	176.3	-67.9	-176.9	0	0	0	112	K120 Q122 L126 S127 K128 Q229 L232 V233 I236	K120-L124 VanDerWaalsContact O-CG 3.24Å; K120-L124 WeakPolarHBondContact O-CG 3.23Å; K120-L124 PolarHBondContact O-N 2.88Å; Q122-L124 VanDerWaalsContact C-N 3.3Å; Q122-L124 PolarHBondContact O-N 2.89Å; L124-L126 PolarHBondContact O-N 3.12Å; L124-S127 PolarHBondContact O-N 3.47Å; L124-K128 VanDerWaalsContact O-CB 3.31Å; L124-K128 WeakPolarHBondContact O-CB 3.23Å; L124-K128 PolarHBondContact O-N 3.44Å; L124-Q229 HydrophobicContact CD2-CB 3.32Å; L124-Q229 HydrophobicContact CD2-CG 3.26Å; L124-L232 HydrophobicContact CD2-CB 4.23Å; L124-V233 HydrophobicContact CD1-CB 4.37Å; L124-V233 HydrophobicContact CD1-CG2 3.5Å; L124-V233 VanDerWaalsContact CD1-CG2 3.5Å; L124-V233 HydrophobicContact CD2-CG2 3.99Å; L124-V233 HydrophobicContact CG-CG2 4.37Å; L124-I236 HydrophobicContact CD1-CD1 3.25Å; L124-I236 HydrophobicContact CG-CD1 4.16Å
125	T	90	Very high	90.7	Very high	70 Å²	70	35.2 Å²	35.2	43%	0.429	18%	0.181	S	C	.	.	H	α-helix	trans	-61.5	-46	-177.8	-59.3	0	0	0	0	111	T121 Q122 T129	T121-T125 WeakPolarHBondContact O-CB 3.48Å; T121-T125 PolarHBondContact O-N 2.7Å; T121-T125 PolarHBondContact O-OG1 2.99Å; Q122-T125 PolarHBondContact O-N 3.38Å; Q122-T125 VanDerWaalsContact O-N 3.16Å; T125-T129 VanDerWaalsContact O-CB 3.3Å; T125-T129 WeakPolarHBondContact O-CB 3.47Å; T125-T129 PolarHBondContact O-N 2.9Å; T125-T129 PolarHBondContact O-OG1 3.33Å
126	L	94.6	Very high	91.2	Very high	5 Å²	5	36.6 Å²	36.6	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-66	-47.1	179.5	-65.1	173.1	0	0	0	111.3	V40 I43 R44 I47 L96 Q122 L124 K128 T129 I130	V40-L126 HydrophobicContact CB-CD1 4.42Å; V40-L126 HydrophobicContact CG1-CD1 4.18Å; V40-L126 HydrophobicContact CG2-CD1 4.16Å; I43-L126 HydrophobicContact CB-CD1 4.14Å; I43-L126 HydrophobicContact CD1-CD1 4.15Å; I43-L126 HydrophobicContact CG2-CB 4.26Å; I43-L126 HydrophobicContact CG2-CD1 3.96Å; I43-L126 HydrophobicContact CG2-CD2 4.12Å; I43-L126 HydrophobicContact CG2-CG 4.34Å; R44-L126 HydrophobicContact CG-CD2 3.5Å; I47-L126 HydrophobicContact CD1-CB 4.43Å; I47-L126 HydrophobicContact CD1-CD2 4.15Å; L96-L126 HydrophobicContact CD2-CB 3.81Å; L96-L126 HydrophobicContact CD2-CD1 4.4Å; Q122-L126 WeakPolarHBondContact O-CB 3.46Å; Q122-L126 VanDerWaalsContact O-CG 3.25Å; Q122-L126 WeakPolarHBondContact O-CG 3.33Å; Q122-L126 PolarHBondContact O-N 2.97Å; L124-L126 PolarHBondContact O-N 3.12Å; L126-K128 PolarHBondContact O-N 2.99Å; L126-T129 PolarHBondContact O-N 3.48Å; L126-T129 VanDerWaalsContact O-N 3.09Å; L126-I130 WeakPolarHBondContact O-CG2 3.39Å; L126-I130 PolarHBondContact O-N 3.03Å
127	S	93.5	Very high	91.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.3	-42.2	179.4	-63.1	0	0	0	0	112.2	F123 L124 T129 I130 T131	F123-S127 WeakPolarHBondContact O-CB 3.44Å; F123-S127 PolarHBondContact O-N 3.34Å; F123-S127 PolarHBondContact O-OG 2.92Å; L124-S127 PolarHBondContact O-N 3.47Å; S127-T129 VanDerWaalsContact C-N 3.34Å; S127-I130 VanDerWaalsContact O-CG2 3.29Å; S127-I130 WeakPolarHBondContact O-CG2 3.39Å; S127-T131 WeakPolarHBondContact O-CB 3.39Å; S127-T131 PolarHBondContact O-N 2.96Å; S127-T131 VanDerWaalsContact O-N 3.12Å; S127-T131 PolarHBondContact O-OG1 3.05Å
128	K	90.7	Very high	92.3	Very high	140 Å²	140	34.9 Å²	34.9	61%	0.609	18%	0.181	S	C	*	.	H	α-helix	trans	-63	-41.7	172.5	-176.9	175.6	-178.3	175.8	0	111.9	L124 L126 T131 T132	L124-K128 VanDerWaalsContact O-CB 3.31Å; L124-K128 WeakPolarHBondContact O-CB 3.23Å; L124-K128 PolarHBondContact O-N 3.44Å; L126-K128 PolarHBondContact O-N 2.99Å; K128-T131 PolarHBondContact O-N 3.2Å; K128-T132 WeakPolarHBondContact O-CB 3.48Å; K128-T132 PolarHBondContact O-N 3.44Å; K128-T132 PolarHBondContact O-OG1 3.1Å
129	T	93.5	Very high	92.8	Very high	42 Å²	42	41 Å²	41	26%	0.258	20%	0.2	S	C	.	.	H	α-helix	trans	-67.2	-49.1	-176.8	-59.5	0	0	0	0	111.7	I47 T125 L126 S127 T131 T132 I133	I47-T129 HydrophobicContact CG2-CG2 3.71Å; T125-T129 VanDerWaalsContact O-CB 3.3Å; T125-T129 WeakPolarHBondContact O-CB 3.47Å; T125-T129 PolarHBondContact O-N 2.9Å; T125-T129 PolarHBondContact O-OG1 3.33Å; L126-T129 PolarHBondContact O-N 3.48Å; L126-T129 VanDerWaalsContact O-N 3.09Å; S127-T129 VanDerWaalsContact C-N 3.34Å; T129-T131 VanDerWaalsContact C-N 3.32Å; T129-T131 PolarHBondContact O-N 3.45Å; T129-T132 PolarHBondContact O-N 2.86Å; T129-I133 HydrophobicContact CG2-CD1 4.06Å; T129-I133 PolarHBondContact O-N 2.99Å
130	I	95	Very high	93.1	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-61.4	-43.5	176.5	-175.8	57.3	0	0	0	110.6	I47 I92 L96 L126 S127 T132 I133 M134 M222	I47-I130 HydrophobicContact CD1-CB 4.05Å; I47-I130 HydrophobicContact CG1-CB 4.19Å; I47-I130 HydrophobicContact CG1-CD1 4.31Å; I92-I130 HydrophobicContact CD1-CD1 3.93Å; I92-I130 HydrophobicContact CG2-CB 4.24Å; I92-I130 HydrophobicContact CG2-CD1 4.46Å; I92-I130 HydrophobicContact CG2-CG1 3.97Å; I92-I130 HydrophobicContact CG2-CG2 4.39Å; L96-I130 HydrophobicContact CD1-CG2 3.77Å; L126-I130 WeakPolarHBondContact O-CG2 3.39Å; L126-I130 PolarHBondContact O-N 3.03Å; S127-I130 VanDerWaalsContact O-CG2 3.29Å; S127-I130 WeakPolarHBondContact O-CG2 3.39Å; I130-T132 VanDerWaalsContact C-N 3.31Å; I130-T132 PolarHBondContact O-N 3.25Å; I130-I133 PolarHBondContact O-N 3.36Å; I130-M134 HydrophobicContact CD1-CG 3.76Å; I130-M134 HydrophobicContact CD1-SD 4.23Å; I130-M134 HydrophobicContact CG1-CG 4.11Å; I130-M134 WeakPolarHBondContact O-CB 3.31Å; I130-M134 WeakPolarHBondContact O-CG 3.4Å; I130-M134 PolarHBondContact O-N 3.49Å; I130-M222 HydrophobicContact CG1-CE 4.15Å
131	T	93.3	Very high	93.5	Very high	9 Å²	9	41.3 Å²	41.3	6%	0.055	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-42.3	179.4	-56	0	0	0	0	111.7	S127 K128 T129 M134 H135 M222 I226	S127-T131 WeakPolarHBondContact O-CB 3.39Å; S127-T131 PolarHBondContact O-N 2.96Å; S127-T131 VanDerWaalsContact O-N 3.12Å; S127-T131 PolarHBondContact O-OG1 3.05Å; K128-T131 PolarHBondContact O-N 3.2Å; T129-T131 VanDerWaalsContact C-N 3.32Å; T129-T131 PolarHBondContact O-N 3.45Å; T131-M134 PolarHBondContact O-N 3.41Å; T131-H135 WeakPolarHBondContact CG2-CE1 3.37Å; T131-H135 WeakPolarHBondContact CG2-ND1 3.4Å; T131-H135 PolarHBondContact O-N 3.39Å; T131-H135 PolarHBondContact O-ND1 3.42Å; T131-M222 HydrophobicContact CG2-CB 4.22Å; T131-I226 HydrophobicContact CG2-CD1 3.5Å; T131-I226 VanDerWaalsContact CG2-CD1 3.5Å; T131-I226 WeakPolarHBondContact OG1-CD1 3.09Å
132	T	93.7	Very high	93.9	Very high	66 Å²	66	42.2 Å²	42.2	41%	0.405	21%	0.207	S	C	.	.	H	α-helix	trans	-61.2	-46.9	177.1	-59.3	0	0	0	0	111.6	K128 T129 I130 M134 H135 Q136	K128-T132 WeakPolarHBondContact O-CB 3.48Å; K128-T132 PolarHBondContact O-N 3.44Å; K128-T132 PolarHBondContact O-OG1 3.1Å; T129-T132 PolarHBondContact O-N 2.86Å; I130-T132 VanDerWaalsContact C-N 3.31Å; I130-T132 PolarHBondContact O-N 3.25Å; T132-M134 VanDerWaalsContact C-N 3.32Å; T132-M134 PolarHBondContact O-N 3.05Å; T132-H135 PolarHBondContact O-N 3.5Å; T132-Q136 WeakPolarHBondContact O-CG 3.48Å; T132-Q136 PolarHBondContact O-N 3.08Å; T132-Q136 VanDerWaalsContact O-N 3.08Å
133	I	96	Very high	94.2	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-62.4	-41.9	178.6	-74.4	159.2	0	0	0	111	I47 R51 I54 T129 I130 H135 Q136 Y137	I47-I133 HydrophobicContact CG2-CD1 3.31Å; R51-I133 HydrophobicContact CB-CD1 4.09Å; R51-I133 HydrophobicContact CB-CG1 4.38Å; R51-I133 HydrophobicContact CB-CG2 4.45Å; R51-I133 VanDerWaalsContact NH2-CD1 3.31Å; I54-I133 HydrophobicContact CD1-CG2 3.15Å; T129-I133 HydrophobicContact CG2-CD1 4.06Å; T129-I133 PolarHBondContact O-N 2.99Å; I130-I133 PolarHBondContact O-N 3.36Å; I133-H135 PolarHBondContact O-N 3.38Å; I133-Q136 WeakPolarHBondContact O-CB 3.29Å; I133-Q136 PolarHBondContact O-N 3.41Å; I133-Q136 VanDerWaalsContact O-N 3.14Å; I133-Y137 PolarHBondContact O-N 3.15Å
134	M	95.6	Very high	94.2	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-71	-33.5	-178.5	-64.4	-63.4	-51.3	0	0	111.6	T50 I85 A89 I130 T131 T132 Q136 Y137 G138 L215 L218 F219 M222	T50-M134 HydrophobicContact CG2-SD 4.25Å; I85-M134 HydrophobicContact CG2-CE 4.25Å; I85-M134 HydrophobicContact CG2-SD 4.32Å; A89-M134 HydrophobicContact CB-CE 4.04Å; A89-M134 HydrophobicContact CB-SD 4.06Å; I130-M134 HydrophobicContact CD1-CG 3.76Å; I130-M134 HydrophobicContact CD1-SD 4.23Å; I130-M134 HydrophobicContact CG1-CG 4.11Å; I130-M134 WeakPolarHBondContact O-CB 3.31Å; I130-M134 WeakPolarHBondContact O-CG 3.4Å; I130-M134 PolarHBondContact O-N 3.49Å; T131-M134 PolarHBondContact O-N 3.41Å; T132-M134 VanDerWaalsContact C-N 3.32Å; T132-M134 PolarHBondContact O-N 3.05Å; M134-Q136 VanDerWaalsContact C-N 3.31Å; M134-Q136 PolarHBondContact O-N 3.1Å; M134-Y137 HydrophobicContact CE-CD1 3.9Å; M134-Y137 WeakPolarHBondContact O-CB 3.39Å; M134-Y137 PolarHBondContact O-N 3.19Å; M134-G138 PolarHBondContact O-N 3.05Å; M134-L215 HydrophobicContact CB-CD1 4.49Å; M134-L215 HydrophobicContact CE-CD1 3.35Å; M134-L218 HydrophobicContact CE-CD1 3.77Å; M134-F219 VanDerWaalsContact C-CE1 3.47Å; M134-F219 HydrophobicContact CB-CE1 4.05Å; M134-F219 VanDerWaalsContact O-CE1 3.3Å; M134-F219 WeakPolarHBondContact O-CE1 3.46Å; M134-F219 WeakPolarHBondContact O-CZ 3.32Å; M134-M222 HydrophobicContact CB-CE 3.99Å; M134-M222 HydrophobicContact CB-SD 3.57Å; M134-M222 VanDerWaalsContact CB-SD 3.57Å; M134-M222 HydrophobicContact CE-CE 4.39Å; M134-M222 HydrophobicContact CG-CE 3.48Å; M134-M222 VanDerWaalsContact CG-CE 3.48Å; M134-M222 HydrophobicContact CG-SD 3.66Å; M134-M222 HydrophobicContact SD-CE 4.44Å
135	H	94.4	Very high	94.4	Very high	99 Å²	99	45.3 Å²	45.3	46%	0.458	22%	0.221	S	C	.	.	H	α-helix	trans	-62	-39.9	169.2	-81.7	77.8	0	0	0	111.7	T131 T132 I133 G138 R139	T131-H135 WeakPolarHBondContact CG2-CE1 3.37Å; T131-H135 WeakPolarHBondContact CG2-ND1 3.4Å; T131-H135 PolarHBondContact O-N 3.39Å; T131-H135 PolarHBondContact O-ND1 3.42Å; T132-H135 PolarHBondContact O-N 3.5Å; I133-H135 PolarHBondContact O-N 3.38Å; H135-G138 PolarHBondContact O-N 3.3Å; H135-R139 WeakPolarHBondContact O-CG 3.46Å; H135-R139 PolarHBondContact O-N 3.23Å; H135-R139 VanDerWaalsContact O-N 3.08Å
136	Q	95.7	Very high	94.6	Very high	96 Å²	96	46.7 Å²	46.7	45%	0.449	22%	0.222	S	C	.	.	H	α-helix	trans	-63	-43.5	174.3	-68.2	173.6	1.7	0	0	111.4	T132 I133 M134 G138 R139 I140	T132-Q136 WeakPolarHBondContact O-CG 3.48Å; T132-Q136 PolarHBondContact O-N 3.08Å; T132-Q136 VanDerWaalsContact O-N 3.08Å; I133-Q136 WeakPolarHBondContact O-CB 3.29Å; I133-Q136 PolarHBondContact O-N 3.41Å; I133-Q136 VanDerWaalsContact O-N 3.14Å; M134-Q136 VanDerWaalsContact C-N 3.31Å; M134-Q136 PolarHBondContact O-N 3.1Å; Q136-G138 VanDerWaalsContact C-N 3.34Å; Q136-G138 PolarHBondContact O-N 3.42Å; Q136-R139 PolarHBondContact O-N 2.85Å; Q136-I140 WeakPolarHBondContact O-CG1 3.48Å; Q136-I140 PolarHBondContact O-N 2.93Å
137	Y	96.8	Very high	94.4	Very high	1 Å²	1	52.3 Å²	52.3	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-57.6	-46	174.6	178.8	-122.9	0	0	0	112	I54 V57 N82 I85 I133 M134 R139 I140 Q141 S211 L215	I54-Y137 HydrophobicContact CB-CD2 4.47Å; I54-Y137 HydrophobicContact CD1-CD2 4.48Å; I54-Y137 HydrophobicContact CD1-CG 4.28Å; I54-Y137 HydrophobicContact CG1-CD2 3.74Å; I54-Y137 HydrophobicContact CG1-CG 4.03Å; I54-Y137 HydrophobicContact CG2-CD2 4.23Å; V57-Y137 HydrophobicContact CG1-CE2 4.26Å; V57-Y137 HydrophobicContact CG2-CE2 4.47Å; N82-Y137 PolarHBondContact OD1-OH 3.46Å; I85-Y137 HydrophobicContact CD1-CD2 4.26Å; I85-Y137 HydrophobicContact CD1-CE2 3.77Å; I85-Y137 HydrophobicContact CG2-CD1 4.15Å; I85-Y137 HydrophobicContact CG2-CE1 3.95Å; I85-Y137 HydrophobicContact CG2-CE2 4.4Å; I85-Y137 HydrophobicContact CG2-CG 4.48Å; I133-Y137 PolarHBondContact O-N 3.15Å; M134-Y137 HydrophobicContact CE-CD1 3.9Å; M134-Y137 WeakPolarHBondContact O-CB 3.39Å; M134-Y137 PolarHBondContact O-N 3.19Å; Y137-R139 VanDerWaalsContact C-N 3.33Å; Y137-R139 PolarHBondContact O-N 3.05Å; Y137-I140 WeakPolarHBondContact O-CB 3.3Å; Y137-I140 PolarHBondContact O-N 3.45Å; Y137-I140 VanDerWaalsContact O-N 3.12Å; Y137-Q141 HydrophobicContact CD2-CG 4.23Å; Y137-Q141 HydrophobicContact CE1-CG 4.28Å; Y137-Q141 HydrophobicContact CE2-CG 3.95Å; Y137-Q141 VanDerWaalsContact CZ-NE2 3.31Å; Y137-Q141 WeakPolarHBondContact O-CG 3.41Å; Y137-Q141 PolarHBondContact O-N 3.39Å; Y137-Q141 PolarHBondContact OH-NE2 3Å; Y137-S211 PolarHBondContact OH-OG 3.41Å; Y137-S211 VanDerWaalsContact OH-OG 3.11Å; Y137-L215 HydrophobicContact CD1-CD1 3.84Å; Y137-L215 HydrophobicContact CD1-CD2 3.81Å; Y137-L215 HydrophobicContact CD1-CG 4.37Å; Y137-L215 HydrophobicContact CE1-CD1 4.35Å; Y137-L215 HydrophobicContact CE1-CD2 4.3Å
138	G	95.6	Very high	94.3	Very high	8 Å²	8	52.3 Å²	52.3	8%	0.082	24%	0.243	C	C	.	.	H	α-helix	trans	-61.6	-39.9	177.6	0	0	0	0	0	113.9	M134 H135 Q136 I140 Q141 V142	M134-G138 PolarHBondContact O-N 3.05Å; H135-G138 PolarHBondContact O-N 3.3Å; Q136-G138 VanDerWaalsContact C-N 3.34Å; Q136-G138 PolarHBondContact O-N 3.42Å; G138-I140 VanDerWaalsContact C-N 3.33Å; G138-I140 PolarHBondContact O-N 3.46Å; G138-Q141 PolarHBondContact O-N 3.37Å; G138-V142 WeakPolarHBondContact O-CG2 3.45Å; G138-V142 PolarHBondContact O-N 2.95Å
139	R	96.6	Very high	94.3	Very high	196 Å²	196	46.9 Å²	46.9	74%	0.74	22%	0.22	S	C	*	.	H	α-helix	trans	-61.8	-42	173.8	-71	177.2	62.1	179	-0.1	112	H135 Q136 Y137 E143	H135-R139 WeakPolarHBondContact O-CG 3.46Å; H135-R139 PolarHBondContact O-N 3.23Å; H135-R139 VanDerWaalsContact O-N 3.08Å; Q136-R139 PolarHBondContact O-N 2.85Å; Y137-R139 VanDerWaalsContact C-N 3.33Å; Y137-R139 PolarHBondContact O-N 3.05Å; R139-E143 VanDerWaalsContact O-CB 3.23Å; R139-E143 WeakPolarHBondContact O-CB 3.2Å; R139-E143 PolarHBondContact O-N 3.35Å
140	I	95.9	Very high	94.1	Very high	24 Å²	24	47.9 Å²	47.9	12%	0.123	23%	0.232	C	C	.	.	H	α-helix	trans	-62.9	-43.6	177.7	-70.7	162.4	0	0	0	110.9	I54 V57 K58 Q136 Y137 G138 H144	I54-I140 HydrophobicContact CG2-CD1 3.56Å; V57-I140 HydrophobicContact CG1-CG2 4.37Å; K58-I140 HydrophobicContact CB-CD1 4.32Å; K58-I140 HydrophobicContact CB-CG2 4.16Å; K58-I140 HydrophobicContact CD-CD1 4.33Å; K58-I140 HydrophobicContact CD-CG1 4.44Å; K58-I140 HydrophobicContact CG-CG2 4.46Å; Q136-I140 WeakPolarHBondContact O-CG1 3.48Å; Q136-I140 PolarHBondContact O-N 2.93Å; Y137-I140 WeakPolarHBondContact O-CB 3.3Å; Y137-I140 PolarHBondContact O-N 3.45Å; Y137-I140 VanDerWaalsContact O-N 3.12Å; G138-I140 VanDerWaalsContact C-N 3.33Å; G138-I140 PolarHBondContact O-N 3.46Å; I140-H144 WeakPolarHBondContact O-CB 3.39Å; I140-H144 PolarHBondContact O-N 3.45Å
141	Q	95.8	Very high	93.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-48.2	178.8	-68.9	-67.4	-22.3	0	0	112	N82 Y137 G138 H144 K145 I212	N82-Q141 PolarHBondContact OD1-NE2 3.26Å; Y137-Q141 HydrophobicContact CD2-CG 4.23Å; Y137-Q141 HydrophobicContact CE1-CG 4.28Å; Y137-Q141 HydrophobicContact CE2-CG 3.95Å; Y137-Q141 VanDerWaalsContact CZ-NE2 3.31Å; Y137-Q141 WeakPolarHBondContact O-CG 3.41Å; Y137-Q141 PolarHBondContact O-N 3.39Å; Y137-Q141 PolarHBondContact OH-NE2 3Å; G138-Q141 PolarHBondContact O-N 3.37Å; Q141-H144 PolarHBondContact O-N 3.29Å; Q141-K145 PolarHBondContact O-N 2.94Å; Q141-I212 HydrophobicContact CB-CD1 4.17Å; Q141-I212 HydrophobicContact CB-CG1 3.68Å
142	V	95.2	Very high	93.5	Very high	70 Å²	70	49.8 Å²	49.8	42%	0.424	24%	0.242	S	C	.	.	H	α-helix	trans	-63.2	-45	177.9	173	0	0	0	0	111	G138 H144 K145 E146 I212	G138-V142 WeakPolarHBondContact O-CG2 3.45Å; G138-V142 PolarHBondContact O-N 2.95Å; V142-H144 VanDerWaalsContact C-N 3.26Å; V142-H144 PolarHBondContact O-N 2.93Å; V142-K145 PolarHBondContact O-N 3.37Å; V142-E146 WeakPolarHBondContact O-CG 3.49Å; V142-E146 PolarHBondContact O-N 3.44Å; V142-I212 HydrophobicContact CG2-CD1 4.27Å
143	E	95.4	Very high	93.3	Very high	87 Å²	87	49 Å²	49	41%	0.407	23%	0.233	S	C	.	.	H	α-helix	trans	-58.1	-40.4	176.7	-177.1	-179.2	-178.9	0	0	111.6	R139 R147	R139-E143 VanDerWaalsContact O-CB 3.23Å; R139-E143 WeakPolarHBondContact O-CB 3.2Å; R139-E143 PolarHBondContact O-N 3.35Å; E143-R147 VanDerWaalsContact O-CG 3.31Å; E143-R147 WeakPolarHBondContact O-CG 3.38Å; E143-R147 PolarHBondContact O-N 3.23Å; E143-R147 VanDerWaalsContact O-N 3.16Å; E143-R147 IonicContact OE1-CZ 2.67Å; E143-R147 IonicContact OE1-NE 3.09Å; E143-R147 IonicContact OE1-NH2 2.84Å; E143-R147 PolarHBondContact OE1-NH2 3.19Å
144	H	92.5	Very high	92.9	Very high	7 Å²	7	57.2 Å²	57.2	3%	0.032	26%	0.264	C	S	.	.	H	α-helix	trans	-71	-40.2	176.9	-171.7	55.6	0	0	0	112.7	H61 I140 Q141 V142 E146 R147 C148 L208	H61-H144 HydrophobicContact CB-CB 4.36Å; H61-H144 AromaticContact CD2-CD2 3.79Å; H61-H144 AromaticContact CD2-CG 3.67Å; H61-H144 AromaticContact CE1-CD2 3.19Å; H61-H144 PolarHBondContact CE1-CD2 2.66Å; H61-H144 AromaticContact CE1-CG 3.86Å; H61-H144 AromaticContact CE1-NE2 3.76Å; H61-H144 AromaticContact CG-CD2 3.39Å; H61-H144 AromaticContact CG-CE1 3.88Å; H61-H144 AromaticContact CG-CG 3.42Å; H61-H144 VanDerWaalsContact CG-CG 3.42Å; H61-H144 AromaticContact CG-ND1 3.75Å; H61-H144 AromaticContact CG-NE2 3.67Å; H61-H144 AromaticContact ND1-CD2 2.98Å; H61-H144 PolarHBondContact ND1-CD2 3.33Å; H61-H144 AromaticContact ND1-CE1 3.77Å; H61-H144 AromaticContact ND1-CG 3.56Å; H61-H144 AromaticContact ND1-NE2 3.13Å; H61-H144 PolarHBondContact ND1-NE2 3.08Å; H61-H144 VanDerWaalsContact ND1-NE2 3.13Å; H61-H144 AromaticContact NE2-CD2 3.69Å; H61-H144 AromaticContact NE2-CG 3.95Å; I140-H144 WeakPolarHBondContact O-CB 3.39Å; I140-H144 PolarHBondContact O-N 3.45Å; Q141-H144 PolarHBondContact O-N 3.29Å; V142-H144 VanDerWaalsContact C-N 3.26Å; V142-H144 PolarHBondContact O-N 2.93Å; H144-E146 VanDerWaalsContact C-N 3.32Å; H144-E146 PolarHBondContact O-N 2.93Å; H144-R147 PolarHBondContact O-N 2.92Å; H144-C148 PolarHBondContact O-N 3.38Å; H144-L208 WeakPolarHBondContact CD2-CD1 3.34Å
145	K	92.8	Very high	92.4	Very high	29 Å²	29	59 Å²	59	13%	0.126	27%	0.272	C	S	.	.	H	α-helix	trans	-54.7	-48.9	173.1	177.5	179.1	165.6	175.3	0	110.6	Q141 V142 R147 C148 K149 E169 I205 L208 E209 I212	Q141-K145 PolarHBondContact O-N 2.94Å; V142-K145 PolarHBondContact O-N 3.37Å; K145-R147 VanDerWaalsContact C-N 3.34Å; K145-R147 PolarHBondContact O-N 3.49Å; K145-C148 PolarHBondContact O-N 3.49Å; K145-K149 WeakPolarHBondContact O-CB 3.43Å; K145-K149 PolarHBondContact O-N 3.28Å; K145-E169 IonicContact NZ-OE1 2.64Å; K145-E169 PolarHBondContact NZ-OE1 3.27Å; K145-I205 HydrophobicContact CG-CG2 4.45Å; K145-L208 HydrophobicContact CB-CD1 4.36Å; K145-E209 HydrophobicContact CD-CG 4.19Å; K145-E209 IonicContact NZ-OE1 3.83Å; K145-E209 PolarHBondContact NZ-OE1 2.89Å; K145-I212 HydrophobicContact CB-CD1 4.25Å; K145-I212 HydrophobicContact CD-CD1 4.22Å
146	E	93.1	Very high	92	Very high	98 Å²	98	54.3 Å²	54.3	46%	0.458	25%	0.25	S	S	.	.	H	α-helix	trans	-62.2	-39.8	179.5	-69.3	-52.5	134.2	0	0	112.6	V142 H144 K149 A150	V142-E146 WeakPolarHBondContact O-CG 3.49Å; V142-E146 PolarHBondContact O-N 3.44Å; H144-E146 VanDerWaalsContact C-N 3.32Å; H144-E146 PolarHBondContact O-N 2.93Å; E146-K149 PolarHBondContact O-N 3.27Å; E146-A150 PolarHBondContact O-N 3.02Å
147	R	91.8	Very high	91.6	Very high	124 Å²	124	54.6 Å²	54.6	47%	0.468	25%	0.252	S	S	.	.	H	α-helix	trans	-65.6	-41.2	175	-70.1	176.2	-175	-157.7	2.2	112.1	L65 E143 H144 K145 A150 L151	L65-R147 HydrophobicContact CD1-CB 3.98Å; L65-R147 HydrophobicContact CD1-CG 4.4Å; L65-R147 HydrophobicContact CD2-CB 4.08Å; E143-R147 VanDerWaalsContact O-CG 3.31Å; E143-R147 WeakPolarHBondContact O-CG 3.38Å; E143-R147 PolarHBondContact O-N 3.23Å; E143-R147 VanDerWaalsContact O-N 3.16Å; E143-R147 IonicContact OE1-CZ 2.67Å; E143-R147 IonicContact OE1-NE 3.09Å; E143-R147 IonicContact OE1-NH2 2.84Å; E143-R147 PolarHBondContact OE1-NH2 3.19Å; H144-R147 PolarHBondContact O-N 2.92Å; K145-R147 VanDerWaalsContact C-N 3.34Å; K145-R147 PolarHBondContact O-N 3.49Å; R147-A150 PolarHBondContact O-N 2.88Å; R147-L151 WeakPolarHBondContact O-CG 3.36Å; R147-L151 PolarHBondContact O-N 3.45Å
148	C	89.9	Confident	90.9	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.3	-40.8	174.8	-75.9	0	0	0	0	111.7	H144 K145 L151 L152 I205	H144-C148 PolarHBondContact O-N 3.38Å; K145-C148 PolarHBondContact O-N 3.49Å; C148-L151 PolarHBondContact O-N 3.48Å; C148-L152 WeakPolarHBondContact O-CB 3.49Å; C148-L152 PolarHBondContact O-N 3.14Å; C148-I205 HydrophobicContact CB-CD1 4.17Å; C148-I205 HydrophobicContact CB-CG1 3.67Å
149	K	91.1	Very high	90.2	Very high	26 Å²	26	59.2 Å²	59.2	11%	0.113	28%	0.28	C	S	.	.	H	α-helix	trans	-60.6	-44.7	175.2	-173	178.4	175.6	-179.4	0	111.7	K145 E146 L151 L152 K153 L168 E169 L172	K145-K149 WeakPolarHBondContact O-CB 3.43Å; K145-K149 PolarHBondContact O-N 3.28Å; E146-K149 PolarHBondContact O-N 3.27Å; K149-L151 PolarHBondContact O-N 3.36Å; K149-L152 PolarHBondContact O-N 3.06Å; K149-K153 PolarHBondContact O-N 3.09Å; K149-L168 HydrophobicContact CD-CD2 4.31Å; K149-L168 HydrophobicContact CG-CD2 3.54Å; K149-L168 HydrophobicContact CG-CG 4.17Å; K149-E169 WeakPolarHBondContact CE-OE2 3.22Å; K149-E169 IonicContact NZ-OE2 2.64Å; K149-E169 PolarHBondContact NZ-OE2 3.18Å; K149-L172 HydrophobicContact CD-CD1 4.39Å; K149-L172 HydrophobicContact CG-CD1 4.33Å
150	A	90.1	Very high	89.4	Confident	62 Å²	62	59 Å²	59	51%	0.512	29%	0.287	S	S	.	.	H	α-helix	trans	-62.5	-39.9	176.4	0	0	0	0	0	112.8	E146 R147 R154	E146-A150 PolarHBondContact O-N 3.02Å; R147-A150 PolarHBondContact O-N 2.88Å; A150-R154 PolarHBondContact O-N 3.08Å; A150-R154 VanDerWaalsContact O-N 3.13Å
151	L	86.9	Confident	88.6	Confident	52 Å²	52	60.6 Å²	60.6	27%	0.272	29%	0.292	S	S	.	.	H	α-helix	trans	-66.3	-43.7	174.7	-71.7	179.5	0	0	0	112.2	L65 R147 C148 K149 K153 R154 Q155	L65-L151 HydrophobicContact CD2-CD1 3.49Å; L65-L151 VanDerWaalsContact CD2-CD1 3.49Å; R147-L151 WeakPolarHBondContact O-CG 3.36Å; R147-L151 PolarHBondContact O-N 3.45Å; C148-L151 PolarHBondContact O-N 3.48Å; K149-L151 PolarHBondContact O-N 3.36Å; L151-K153 VanDerWaalsContact C-N 3.34Å; L151-K153 PolarHBondContact O-N 3.42Å; L151-R154 PolarHBondContact O-N 2.9Å; L151-Q155 WeakPolarHBondContact O-CG 3.46Å; L151-Q155 PolarHBondContact O-N 3.4Å
152	L	88.6	Confident	87.9	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.9	-44.2	177.2	177	58.1	0	0	0	111.1	C148 K149 R154 Q155 L156 L168 L172 F180 I198 R201 I205	C148-L152 WeakPolarHBondContact O-CB 3.49Å; C148-L152 PolarHBondContact O-N 3.14Å; K149-L152 PolarHBondContact O-N 3.06Å; L152-R154 PolarHBondContact O-N 2.66Å; L152-Q155 PolarHBondContact O-N 3.41Å; L152-Q155 VanDerWaalsContact O-N 3.15Å; L152-L156 HydrophobicContact CD1-CD1 4.26Å; L152-L156 HydrophobicContact CD1-CG 4.35Å; L152-L156 HydrophobicContact CG-CD1 4.12Å; L152-L156 WeakPolarHBondContact O-CG 3.45Å; L152-L156 PolarHBondContact O-N 3.17Å; L152-L168 HydrophobicContact CD2-CD1 3.94Å; L152-L168 HydrophobicContact CG-CD1 4.2Å; L152-L172 HydrophobicContact CD2-CD2 3.99Å; L152-F180 HydrophobicContact CD1-CD1 4.44Å; L152-F180 HydrophobicContact CD2-CD1 4.43Å; L152-F180 HydrophobicContact CD2-CE1 3.88Å; L152-F180 HydrophobicContact CD2-CZ 4.31Å; L152-I198 HydrophobicContact CD1-CB 4.2Å; L152-I198 HydrophobicContact CD1-CG1 4.14Å; L152-I198 HydrophobicContact CD1-CG2 3.93Å; L152-R201 HydrophobicContact CB-CB 4.26Å; L152-R201 HydrophobicContact CD1-CB 4.25Å; L152-I205 HydrophobicContact CB-CD1 4.41Å; L152-I205 HydrophobicContact CD2-CD1 3.75Å
153	K	89.5	Confident	87.4	Confident	50 Å²	50	62.6 Å²	62.6	22%	0.217	31%	0.309	C	S	.	.	H	α-helix	trans	-56.7	-48.5	174.7	-169.7	176.6	179.8	177.6	0	111.7	K149 L151 Q155 L156 E157 V163 D165 L168	K149-K153 PolarHBondContact O-N 3.09Å; L151-K153 VanDerWaalsContact C-N 3.34Å; L151-K153 PolarHBondContact O-N 3.42Å; K153-Q155 VanDerWaalsContact C-N 3.3Å; K153-Q155 PolarHBondContact O-N 3.06Å; K153-L156 PolarHBondContact O-N 3.02Å; K153-E157 WeakPolarHBondContact O-CG 3.35Å; K153-E157 PolarHBondContact O-N 3.36Å; K153-V163 WeakPolarHBondContact CE-O 3.28Å; K153-D165 IonicContact NZ-OD1 2.82Å; K153-D165 PolarHBondContact NZ-OD1 3.49Å; K153-D165 IonicContact NZ-OD2 3.8Å; K153-L168 HydrophobicContact CB-CD2 3.81Å; K153-L168 HydrophobicContact CG-CD2 4.32Å
154	R	87.5	Confident	87.1	Confident	172 Å²	172	62 Å²	62	65%	0.649	31%	0.311	S	S	*	.	H	α-helix	trans	-60.6	-38.2	176.8	-178.7	179	170.2	171.9	-1.7	112.4	A150 L151 L152 E157 V158	A150-R154 PolarHBondContact O-N 3.08Å; A150-R154 VanDerWaalsContact O-N 3.13Å; L151-R154 PolarHBondContact O-N 2.9Å; L152-R154 PolarHBondContact O-N 2.66Å; R154-E157 PolarHBondContact O-N 3.41Å; R154-V158 WeakPolarHBondContact O-CG2 3.41Å; R154-V158 PolarHBondContact O-N 3.48Å; R154-V158 VanDerWaalsContact O-N 3.1Å
155	Q	84.5	Confident	86.9	Confident	39 Å²	39	65.9 Å²	65.9	18%	0.182	33%	0.332	C	S	.	.	H	α-helix	trans	-68.3	-38.2	177.4	-73.4	172.1	-19.4	0	0	112.2	L151 L152 K153 V158 A159 I198	L151-Q155 WeakPolarHBondContact O-CG 3.46Å; L151-Q155 PolarHBondContact O-N 3.4Å; L152-Q155 PolarHBondContact O-N 3.41Å; L152-Q155 VanDerWaalsContact O-N 3.15Å; K153-Q155 VanDerWaalsContact C-N 3.3Å; K153-Q155 PolarHBondContact O-N 3.06Å; Q155-V158 PolarHBondContact O-N 3.47Å; Q155-A159 PolarHBondContact O-N 2.88Å; Q155-I198 HydrophobicContact CB-CG1 3.88Å
156	L	86	Confident	86.6	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-64.2	-42.5	174.1	-69.4	164.4	0	0	0	111.5	L152 K153 V158 A159 Q160 R161 V163 L168 F180 I198	L152-L156 HydrophobicContact CD1-CD1 4.26Å; L152-L156 HydrophobicContact CD1-CG 4.35Å; L152-L156 HydrophobicContact CG-CD1 4.12Å; L152-L156 WeakPolarHBondContact O-CG 3.45Å; L152-L156 PolarHBondContact O-N 3.17Å; K153-L156 PolarHBondContact O-N 3.02Å; L156-V158 PolarHBondContact O-N 3.47Å; L156-A159 CarbonylContact O-C 3.57Å; L156-A159 WeakPolarHBondContact O-CA 3.42Å; L156-A159 PolarHBondContact O-N 2.84Å; L156-A159 VanDerWaalsContact O-N 3.11Å; L156-Q160 PolarHBondContact O-N 3.46Å; L156-R161 CarbonylContact C-O 3.42Å; L156-R161 WeakPolarHBondContact CB-O 3.38Å; L156-R161 CarbonylContact O-C 3.56Å; L156-R161 WeakPolarHBondContact O-CA 3.41Å; L156-R161 PolarHBondContact O-N 3.32Å; L156-R161 VanDerWaalsContact O-O 3.07Å; L156-V163 HydrophobicContact CB-CG2 4.08Å; L156-V163 HydrophobicContact CD1-CG2 3.61Å; L156-V163 HydrophobicContact CG-CG2 4.45Å; L156-L168 HydrophobicContact CD1-CD1 3.97Å; L156-F180 HydrophobicContact CD1-CD1 3.89Å; L156-F180 HydrophobicContact CD1-CE1 4.25Å; L156-F180 HydrophobicContact CD2-CB 4.32Å; L156-F180 HydrophobicContact CD2-CD1 4.09Å; L156-I198 HydrophobicContact CD2-CD1 3.82Å; L156-I198 HydrophobicContact CD2-CG1 4.37Å; L156-I198 HydrophobicContact CD2-CG2 4.47Å; L156-I198 HydrophobicContact CG-CD1 4.38Å
157	E	87.3	Confident	86.3	Confident	101 Å²	101	70.4 Å²	70.4	47%	0.472	36%	0.358	S	S	.	.	H	α-helix	trans	-59.9	-42.9	174.9	-72	171.6	-173.9	0	0	112.1	K153 R154 A159 Q160	K153-E157 WeakPolarHBondContact O-CG 3.35Å; K153-E157 PolarHBondContact O-N 3.36Å; R154-E157 PolarHBondContact O-N 3.41Å; E157-A159 VanDerWaalsContact C-N 3.29Å; E157-A159 PolarHBondContact O-N 3.43Å; E157-Q160 WeakPolarHBondContact O-CA 3.24Å; E157-Q160 PolarHBondContact O-N 3.41Å
158	V	82.9	Confident	86.1	Confident	89 Å²	89	64.5 Å²	64.5	54%	0.539	34%	0.336	S	S	.	.	H	α-helix	trans	-64.1	-34.6	175	171.5	0	0	0	0	111.7	R154 Q155 L156 Q160	R154-V158 WeakPolarHBondContact O-CG2 3.41Å; R154-V158 PolarHBondContact O-N 3.48Å; R154-V158 VanDerWaalsContact O-N 3.1Å; Q155-V158 PolarHBondContact O-N 3.47Å; L156-V158 PolarHBondContact O-N 3.47Å; V158-Q160 PolarHBondContact O-N 2.92Å; V158-Q160 VanDerWaalsContact O-N 3.16Å
159	A	80.4	Confident	86	Confident	18 Å²	18	66.7 Å²	66.7	15%	0.149	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	14.3	173.3	0	0	0	0	0	113.5	Q155 L156 E157 R161 I184 I198	Q155-A159 PolarHBondContact O-N 2.88Å; L156-A159 CarbonylContact O-C 3.57Å; L156-A159 WeakPolarHBondContact O-CA 3.42Å; L156-A159 PolarHBondContact O-N 2.84Å; L156-A159 VanDerWaalsContact O-N 3.11Å; E157-A159 VanDerWaalsContact C-N 3.29Å; E157-A159 PolarHBondContact O-N 3.43Å; A159-R161 PolarHBondContact O-N 3.28Å; A159-I184 HydrophobicContact CB-CD1 3.82Å; A159-I184 HydrophobicContact CB-CG1 4.42Å; A159-I198 HydrophobicContact CB-CD1 4.32Å
160	Q	79.4	Confident	85.8	Confident	190 Å²	190	70.2 Å²	70.2	89%	0.888	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	23.8	-178.9	-59.3	-178.6	-8.5	0	0	114.1	L156 E157 V158	L156-Q160 PolarHBondContact O-N 3.46Å; E157-Q160 WeakPolarHBondContact O-CA 3.24Å; E157-Q160 PolarHBondContact O-N 3.41Å; V158-Q160 PolarHBondContact O-N 2.92Å; V158-Q160 VanDerWaalsContact O-N 3.16Å
161	R	80	Confident	85.6	Confident	58 Å²	58	67.7 Å²	67.7	22%	0.219	34%	0.344	C	S	.	.			trans	-113.8	91.1	174.2	-173.3	171.8	179.3	-179	-0.1	109.8	L156 A159 V163 M171 I179 F180 Q182	L156-R161 CarbonylContact C-O 3.42Å; L156-R161 WeakPolarHBondContact CB-O 3.38Å; L156-R161 CarbonylContact O-C 3.56Å; L156-R161 WeakPolarHBondContact O-CA 3.41Å; L156-R161 PolarHBondContact O-N 3.32Å; L156-R161 VanDerWaalsContact O-O 3.07Å; A159-R161 PolarHBondContact O-N 3.28Å; R161-V163 HydrophobicContact CG-CG1 4.34Å; R161-V163 PolarHBondContact O-N 2.89Å; R161-M171 VanDerWaalsContact NH2-CE 3.34Å; R161-I179 PolarHBondContact NH1-O 3.04Å; R161-I179 PolarHBondContact NH2-O 3.38Å; R161-F180 PolarHBondContact NH1-O 3.42Å; R161-Q182 PolarHBondContact NH1-O 3.05Å
162	S	81.7	Confident	85.7	Confident	104 Å²	104	65.3 Å²	65.3	73%	0.727	33%	0.331	S	S	*	.			trans	-70.6	126.5	170.7	-172.5	0	0	0	0	109.4
163	V	84.7	Confident	85.5	Confident	9 Å²	9	71.9 Å²	71.9	6%	0.055	36%	0.362	C	S	.	.			trans	-129.6	137.4	174.4	-82.2	0	0	0	0	109.3	K153 L156 R161 E167 M171	K153-V163 WeakPolarHBondContact CE-O 3.28Å; L156-V163 HydrophobicContact CB-CG2 4.08Å; L156-V163 HydrophobicContact CD1-CG2 3.61Å; L156-V163 HydrophobicContact CG-CG2 4.45Å; R161-V163 HydrophobicContact CG-CG1 4.34Å; R161-V163 PolarHBondContact O-N 2.89Å; V163-E167 HydrophobicContact CB-CB 4.35Å; V163-E167 HydrophobicContact CG1-CB 4.41Å; V163-M171 HydrophobicContact CG1-SD 3.81Å
164	T	88.5	Confident	85.2	Confident	74 Å²	74	72.4 Å²	72.4	45%	0.454	37%	0.372	S	S	.	.			trans	-72.2	163.9	171.5	62.8	0	0	0	0	110.9	N166 E167 L168	T164-N166 PolarHBondContact O-N 3.28Å; T164-E167 WeakPolarHBondContact CB-OE2 3.29Å; T164-E167 PolarHBondContact N-OE2 2.73Å; T164-E167 PolarHBondContact O-N 3.12Å; T164-E167 WeakPolarHBondContact OG1-CB 3.39Å; T164-E167 VanDerWaalsContact OG1-CD 3.23Å; T164-E167 VanDerWaalsContact OG1-CG 3.24Å; T164-E167 WeakPolarHBondContact OG1-CG 3.17Å; T164-E167 PolarHBondContact OG1-N 3.45Å; T164-E167 PolarHBondContact OG1-OE2 2.79Å; T164-L168 WeakPolarHBondContact O-CB 3.37Å; T164-L168 PolarHBondContact O-N 3.34Å
165	D	87.5	Confident	84.8	Confident	89 Å²	89	66 Å²	66	48%	0.476	36%	0.359	S	S	.	.	H	α-helix	trans	-63.4	-31.9	-180	-66.1	-34.6	0	0	0	112.8	K153 E169	K153-D165 IonicContact NZ-OD1 2.82Å; K153-D165 PolarHBondContact NZ-OD1 3.49Å; K153-D165 IonicContact NZ-OD2 3.8Å; D165-E169 PolarHBondContact O-N 3.22Å
166	N	87.9	Confident	84.6	Confident	128 Å²	128	67.9 Å²	67.9	68%	0.684	37%	0.371	S	S	*	.	H	α-helix	trans	-72	-43.3	176.2	-69.1	-13.1	0	0	0	111.5	T164 L168 E169 N170	T164-N166 PolarHBondContact O-N 3.28Å; N166-L168 VanDerWaalsContact C-N 3.32Å; N166-E169 PolarHBondContact O-N 2.83Å; N166-N170 PolarHBondContact O-N 3.07Å; N166-N170 PolarHBondContact O-ND2 3.36Å
167	E	86.6	Confident	84.1	Confident	93 Å²	93	70 Å²	70	44%	0.435	38%	0.384	S	S	.	.	H	α-helix	trans	-63.5	-41.2	174.8	-72.4	164.2	153.6	0	0	111.1	V163 T164 E169 N170 M171	V163-E167 HydrophobicContact CB-CB 4.35Å; V163-E167 HydrophobicContact CG1-CB 4.41Å; T164-E167 WeakPolarHBondContact CB-OE2 3.29Å; T164-E167 PolarHBondContact N-OE2 2.73Å; T164-E167 PolarHBondContact O-N 3.12Å; T164-E167 WeakPolarHBondContact OG1-CB 3.39Å; T164-E167 VanDerWaalsContact OG1-CD 3.23Å; T164-E167 VanDerWaalsContact OG1-CG 3.24Å; T164-E167 WeakPolarHBondContact OG1-CG 3.17Å; T164-E167 PolarHBondContact OG1-N 3.45Å; T164-E167 PolarHBondContact OG1-OE2 2.79Å; E167-E169 VanDerWaalsContact C-N 3.35Å; E167-E169 PolarHBondContact O-N 3.49Å; E167-N170 PolarHBondContact O-N 2.92Å; E167-M171 WeakPolarHBondContact O-CB 3.43Å; E167-M171 WeakPolarHBondContact O-CG 3.34Å; E167-M171 PolarHBondContact O-N 3.48Å
168	L	87.9	Confident	83.7	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.005	39%	0.387	C	S	.	.	H	α-helix	trans	-61.6	-42.2	176.2	-179.5	56.8	0	0	0	111.8	K149 L152 K153 L156 T164 N166 M171 L172 F180	K149-L168 HydrophobicContact CD-CD2 4.31Å; K149-L168 HydrophobicContact CG-CD2 3.54Å; K149-L168 HydrophobicContact CG-CG 4.17Å; L152-L168 HydrophobicContact CD2-CD1 3.94Å; L152-L168 HydrophobicContact CG-CD1 4.2Å; K153-L168 HydrophobicContact CB-CD2 3.81Å; K153-L168 HydrophobicContact CG-CD2 4.32Å; L156-L168 HydrophobicContact CD1-CD1 3.97Å; T164-L168 WeakPolarHBondContact O-CB 3.37Å; T164-L168 PolarHBondContact O-N 3.34Å; N166-L168 VanDerWaalsContact C-N 3.32Å; L168-M171 PolarHBondContact O-N 3.21Å; L168-L172 HydrophobicContact CD1-CG 4.47Å; L168-L172 HydrophobicContact CG-CD1 4.37Å; L168-L172 VanDerWaalsContact O-CG 3.3Å; L168-L172 WeakPolarHBondContact O-CG 3.44Å; L168-L172 PolarHBondContact O-N 3.43Å; L168-F180 HydrophobicContact CD1-CE1 3.83Å
169	E	87.4	Confident	83.4	Confident	46 Å²	46	68.6 Å²	68.6	22%	0.215	37%	0.373	C	S	.	.	H	α-helix	trans	-64.1	-46.5	175.3	-159.2	68.3	-159.9	0	0	111.1	K145 K149 D165 N166 E167 M171 L172 E173	K145-E169 IonicContact NZ-OE1 2.64Å; K145-E169 PolarHBondContact NZ-OE1 3.27Å; K149-E169 WeakPolarHBondContact CE-OE2 3.22Å; K149-E169 IonicContact NZ-OE2 2.64Å; K149-E169 PolarHBondContact NZ-OE2 3.18Å; D165-E169 PolarHBondContact O-N 3.22Å; N166-E169 PolarHBondContact O-N 2.83Å; E167-E169 VanDerWaalsContact C-N 3.35Å; E167-E169 PolarHBondContact O-N 3.49Å; E169-M171 PolarHBondContact O-N 3.02Å; E169-L172 WeakPolarHBondContact O-CB 3.45Å; E169-L172 PolarHBondContact O-N 3.26Å; E169-E173 WeakPolarHBondContact O-CG 3.29Å; E169-E173 PolarHBondContact O-N 2.85Å
170	N	87	Confident	83.2	Confident	99 Å²	99	67.8 Å²	67.8	53%	0.529	37%	0.366	S	S	.	.	H	α-helix	trans	-58.4	-37.2	176.3	-67	-20.2	0	0	0	112.3	N166 E167 S174	N166-N170 PolarHBondContact O-N 3.07Å; N166-N170 PolarHBondContact O-ND2 3.36Å; E167-N170 PolarHBondContact O-N 2.92Å; N170-S174 PolarHBondContact O-N 3.5Å; N170-S174 VanDerWaalsContact O-N 3.16Å
171	M	85.5	Confident	82.8	Confident	10 Å²	10	60 Å²	60	5%	0.049	33%	0.332	C	S	.	.	H	α-helix	trans	-67.3	-41.2	175.8	-71.2	171.6	73.8	0	0	111.7	R161 V163 E167 L168 E169 S174 I179 F180	R161-M171 VanDerWaalsContact NH2-CE 3.34Å; V163-M171 HydrophobicContact CG1-SD 3.81Å; E167-M171 WeakPolarHBondContact O-CB 3.43Å; E167-M171 WeakPolarHBondContact O-CG 3.34Å; E167-M171 PolarHBondContact O-N 3.48Å; L168-M171 PolarHBondContact O-N 3.21Å; E169-M171 PolarHBondContact O-N 3.02Å; M171-S174 WeakPolarHBondContact O-CB 3.38Å; M171-S174 PolarHBondContact O-N 2.86Å; M171-S174 PolarHBondContact O-OG 3.47Å; M171-I179 HydrophobicContact CB-CG2 3.86Å; M171-I179 HydrophobicContact CE-CG1 4.38Å; M171-I179 HydrophobicContact CE-CG2 3.89Å; M171-I179 WeakPolarHBondContact CE-O 3.42Å; M171-I179 HydrophobicContact CG-CD1 3.98Å; M171-I179 HydrophobicContact CG-CG1 4.24Å; M171-I179 HydrophobicContact CG-CG2 4.06Å; M171-F180 HydrophobicContact CB-CE1 3.7Å; M171-F180 HydrophobicContact CB-CE2 4.25Å; M171-F180 HydrophobicContact CB-CZ 3.53Å; M171-F180 HydrophobicContact CE-CB 4.22Å; M171-F180 HydrophobicContact CE-CD1 3.26Å; M171-F180 HydrophobicContact CE-CD2 4.45Å; M171-F180 HydrophobicContact CE-CE1 3.57Å; M171-F180 HydrophobicContact CE-CG 3.76Å; M171-F180 HydrophobicContact CE-CZ 4.28Å; M171-F180 HydrophobicContact SD-CD1 4.46Å; M171-F180 HydrophobicContact SD-CE1 4.28Å
172	L	87.8	Confident	82.4	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	35%	0.354	C	S	.	.	H	α-helix	trans	-65.7	-42.8	174.9	-70	170.5	0	0	0	111.6	K149 L152 L168 E169 S174 G175 F180 I205 M206	K149-L172 HydrophobicContact CD-CD1 4.39Å; K149-L172 HydrophobicContact CG-CD1 4.33Å; L152-L172 HydrophobicContact CD2-CD2 3.99Å; L168-L172 HydrophobicContact CD1-CG 4.47Å; L168-L172 HydrophobicContact CG-CD1 4.37Å; L168-L172 VanDerWaalsContact O-CG 3.3Å; L168-L172 WeakPolarHBondContact O-CG 3.44Å; L168-L172 PolarHBondContact O-N 3.43Å; E169-L172 WeakPolarHBondContact O-CB 3.45Å; E169-L172 PolarHBondContact O-N 3.26Å; L172-S174 PolarHBondContact O-N 2.91Å; L172-G175 PolarHBondContact O-N 2.89Å; L172-F180 HydrophobicContact CD2-CZ 3.95Å; L172-F180 HydrophobicContact CG-CZ 4.27Å; L172-I205 HydrophobicContact CD1-CD1 4.36Å; L172-I205 HydrophobicContact CD1-CG2 4.24Å; L172-I205 HydrophobicContact CD2-CB 4.27Å; L172-I205 HydrophobicContact CD2-CD1 3.86Å; L172-I205 HydrophobicContact CD2-CG2 3.87Å; L172-M206 HydrophobicContact CB-CE 4.4Å; L172-M206 HydrophobicContact CD2-CE 4.37Å
173	E	85.7	Confident	81.8	Confident	138 Å²	138	63 Å²	63	65%	0.645	36%	0.357	S	S	*	.	H	α-helix	trans	-61.1	-29.7	177.3	-74.2	-178.8	179.2	0	0	112.8	E169 G175	E169-E173 WeakPolarHBondContact O-CG 3.29Å; E169-E173 PolarHBondContact O-N 2.85Å; E173-G175 PolarHBondContact O-N 3.33Å
174	S	83.3	Confident	81.2	Confident	61 Å²	61	63.7 Å²	63.7	43%	0.427	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-23.4	175.6	82	0	0	0	0	113.3	N170 M171 L172 N176	N170-S174 PolarHBondContact O-N 3.5Å; N170-S174 VanDerWaalsContact O-N 3.16Å; M171-S174 WeakPolarHBondContact O-CB 3.38Å; M171-S174 PolarHBondContact O-N 2.86Å; M171-S174 PolarHBondContact O-OG 3.47Å; L172-S174 PolarHBondContact O-N 2.91Å; S174-N176 PolarHBondContact O-N 2.67Å; S174-N176 PolarHBondContact OG-N 3.29Å
175	G	78.5	Confident	80.2	Confident	38 Å²	38	66 Å²	66	39%	0.392	37%	0.369	S	S	.	.			trans	61.9	4.1	-175.9	0	0	0	0	0	115.2	L172 E173 P177 H202	L172-G175 PolarHBondContact O-N 2.89Å; E173-G175 PolarHBondContact O-N 3.33Å; G175-P177 WeakPolarHBondContact O-CD 3.33Å; G175-H202 PolarHBondContact O-CE1 2.94Å
176	N	80.2	Confident	79.5	Confident	79 Å²	79	65 Å²	65	42%	0.422	37%	0.366	S	S	.	.			trans	-99.2	108.1	-174.4	-176.1	2.2	0	0	0	110.9	S174 Q178 I179	S174-N176 PolarHBondContact O-N 2.67Å; S174-N176 PolarHBondContact OG-N 3.29Å; N176-Q178 PolarHBondContact O-N 3.09Å; N176-Q178 VanDerWaalsContact O-N 3.14Å; N176-Q178 WeakPolarHBondContact OD1-CB 3.42Å; N176-Q178 PolarHBondContact OD1-N 2.97Å; N176-Q178 VanDerWaalsContact OD1-N 3.14Å; N176-I179 WeakPolarHBondContact O-CG2 3.37Å; N176-I179 PolarHBondContact O-N 2.89Å
177	P	75.9	Confident	79	Confident	44 Å²	44	65.1 Å²	65.1	29%	0.286	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.2	-178.7	24.2	-32.2	0	0	0	113	G175 I179 F180	G175-P177 WeakPolarHBondContact O-CD 3.33Å; P177-I179 PolarHBondContact O-N 3.21Å; P177-I179 VanDerWaalsContact O-N 3.15Å; P177-F180 PolarHBondContact O-N 3.2Å
178	Q	78.4	Confident	78.7	Confident	112 Å²	112	64.5 Å²	64.5	52%	0.523	37%	0.369	S	S	.	.	H	α-helix	trans	-59.7	-26.8	177.2	-98.2	70.2	10.1	0	0	113.1	N176 F180 T181 Q182	N176-Q178 PolarHBondContact O-N 3.09Å; N176-Q178 VanDerWaalsContact O-N 3.14Å; N176-Q178 WeakPolarHBondContact OD1-CB 3.42Å; N176-Q178 PolarHBondContact OD1-N 2.97Å; N176-Q178 VanDerWaalsContact OD1-N 3.14Å; Q178-F180 PolarHBondContact O-N 3.44Å; Q178-T181 WeakPolarHBondContact CA-OG1 3.37Å; Q178-T181 PolarHBondContact O-N 2.78Å; Q178-T181 VanDerWaalsContact O-N 3.13Å; Q178-T181 PolarHBondContact O-OG1 2.95Å; Q178-Q182 PolarHBondContact O-N 2.74Å
179	I	77.9	Confident	78.4	Confident	49 Å²	49	72.7 Å²	72.7	25%	0.251	41%	0.408	S	S	.	.	H	α-helix	trans	-62.3	-27.8	179.2	-158.5	168.8	0	0	0	111.2	R161 M171 N176 P177	R161-I179 PolarHBondContact NH1-O 3.04Å; R161-I179 PolarHBondContact NH2-O 3.38Å; M171-I179 HydrophobicContact CB-CG2 3.86Å; M171-I179 HydrophobicContact CE-CG1 4.38Å; M171-I179 HydrophobicContact CE-CG2 3.89Å; M171-I179 WeakPolarHBondContact CE-O 3.42Å; M171-I179 HydrophobicContact CG-CD1 3.98Å; M171-I179 HydrophobicContact CG-CG1 4.24Å; M171-I179 HydrophobicContact CG-CG2 4.06Å; N176-I179 WeakPolarHBondContact O-CG2 3.37Å; N176-I179 PolarHBondContact O-N 2.89Å; P177-I179 PolarHBondContact O-N 3.21Å; P177-I179 VanDerWaalsContact O-N 3.15Å
180	F	74.4	Confident	78.1	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-81.9	-29.1	178.4	-60.8	-86.9	0	0	0	112.7	L152 L156 R161 L168 M171 L172 P177 Q178 I184 I198 H202	L152-F180 HydrophobicContact CD1-CD1 4.44Å; L152-F180 HydrophobicContact CD2-CD1 4.43Å; L152-F180 HydrophobicContact CD2-CE1 3.88Å; L152-F180 HydrophobicContact CD2-CZ 4.31Å; L156-F180 HydrophobicContact CD1-CD1 3.89Å; L156-F180 HydrophobicContact CD1-CE1 4.25Å; L156-F180 HydrophobicContact CD2-CB 4.32Å; L156-F180 HydrophobicContact CD2-CD1 4.09Å; R161-F180 PolarHBondContact NH1-O 3.42Å; L168-F180 HydrophobicContact CD1-CE1 3.83Å; M171-F180 HydrophobicContact CB-CE1 3.7Å; M171-F180 HydrophobicContact CB-CE2 4.25Å; M171-F180 HydrophobicContact CB-CZ 3.53Å; M171-F180 HydrophobicContact CE-CB 4.22Å; M171-F180 HydrophobicContact CE-CD1 3.26Å; M171-F180 HydrophobicContact CE-CD2 4.45Å; M171-F180 HydrophobicContact CE-CE1 3.57Å; M171-F180 HydrophobicContact CE-CG 3.76Å; M171-F180 HydrophobicContact CE-CZ 4.28Å; M171-F180 HydrophobicContact SD-CD1 4.46Å; M171-F180 HydrophobicContact SD-CE1 4.28Å; L172-F180 HydrophobicContact CD2-CZ 3.95Å; L172-F180 HydrophobicContact CG-CZ 4.27Å; P177-F180 PolarHBondContact O-N 3.2Å; Q178-F180 PolarHBondContact O-N 3.44Å; F180-I184 VanDerWaalsContact O-CD1 3.31Å; F180-I184 WeakPolarHBondContact O-CD1 3.3Å; F180-I198 HydrophobicContact CB-CG2 3.42Å; F180-I198 VanDerWaalsContact CB-CG2 3.42Å; F180-I198 HydrophobicContact CD1-CG2 4.45Å; F180-I198 HydrophobicContact CG-CG2 4.06Å; F180-H202 HydrophobicContact CE2-CB 4.46Å; F180-H202 AromaticContact CE2-CD2 3.25Å; F180-H202 WeakPolarHBondContact CE2-CD2 3.21Å; F180-H202 AromaticContact CE2-NE2 3.88Å; F180-H202 AromaticContact CZ-CD2 3.88Å
181	T	72.3	Confident	77.7	Confident	27 Å²	27	72 Å²	72	17%	0.166	40%	0.403	C	S	.	.	H	α-helix	trans	-92.2	-17	-175.1	67.7	0	0	0	0	113.2	Q178 G183 I184 L195 E199	Q178-T181 WeakPolarHBondContact CA-OG1 3.37Å; Q178-T181 PolarHBondContact O-N 2.78Å; Q178-T181 VanDerWaalsContact O-N 3.13Å; Q178-T181 PolarHBondContact O-OG1 2.95Å; T181-G183 PolarHBondContact O-N 3.47Å; T181-I184 PolarHBondContact O-N 3.43Å; T181-L195 HydrophobicContact CG2-CD2 3.48Å; T181-L195 VanDerWaalsContact CG2-CD2 3.48Å; T181-E199 HydrophobicContact CG2-CG 4.13Å
182	Q	72.1	Confident	77.5	Confident	146 Å²	146	78.8 Å²	78.8	68%	0.682	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	122	178.2	-165.7	173.4	19.9	0	0	112.1	R161 Q178	R161-Q182 PolarHBondContact NH1-O 3.05Å; Q178-Q182 PolarHBondContact O-N 2.74Å
183	G	69	Low	77.3	Confident	78 Å²	78	82.8 Å²	82.8	80%	0.804	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	-4.1	178.4	0	0	0	0	0	115.3	T181	T181-G183 PolarHBondContact O-N 3.47Å
184	I	70.9	Confident	77	Confident	24 Å²	24	77.3 Å²	77.3	12%	0.123	42%	0.422	C	S	.	.			trans	-83.6	120	175.8	-62	175.4	0	0	0	109.2	A159 F180 T181 T186 A191 L195 I198	A159-I184 HydrophobicContact CB-CD1 3.82Å; A159-I184 HydrophobicContact CB-CG1 4.42Å; F180-I184 VanDerWaalsContact O-CD1 3.31Å; F180-I184 WeakPolarHBondContact O-CD1 3.3Å; T181-I184 PolarHBondContact O-N 3.43Å; I184-T186 PolarHBondContact O-N 2.87Å; I184-A191 HydrophobicContact CG2-CB 4.46Å; I184-L195 HydrophobicContact CB-CD1 4.4Å; I184-L195 HydrophobicContact CB-CD2 3.92Å; I184-L195 HydrophobicContact CB-CG 4.43Å; I184-L195 HydrophobicContact CD1-CD2 3.53Å; I184-L195 HydrophobicContact CD1-CG 4.49Å; I184-L195 HydrophobicContact CG1-CD2 4.27Å; I184-L195 HydrophobicContact CG2-CD1 3.93Å; I184-L195 HydrophobicContact CG2-CD2 3.91Å; I184-L195 HydrophobicContact CG2-CG 3.91Å; I184-I198 HydrophobicContact CD1-CD1 4.2Å
185	I	68.9	Low	77	Confident	123 Å²	123	75 Å²	75	63%	0.631	41%	0.405	S	S	*	.			trans	-71.2	111.9	179	-61.3	172.9	0	0	0	109.6	D187 A191	I185-D187 VanDerWaalsContact C-N 3.26Å; I185-D187 HydrophobicContact CG2-CB 3.9Å; I185-D187 WeakPolarHBondContact CG2-OD2 3.25Å; I185-D187 PolarHBondContact O-N 3.28Å; I185-A191 WeakPolarHBondContact O-CB 3.45Å
186	T	71.9	Confident	77.2	Confident	68 Å²	68	75.4 Å²	75.4	42%	0.417	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	10	-175.7	49.5	0	0	0	0	115.2	I184 T188 R192 L195	I184-T186 PolarHBondContact O-N 2.87Å; T186-T188 VanDerWaalsContact C-N 3.29Å; T186-T188 PolarHBondContact O-N 3.47Å; T186-R192 PolarHBondContact O-NE 3.36Å; T186-L195 HydrophobicContact CG2-CD1 3.33Å
187	D	76.6	Confident	77.3	Confident	130 Å²	130	73.5 Å²	73.5	70%	0.695	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-24.2	-169.2	-64.9	-15.2	0	0	0	112.8	I185	I185-D187 VanDerWaalsContact C-N 3.26Å; I185-D187 HydrophobicContact CG2-CB 3.9Å; I185-D187 WeakPolarHBondContact CG2-OD2 3.25Å; I185-D187 PolarHBondContact O-N 3.28Å
188	T	80.7	Confident	77.8	Confident	80 Å²	80	71.4 Å²	71.4	49%	0.491	38%	0.38	S	S	.	.	S	Bend	trans	-97.1	145.7	176.9	68.9	0	0	0	0	111.1	T186 Q190 A191 R192	T186-T188 VanDerWaalsContact C-N 3.29Å; T186-T188 PolarHBondContact O-N 3.47Å; T188-Q190 PolarHBondContact O-N 3.03Å; T188-A191 PolarHBondContact O-N 3.06Å; T188-A191 VanDerWaalsContact O-N 3.13Å; T188-A191 VanDerWaalsContact OG1-CB 3.32Å; T188-A191 WeakPolarHBondContact OG1-CB 3.3Å; T188-A191 PolarHBondContact OG1-N 3.36Å; T188-A191 VanDerWaalsContact OG1-N 3.08Å; T188-R192 PolarHBondContact O-N 2.9Å
189	Q	82.5	Confident	78.1	Confident	173 Å²	173	70 Å²	70	81%	0.808	37%	0.374	S	S	*	.	H	α-helix	trans	-56.5	-35.6	172.1	-174.9	173.5	11	0	0	111.5	R192 Q193	Q189-R192 PolarHBondContact O-N 3.42Å; Q189-Q193 PolarHBondContact O-N 3.16Å
190	Q	80.5	Confident	78.4	Confident	120 Å²	120	68.5 Å²	68.5	56%	0.561	37%	0.368	S	S	*	.	H	α-helix	trans	-62.3	-44.1	176.3	-172.9	61.7	46.1	0	0	112.3	T188 R192 Q193 N194	T188-Q190 PolarHBondContact O-N 3.03Å; Q190-R192 VanDerWaalsContact C-N 3.32Å; Q190-R192 PolarHBondContact O-N 3.47Å; Q190-Q193 PolarHBondContact O-N 3.41Å; Q190-N194 PolarHBondContact NE2-OD1 2.87Å; Q190-N194 VanDerWaalsContact O-CG 3.27Å; Q190-N194 PolarHBondContact O-N 3.41Å; Q190-N194 PolarHBondContact O-OD1 3.46Å
191	A	79.7	Confident	79	Confident	10 Å²	10	69.4 Å²	69.4	8%	0.083	37%	0.372	C	S	.	.	H	α-helix	trans	-63	-40.7	178.2	0	0	0	0	0	111.7	I184 I185 T188 Q193 N194 L195	I184-A191 HydrophobicContact CG2-CB 4.46Å; I185-A191 WeakPolarHBondContact O-CB 3.45Å; T188-A191 PolarHBondContact O-N 3.06Å; T188-A191 VanDerWaalsContact O-N 3.13Å; T188-A191 VanDerWaalsContact OG1-CB 3.32Å; T188-A191 WeakPolarHBondContact OG1-CB 3.3Å; T188-A191 PolarHBondContact OG1-N 3.36Å; T188-A191 VanDerWaalsContact OG1-N 3.08Å; A191-Q193 VanDerWaalsContact C-N 3.34Å; A191-Q193 PolarHBondContact O-N 2.86Å; A191-N194 PolarHBondContact O-N 2.83Å; A191-L195 WeakPolarHBondContact O-CB 3.42Å; A191-L195 VanDerWaalsContact O-CG 3.24Å; A191-L195 WeakPolarHBondContact O-CG 3.41Å; A191-L195 PolarHBondContact O-N 2.94Å
192	R	81.4	Confident	79.7	Confident	154 Å²	154	68.6 Å²	68.6	58%	0.581	37%	0.366	S	S	*	.	H	α-helix	trans	-62.8	-39.7	175.6	-63.8	-179.1	-168.9	169.1	0.7	112.4	T186 T188 Q189 Q190 L195 A196	T186-R192 PolarHBondContact O-NE 3.36Å; T188-R192 PolarHBondContact O-N 2.9Å; Q189-R192 PolarHBondContact O-N 3.42Å; Q190-R192 VanDerWaalsContact C-N 3.32Å; Q190-R192 PolarHBondContact O-N 3.47Å; R192-L195 PolarHBondContact O-N 3.45Å; R192-A196 PolarHBondContact O-N 3.23Å
193	Q	82.2	Confident	80.4	Confident	85 Å²	85	65.7 Å²	65.7	40%	0.397	35%	0.352	S	S	.	.	H	α-helix	trans	-65.8	-46.5	175.9	-173.7	60.9	49	0	0	111.6	Q189 Q190 A191 L195 A196 D197	Q189-Q193 PolarHBondContact O-N 3.16Å; Q190-Q193 PolarHBondContact O-N 3.41Å; A191-Q193 VanDerWaalsContact C-N 3.34Å; A191-Q193 PolarHBondContact O-N 2.86Å; Q193-L195 VanDerWaalsContact C-N 3.25Å; Q193-L195 PolarHBondContact O-N 3.27Å; Q193-A196 PolarHBondContact O-N 2.87Å; Q193-D197 PolarHBondContact NE2-OD1 3.49Å; Q193-D197 VanDerWaalsContact O-CG 3.26Å; Q193-D197 PolarHBondContact O-N 3.45Å
194	N	80.8	Confident	81.2	Confident	22 Å²	22	62.5 Å²	62.5	12%	0.118	32%	0.317	C	S	.	.	H	α-helix	trans	-58.8	-40.5	177.5	-67.5	-8.2	0	0	0	111.4	Q190 A191 D197 I198	Q190-N194 PolarHBondContact NE2-OD1 2.87Å; Q190-N194 VanDerWaalsContact O-CG 3.27Å; Q190-N194 PolarHBondContact O-N 3.41Å; Q190-N194 PolarHBondContact O-OD1 3.46Å; A191-N194 PolarHBondContact O-N 2.83Å; N194-D197 PolarHBondContact O-N 3.16Å; N194-I198 WeakPolarHBondContact O-CB 3.49Å; N194-I198 WeakPolarHBondContact O-CD1 3.46Å; N194-I198 VanDerWaalsContact O-CG1 3.22Å; N194-I198 WeakPolarHBondContact O-CG1 3.49Å; N194-I198 PolarHBondContact O-N 3.29Å
195	L	82.4	Confident	82.2	Confident	14 Å²	14	61.4 Å²	61.4	7%	0.073	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-46.3	176.4	-75	170.9	0	0	0	112.6	T181 I184 T186 A191 R192 Q193 D197 I198 E199	T181-L195 HydrophobicContact CG2-CD2 3.48Å; T181-L195 VanDerWaalsContact CG2-CD2 3.48Å; I184-L195 HydrophobicContact CB-CD1 4.4Å; I184-L195 HydrophobicContact CB-CD2 3.92Å; I184-L195 HydrophobicContact CB-CG 4.43Å; I184-L195 HydrophobicContact CD1-CD2 3.53Å; I184-L195 HydrophobicContact CD1-CG 4.49Å; I184-L195 HydrophobicContact CG1-CD2 4.27Å; I184-L195 HydrophobicContact CG2-CD1 3.93Å; I184-L195 HydrophobicContact CG2-CD2 3.91Å; I184-L195 HydrophobicContact CG2-CG 3.91Å; T186-L195 HydrophobicContact CG2-CD1 3.33Å; A191-L195 WeakPolarHBondContact O-CB 3.42Å; A191-L195 VanDerWaalsContact O-CG 3.24Å; A191-L195 WeakPolarHBondContact O-CG 3.41Å; A191-L195 PolarHBondContact O-N 2.94Å; R192-L195 PolarHBondContact O-N 3.45Å; Q193-L195 VanDerWaalsContact C-N 3.25Å; Q193-L195 PolarHBondContact O-N 3.27Å; L195-D197 VanDerWaalsContact C-N 3.25Å; L195-D197 PolarHBondContact O-N 3.4Å; L195-I198 WeakPolarHBondContact O-CB 3.32Å; L195-I198 PolarHBondContact O-N 3.07Å; L195-E199 WeakPolarHBondContact O-CG 3.3Å; L195-E199 PolarHBondContact O-N 2.92Å
196	A	82.8	Confident	83.2	Confident	45 Å²	45	57.8 Å²	57.8	37%	0.372	29%	0.293	S	S	.	.	H	α-helix	trans	-60.2	-38.6	176.2	0	0	0	0	0	111.7	R192 Q193 A200	R192-A196 PolarHBondContact O-N 3.23Å; Q193-A196 PolarHBondContact O-N 2.87Å; A196-A200 VanDerWaalsContact O-CB 3.29Å; A196-A200 WeakPolarHBondContact O-CB 3.23Å; A196-A200 PolarHBondContact O-N 2.93Å
197	D	83.1	Confident	84	Confident	39 Å²	39	58.4 Å²	58.4	21%	0.209	29%	0.289	C	S	.	.	H	α-helix	trans	-67.9	-42.6	177.2	-65.3	-16.9	0	0	0	111.7	Q193 N194 L195 A200 R201	Q193-D197 PolarHBondContact NE2-OD1 3.49Å; Q193-D197 VanDerWaalsContact O-CG 3.26Å; Q193-D197 PolarHBondContact O-N 3.45Å; N194-D197 PolarHBondContact O-N 3.16Å; L195-D197 VanDerWaalsContact C-N 3.25Å; L195-D197 PolarHBondContact O-N 3.4Å; D197-A200 PolarHBondContact O-N 3.2Å; D197-R201 VanDerWaalsContact O-CG 3.31Å; D197-R201 WeakPolarHBondContact O-CG 3.48Å; D197-R201 PolarHBondContact O-N 2.71Å
198	I	85.1	Confident	84.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-50.4	174.7	-77	165.9	0	0	0	110.7	L152 Q155 L156 A159 F180 I184 N194 L195 A200 R201 H202	L152-I198 HydrophobicContact CD1-CB 4.2Å; L152-I198 HydrophobicContact CD1-CG1 4.14Å; L152-I198 HydrophobicContact CD1-CG2 3.93Å; Q155-I198 HydrophobicContact CB-CG1 3.88Å; L156-I198 HydrophobicContact CD2-CD1 3.82Å; L156-I198 HydrophobicContact CD2-CG1 4.37Å; L156-I198 HydrophobicContact CD2-CG2 4.47Å; L156-I198 HydrophobicContact CG-CD1 4.38Å; A159-I198 HydrophobicContact CB-CD1 4.32Å; F180-I198 HydrophobicContact CB-CG2 3.42Å; F180-I198 VanDerWaalsContact CB-CG2 3.42Å; F180-I198 HydrophobicContact CD1-CG2 4.45Å; F180-I198 HydrophobicContact CG-CG2 4.06Å; I184-I198 HydrophobicContact CD1-CD1 4.2Å; N194-I198 WeakPolarHBondContact O-CB 3.49Å; N194-I198 WeakPolarHBondContact O-CD1 3.46Å; N194-I198 VanDerWaalsContact O-CG1 3.22Å; N194-I198 WeakPolarHBondContact O-CG1 3.49Å; N194-I198 PolarHBondContact O-N 3.29Å; L195-I198 WeakPolarHBondContact O-CB 3.32Å; L195-I198 PolarHBondContact O-N 3.07Å; I198-A200 VanDerWaalsContact C-N 3.33Å; I198-A200 PolarHBondContact O-N 2.92Å; I198-R201 PolarHBondContact O-N 3.05Å; I198-H202 WeakPolarHBondContact O-CB 3.39Å; I198-H202 PolarHBondContact O-N 2.98Å
199	E	84.3	Confident	85.2	Confident	84 Å²	84	50.3 Å²	50.3	39%	0.393	24%	0.242	S	C	.	.	H	α-helix	trans	-60.3	-44.1	178.9	-73.9	177.5	175.3	0	0	111.2	T181 L195 R201 H202 E203	T181-E199 HydrophobicContact CG2-CG 4.13Å; L195-E199 WeakPolarHBondContact O-CG 3.3Å; L195-E199 PolarHBondContact O-N 2.92Å; E199-R201 VanDerWaalsContact C-N 3.34Å; E199-R201 PolarHBondContact O-N 3.34Å; E199-H202 PolarHBondContact O-N 2.98Å; E199-E203 PolarHBondContact O-N 3.33Å
200	A	84.8	Confident	85.6	Confident	16 Å²	16	47.9 Å²	47.9	13%	0.132	23%	0.229	C	C	.	.	H	α-helix	trans	-66	-35.4	178.8	0	0	0	0	0	112.6	Q70 A196 D197 I198 D204	Q70-A200 HydrophobicContact CG-CB 3.77Å; A196-A200 VanDerWaalsContact O-CB 3.29Å; A196-A200 WeakPolarHBondContact O-CB 3.23Å; A196-A200 PolarHBondContact O-N 2.93Å; D197-A200 PolarHBondContact O-N 3.2Å; I198-A200 VanDerWaalsContact C-N 3.33Å; I198-A200 PolarHBondContact O-N 2.92Å; A200-D204 PolarHBondContact O-N 2.91Å
201	R	86.3	Confident	86.1	Confident	20 Å²	20	42.6 Å²	42.6	8%	0.075	21%	0.205	C	C	.	.	H	α-helix	trans	-71.5	-39.3	174.5	-70.2	-60.9	173.4	-133.1	-0	112.3	I64 L152 D197 I198 E199 E203 D204 I205	I64-R201 PolarHBondContact O-NH2 3.43Å; L152-R201 HydrophobicContact CB-CB 4.26Å; L152-R201 HydrophobicContact CD1-CB 4.25Å; D197-R201 VanDerWaalsContact O-CG 3.31Å; D197-R201 WeakPolarHBondContact O-CG 3.48Å; D197-R201 PolarHBondContact O-N 2.71Å; I198-R201 PolarHBondContact O-N 3.05Å; E199-R201 VanDerWaalsContact C-N 3.34Å; E199-R201 PolarHBondContact O-N 3.34Å; R201-E203 VanDerWaalsContact C-N 3.33Å; R201-D204 IonicContact NH1-OD2 3.57Å; R201-D204 PolarHBondContact NH1-OD2 3.24Å; R201-D204 PolarHBondContact O-N 3.03Å; R201-I205 VanDerWaalsContact O-CG1 3.29Å; R201-I205 WeakPolarHBondContact O-CG1 3.42Å; R201-I205 PolarHBondContact O-N 3.47Å
202	H	87.6	Confident	86.8	Confident	10 Å²	10	44.1 Å²	44.1	5%	0.046	21%	0.211	C	C	.	.	H	α-helix	trans	-58.2	-47.5	171.9	172	-95.1	0	0	0	110.9	G175 F180 I198 E199 D204 I205 M206	G175-H202 PolarHBondContact O-CE1 2.94Å; F180-H202 HydrophobicContact CE2-CB 4.46Å; F180-H202 AromaticContact CE2-CD2 3.25Å; F180-H202 WeakPolarHBondContact CE2-CD2 3.21Å; F180-H202 AromaticContact CE2-NE2 3.88Å; F180-H202 AromaticContact CZ-CD2 3.88Å; I198-H202 WeakPolarHBondContact O-CB 3.39Å; I198-H202 PolarHBondContact O-N 2.98Å; E199-H202 PolarHBondContact O-N 2.98Å; H202-D204 VanDerWaalsContact C-N 3.35Å; H202-D204 PolarHBondContact O-N 2.9Å; H202-I205 PolarHBondContact O-N 3.31Å; H202-M206 WeakPolarHBondContact O-CG 3.1Å; H202-M206 PolarHBondContact O-N 3.24Å
203	E	87	Confident	87.3	Confident	84 Å²	84	44.5 Å²	44.5	39%	0.393	21%	0.213	S	C	.	.	H	α-helix	trans	-58.3	-44.9	176.1	-167.5	-158.1	162.5	0	0	112.1	K75 E199 R201 I205 M206 K207	K75-E203 IonicContact NZ-OE2 2.74Å; E199-E203 PolarHBondContact O-N 3.33Å; R201-E203 VanDerWaalsContact C-N 3.33Å; E203-I205 VanDerWaalsContact C-N 3.34Å; E203-I205 PolarHBondContact O-N 3.09Å; E203-M206 PolarHBondContact O-N 3.38Å; E203-K207 WeakPolarHBondContact O-CG 3.46Å; E203-K207 PolarHBondContact O-N 2.88Å; E203-K207 VanDerWaalsContact OE1-CE 3.25Å; E203-K207 WeakPolarHBondContact OE1-CE 3.38Å; E203-K207 IonicContact OE1-NZ 2.7Å; E203-K207 PolarHBondContact OE1-NZ 3.32Å
204	D	86.7	Confident	87.7	Confident	12 Å²	12	44.1 Å²	44.1	6%	0.064	21%	0.211	C	C	.	.	H	α-helix	trans	-58.4	-45.9	176.5	-67.3	-22.3	0	0	0	110.7	Q70 K75 A200 R201 H202 K207 L208	Q70-D204 PolarHBondContact NE2-OD2 2.87Å; K75-D204 WeakPolarHBondContact CE-OD1 3.22Å; K75-D204 IonicContact NZ-OD1 3.49Å; K75-D204 PolarHBondContact NZ-OD1 3.16Å; K75-D204 IonicContact NZ-OD2 3.81Å; A200-D204 PolarHBondContact O-N 2.91Å; R201-D204 IonicContact NH1-OD2 3.57Å; R201-D204 PolarHBondContact NH1-OD2 3.24Å; R201-D204 PolarHBondContact O-N 3.03Å; H202-D204 VanDerWaalsContact C-N 3.35Å; H202-D204 PolarHBondContact O-N 2.9Å; D204-K207 PolarHBondContact O-N 3.22Å; D204-L208 VanDerWaalsContact O-CG 3.28Å; D204-L208 WeakPolarHBondContact O-CG 3.41Å; D204-L208 PolarHBondContact O-N 2.79Å
205	I	90.8	Very high	88.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.3	-44.1	178.7	-66.4	165.2	0	0	0	111	K145 C148 L152 L172 R201 H202 E203 K207 L208 E209	K145-I205 HydrophobicContact CG-CG2 4.45Å; C148-I205 HydrophobicContact CB-CD1 4.17Å; C148-I205 HydrophobicContact CB-CG1 3.67Å; L152-I205 HydrophobicContact CB-CD1 4.41Å; L152-I205 HydrophobicContact CD2-CD1 3.75Å; L172-I205 HydrophobicContact CD1-CD1 4.36Å; L172-I205 HydrophobicContact CD1-CG2 4.24Å; L172-I205 HydrophobicContact CD2-CB 4.27Å; L172-I205 HydrophobicContact CD2-CD1 3.86Å; L172-I205 HydrophobicContact CD2-CG2 3.87Å; R201-I205 VanDerWaalsContact O-CG1 3.29Å; R201-I205 WeakPolarHBondContact O-CG1 3.42Å; R201-I205 PolarHBondContact O-N 3.47Å; H202-I205 PolarHBondContact O-N 3.31Å; E203-I205 VanDerWaalsContact C-N 3.34Å; E203-I205 PolarHBondContact O-N 3.09Å; I205-K207 VanDerWaalsContact C-N 3.32Å; I205-K207 PolarHBondContact O-N 3.36Å; I205-L208 WeakPolarHBondContact O-CB 3.42Å; I205-L208 PolarHBondContact O-N 3.04Å; I205-L208 VanDerWaalsContact O-N 3.16Å; I205-E209 HydrophobicContact CG2-CG 4.42Å; I205-E209 WeakPolarHBondContact O-CG 3.41Å; I205-E209 PolarHBondContact O-N 3.3Å
206	M	90.6	Very high	88.6	Confident	48 Å²	48	48.5 Å²	48.5	24%	0.236	23%	0.23	C	C	.	.	H	α-helix	trans	-61.6	-39.5	178.3	-68.9	-62.7	97	0	0	112.6	L172 H202 E203 E209 K210	L172-M206 HydrophobicContact CB-CE 4.4Å; L172-M206 HydrophobicContact CD2-CE 4.37Å; H202-M206 WeakPolarHBondContact O-CG 3.1Å; H202-M206 PolarHBondContact O-N 3.24Å; E203-M206 PolarHBondContact O-N 3.38Å; M206-E209 HydrophobicContact CE-CG 4.49Å; M206-E209 WeakPolarHBondContact CE-OE2 3.39Å; M206-E209 PolarHBondContact O-N 2.93Å; M206-K210 PolarHBondContact O-N 3.32Å; M206-K210 VanDerWaalsContact O-N 3.1Å
207	K	89.1	Confident	88.9	Confident	81 Å²	81	48.1 Å²	48.1	35%	0.352	23%	0.23	S	C	.	.	H	α-helix	trans	-65.3	-41.3	174.4	-74	176	172.3	177.3	0	111.8	E79 E203 D204 I205 K210 S211	E79-K207 WeakPolarHBondContact OE1-CD 3.43Å; E79-K207 WeakPolarHBondContact OE1-CE 3.33Å; E79-K207 IonicContact OE1-NZ 2.65Å; E79-K207 PolarHBondContact OE1-NZ 2.98Å; E203-K207 WeakPolarHBondContact O-CG 3.46Å; E203-K207 PolarHBondContact O-N 2.88Å; E203-K207 VanDerWaalsContact OE1-CE 3.25Å; E203-K207 WeakPolarHBondContact OE1-CE 3.38Å; E203-K207 IonicContact OE1-NZ 2.7Å; E203-K207 PolarHBondContact OE1-NZ 3.32Å; D204-K207 PolarHBondContact O-N 3.22Å; I205-K207 VanDerWaalsContact C-N 3.32Å; I205-K207 PolarHBondContact O-N 3.36Å; K207-K210 PolarHBondContact O-N 3.49Å; K207-S211 PolarHBondContact O-N 3.16Å
208	L	90.7	Very high	89.3	Confident	6 Å²	6	46.4 Å²	46.4	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-42.4	175.3	-67.5	167.7	0	0	0	112	H144 K145 D204 I205 K210 S211 I212	H144-L208 WeakPolarHBondContact CD2-CD1 3.34Å; K145-L208 HydrophobicContact CB-CD1 4.36Å; D204-L208 VanDerWaalsContact O-CG 3.28Å; D204-L208 WeakPolarHBondContact O-CG 3.41Å; D204-L208 PolarHBondContact O-N 2.79Å; I205-L208 WeakPolarHBondContact O-CB 3.42Å; I205-L208 PolarHBondContact O-N 3.04Å; I205-L208 VanDerWaalsContact O-N 3.16Å; L208-K210 VanDerWaalsContact C-N 3.33Å; L208-K210 PolarHBondContact O-N 3.03Å; L208-S211 WeakPolarHBondContact O-CB 3.48Å; L208-S211 PolarHBondContact O-N 3.21Å; L208-S211 VanDerWaalsContact O-N 3.15Å; L208-I212 WeakPolarHBondContact O-CB 3.31Å; L208-I212 VanDerWaalsContact O-CG1 3.25Å; L208-I212 WeakPolarHBondContact O-CG1 3.43Å; L208-I212 PolarHBondContact O-N 3.48Å
209	E	91.1	Very high	89.6	Confident	34 Å²	34	49 Å²	49	16%	0.159	23%	0.232	C	C	.	.	H	α-helix	trans	-61.8	-41	177	-74	-166.5	165.4	0	0	112.7	K145 I205 M206 S211 I212 R213	K145-E209 HydrophobicContact CD-CG 4.19Å; K145-E209 IonicContact NZ-OE1 3.83Å; K145-E209 PolarHBondContact NZ-OE1 2.89Å; I205-E209 HydrophobicContact CG2-CG 4.42Å; I205-E209 WeakPolarHBondContact O-CG 3.41Å; I205-E209 PolarHBondContact O-N 3.3Å; M206-E209 HydrophobicContact CE-CG 4.49Å; M206-E209 WeakPolarHBondContact CE-OE2 3.39Å; M206-E209 PolarHBondContact O-N 2.93Å; E209-S211 VanDerWaalsContact C-N 3.34Å; E209-I212 PolarHBondContact O-N 3.49Å; E209-R213 VanDerWaalsContact O-CB 3.3Å; E209-R213 WeakPolarHBondContact O-CB 3.49Å; E209-R213 PolarHBondContact O-N 3.42Å
210	K	90.6	Very high	89.8	Confident	122 Å²	122	49 Å²	49	53%	0.53	24%	0.239	S	C	.	.	H	α-helix	trans	-58.5	-48.7	172.4	-175.9	-172.9	172.8	-167.7	0	110.7	M206 K207 L208 I212 R213 E214	M206-K210 PolarHBondContact O-N 3.32Å; M206-K210 VanDerWaalsContact O-N 3.1Å; K207-K210 PolarHBondContact O-N 3.49Å; L208-K210 VanDerWaalsContact C-N 3.33Å; L208-K210 PolarHBondContact O-N 3.03Å; K210-I212 PolarHBondContact O-N 2.77Å; K210-R213 PolarHBondContact O-N 2.78Å; K210-E214 VanDerWaalsContact CE-OE1 3.27Å; K210-E214 WeakPolarHBondContact CE-OE1 3.26Å; K210-E214 WeakPolarHBondContact O-CG 3.4Å; K210-E214 PolarHBondContact O-N 2.75Å
211	S	91.6	Very high	89.9	Confident	8 Å²	8	51 Å²	51	6%	0.056	25%	0.247	C	C	.	.	H	α-helix	trans	-61.6	-41.8	179.2	-162.7	0	0	0	0	112.6	Y137 K207 L208 E209 E214 L215	Y137-S211 PolarHBondContact OH-OG 3.41Å; Y137-S211 VanDerWaalsContact OH-OG 3.11Å; K207-S211 PolarHBondContact O-N 3.16Å; L208-S211 WeakPolarHBondContact O-CB 3.48Å; L208-S211 PolarHBondContact O-N 3.21Å; L208-S211 VanDerWaalsContact O-N 3.15Å; E209-S211 VanDerWaalsContact C-N 3.34Å; S211-E214 PolarHBondContact O-N 3.48Å; S211-L215 WeakPolarHBondContact O-CB 3.42Å; S211-L215 PolarHBondContact O-N 3.15Å
212	I	92.8	Very high	89.9	Confident	43 Å²	43	50.2 Å²	50.2	22%	0.221	24%	0.244	C	C	.	.	H	α-helix	trans	-66.3	-38.6	177.3	-68.9	165.9	0	0	0	110.7	Q141 V142 K145 L208 E209 K210 L215 H216	Q141-I212 HydrophobicContact CB-CD1 4.17Å; Q141-I212 HydrophobicContact CB-CG1 3.68Å; V142-I212 HydrophobicContact CG2-CD1 4.27Å; K145-I212 HydrophobicContact CB-CD1 4.25Å; K145-I212 HydrophobicContact CD-CD1 4.22Å; L208-I212 WeakPolarHBondContact O-CB 3.31Å; L208-I212 VanDerWaalsContact O-CG1 3.25Å; L208-I212 WeakPolarHBondContact O-CG1 3.43Å; L208-I212 PolarHBondContact O-N 3.48Å; E209-I212 PolarHBondContact O-N 3.49Å; K210-I212 PolarHBondContact O-N 2.77Å; I212-L215 WeakPolarHBondContact O-CB 3.49Å; I212-L215 PolarHBondContact O-N 3.38Å; I212-H216 PolarHBondContact O-N 3.18Å
213	R	92	Very high	89.9	Confident	162 Å²	162	52.4 Å²	52.4	61%	0.611	26%	0.264	S	S	*	.	H	α-helix	trans	-65.9	-42.1	176.8	-166.4	-176.9	-58.5	112.4	2.5	111.8	E209 K210 L215 H216 G217	E209-R213 VanDerWaalsContact O-CB 3.3Å; E209-R213 WeakPolarHBondContact O-CB 3.49Å; E209-R213 PolarHBondContact O-N 3.42Å; K210-R213 PolarHBondContact O-N 2.78Å; R213-L215 VanDerWaalsContact C-N 3.31Å; R213-L215 PolarHBondContact O-N 2.82Å; R213-H216 WeakPolarHBondContact O-CB 3.09Å; R213-H216 PolarHBondContact O-N 3.38Å; R213-G217 PolarHBondContact O-N 3.08Å
214	E	91.1	Very high	89.8	Confident	76 Å²	76	51.2 Å²	51.2	36%	0.355	27%	0.269	S	S	.	.	H	α-helix	trans	-62.1	-41	173.3	-72.5	179.9	-164.3	0	0	111.5	K210 S211 H216 G217 L218	K210-E214 VanDerWaalsContact CE-OE1 3.27Å; K210-E214 WeakPolarHBondContact CE-OE1 3.26Å; K210-E214 WeakPolarHBondContact O-CG 3.4Å; K210-E214 PolarHBondContact O-N 2.75Å; S211-E214 PolarHBondContact O-N 3.48Å; E214-H216 VanDerWaalsContact C-N 3.32Å; E214-H216 PolarHBondContact O-N 3.35Å; E214-G217 PolarHBondContact O-N 2.82Å; E214-L218 PolarHBondContact O-N 3.28Å
215	L	91.9	Very high	89.6	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-63.1	-37.2	175.6	-178.6	60.6	0	0	0	112.8	M134 Y137 S211 I212 R213 G217 L218 F219	M134-L215 HydrophobicContact CB-CD1 4.49Å; M134-L215 HydrophobicContact CE-CD1 3.35Å; Y137-L215 HydrophobicContact CD1-CD1 3.84Å; Y137-L215 HydrophobicContact CD1-CD2 3.81Å; Y137-L215 HydrophobicContact CD1-CG 4.37Å; Y137-L215 HydrophobicContact CE1-CD1 4.35Å; Y137-L215 HydrophobicContact CE1-CD2 4.3Å; S211-L215 WeakPolarHBondContact O-CB 3.42Å; S211-L215 PolarHBondContact O-N 3.15Å; I212-L215 WeakPolarHBondContact O-CB 3.49Å; I212-L215 PolarHBondContact O-N 3.38Å; R213-L215 VanDerWaalsContact C-N 3.31Å; R213-L215 PolarHBondContact O-N 2.82Å; L215-G217 VanDerWaalsContact C-N 3.28Å; L215-G217 PolarHBondContact O-N 3.11Å; L215-L218 HydrophobicContact CD1-CB 4.35Å; L215-L218 HydrophobicContact CD1-CD1 4.39Å; L215-L218 CarbonylContact O-C 3.55Å; L215-L218 WeakPolarHBondContact O-CA 3.3Å; L215-L218 WeakPolarHBondContact O-CB 3.27Å; L215-L218 PolarHBondContact O-N 3.44Å; L215-F219 HydrophobicContact CD1-CD1 4.09Å; L215-F219 HydrophobicContact CD1-CE1 3.63Å; L215-F219 HydrophobicContact CD1-CE2 4.41Å; L215-F219 HydrophobicContact CD1-CZ 3.82Å; L215-F219 HydrophobicContact CD2-CE1 4.21Å; L215-F219 HydrophobicContact CD2-CE2 3.84Å; L215-F219 HydrophobicContact CD2-CZ 3.52Å; L215-F219 HydrophobicContact CG-CD1 4.34Å; L215-F219 HydrophobicContact CG-CD2 4.2Å; L215-F219 HydrophobicContact CG-CE1 3.87Å; L215-F219 HydrophobicContact CG-CE2 3.71Å; L215-F219 HydrophobicContact CG-CG 4.5Å; L215-F219 HydrophobicContact CG-CZ 3.54Å; L215-F219 WeakPolarHBondContact O-CG 3.11Å; L215-F219 PolarHBondContact O-N 3.15Å
216	H	90.2	Very high	89.1	Confident	126 Å²	126	54.3 Å²	54.3	58%	0.583	28%	0.284	S	S	*	.	H	α-helix	trans	-57.9	-42.9	176	-172.5	74.6	0	0	0	111.6	I212 R213 E214 L218 F219 T220	I212-H216 PolarHBondContact O-N 3.18Å; R213-H216 WeakPolarHBondContact O-CB 3.09Å; R213-H216 PolarHBondContact O-N 3.38Å; E214-H216 VanDerWaalsContact C-N 3.32Å; E214-H216 PolarHBondContact O-N 3.35Å; H216-L218 VanDerWaalsContact C-N 3.31Å; H216-L218 PolarHBondContact O-N 3.35Å; H216-F219 WeakPolarHBondContact O-CB 3.46Å; H216-F219 PolarHBondContact O-N 2.64Å; H216-F219 VanDerWaalsContact O-N 3.15Å; H216-T220 PolarHBondContact O-N 2.78Å; H216-T220 VanDerWaalsContact O-N 3.08Å; H216-T220 PolarHBondContact O-OG1 3.46Å
217	G	90.1	Very high	88.5	Confident	36 Å²	36	59.6 Å²	59.6	37%	0.371	31%	0.309	S	S	.	.	H	α-helix	trans	-59.7	-40.7	173.2	0	0	0	0	0	112.8	R213 E214 L215 F219 T220 D221	R213-G217 PolarHBondContact O-N 3.08Å; E214-G217 PolarHBondContact O-N 2.82Å; L215-G217 VanDerWaalsContact C-N 3.28Å; L215-G217 PolarHBondContact O-N 3.11Å; G217-F219 VanDerWaalsContact C-N 3.35Å; G217-F219 PolarHBondContact O-N 3.45Å; G217-T220 PolarHBondContact O-N 2.98Å; G217-D221 PolarHBondContact O-N 3.45Å; G217-D221 VanDerWaalsContact O-N 3.1Å
218	L	91.4	Very high	87.5	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-66.4	-33.9	175.1	-65.4	174.9	0	0	0	112.8	A89 K90 M134 E214 L215 H216 D221 M222	A89-L218 HydrophobicContact CB-CD1 3.79Å; A89-L218 HydrophobicContact CB-CD2 4.22Å; K90-L218 HydrophobicContact CG-CD2 3.93Å; M134-L218 HydrophobicContact CE-CD1 3.77Å; E214-L218 PolarHBondContact O-N 3.28Å; L215-L218 HydrophobicContact CD1-CB 4.35Å; L215-L218 HydrophobicContact CD1-CD1 4.39Å; L215-L218 CarbonylContact O-C 3.55Å; L215-L218 WeakPolarHBondContact O-CA 3.3Å; L215-L218 WeakPolarHBondContact O-CB 3.27Å; L215-L218 PolarHBondContact O-N 3.44Å; H216-L218 VanDerWaalsContact C-N 3.31Å; H216-L218 PolarHBondContact O-N 3.35Å; L218-D221 WeakPolarHBondContact O-CB 3.24Å; L218-D221 PolarHBondContact O-N 3.23Å; L218-M222 HydrophobicContact CB-CE 3.98Å; L218-M222 WeakPolarHBondContact O-CB 3.35Å; L218-M222 VanDerWaalsContact O-CG 3.24Å; L218-M222 WeakPolarHBondContact O-CG 3.37Å; L218-M222 PolarHBondContact O-N 2.83Å
219	F	90	Very high	86.4	Confident	53 Å²	53	58 Å²	58	23%	0.232	31%	0.305	C	S	.	.	H	α-helix	trans	-66.5	-41.7	174.8	-70.8	-24.3	0	0	0	112.4	M134 L215 H216 G217 D221 M222 A223	M134-F219 VanDerWaalsContact C-CE1 3.47Å; M134-F219 HydrophobicContact CB-CE1 4.05Å; M134-F219 VanDerWaalsContact O-CE1 3.3Å; M134-F219 WeakPolarHBondContact O-CE1 3.46Å; M134-F219 WeakPolarHBondContact O-CZ 3.32Å; L215-F219 HydrophobicContact CD1-CD1 4.09Å; L215-F219 HydrophobicContact CD1-CE1 3.63Å; L215-F219 HydrophobicContact CD1-CE2 4.41Å; L215-F219 HydrophobicContact CD1-CZ 3.82Å; L215-F219 HydrophobicContact CD2-CE1 4.21Å; L215-F219 HydrophobicContact CD2-CE2 3.84Å; L215-F219 HydrophobicContact CD2-CZ 3.52Å; L215-F219 HydrophobicContact CG-CD1 4.34Å; L215-F219 HydrophobicContact CG-CD2 4.2Å; L215-F219 HydrophobicContact CG-CE1 3.87Å; L215-F219 HydrophobicContact CG-CE2 3.71Å; L215-F219 HydrophobicContact CG-CG 4.5Å; L215-F219 HydrophobicContact CG-CZ 3.54Å; L215-F219 WeakPolarHBondContact O-CG 3.11Å; L215-F219 PolarHBondContact O-N 3.15Å; H216-F219 WeakPolarHBondContact O-CB 3.46Å; H216-F219 PolarHBondContact O-N 2.64Å; H216-F219 VanDerWaalsContact O-N 3.15Å; G217-F219 VanDerWaalsContact C-N 3.35Å; G217-F219 PolarHBondContact O-N 3.45Å; F219-D221 VanDerWaalsContact C-N 3.31Å; F219-D221 PolarHBondContact O-N 3.04Å; F219-M222 PolarHBondContact O-N 2.95Å; F219-A223 VanDerWaalsContact O-CB 3.28Å; F219-A223 WeakPolarHBondContact O-CB 3.48Å; F219-A223 PolarHBondContact O-N 3.28Å
220	T	89.1	Confident	85.2	Confident	86 Å²	86	58.5 Å²	58.5	53%	0.528	32%	0.319	S	S	.	.	H	α-helix	trans	-60.5	-44.8	173.5	-51.3	0	0	0	0	111	H216 G217 M222 A223 A224	H216-T220 PolarHBondContact O-N 2.78Å; H216-T220 VanDerWaalsContact O-N 3.08Å; H216-T220 PolarHBondContact O-OG1 3.46Å; G217-T220 PolarHBondContact O-N 2.98Å; T220-M222 PolarHBondContact O-N 3.41Å; T220-A223 PolarHBondContact O-N 3.46Å; T220-A224 PolarHBondContact O-N 3.47Å
221	D	86.9	Confident	84.2	Confident	58 Å²	58	58.9 Å²	58.9	31%	0.31	32%	0.323	S	S	.	.	H	α-helix	trans	-60.9	-41.8	176.7	-89.6	-20.7	0	0	0	112.8	R93 G217 L218 F219 A224 L225	R93-D221 VanDerWaalsContact CD-CB 3.45Å; R93-D221 WeakPolarHBondContact CD-OD2 3.42Å; R93-D221 HydrophobicContact CG-CB 4.36Å; R93-D221 IonicContact CZ-OD2 2.71Å; R93-D221 IonicContact NE-OD2 2.7Å; R93-D221 PolarHBondContact NE-OD2 2.88Å; R93-D221 IonicContact NH1-OD1 3.4Å; R93-D221 PolarHBondContact NH1-OD1 3.16Å; R93-D221 IonicContact NH1-OD2 3.78Å; R93-D221 PolarHBondContact NH1-OD2 2.86Å; G217-D221 PolarHBondContact O-N 3.45Å; G217-D221 VanDerWaalsContact O-N 3.1Å; L218-D221 WeakPolarHBondContact O-CB 3.24Å; L218-D221 PolarHBondContact O-N 3.23Å; F219-D221 VanDerWaalsContact C-N 3.31Å; F219-D221 PolarHBondContact O-N 3.04Å; D221-A224 PolarHBondContact O-N 2.93Å; D221-L225 PolarHBondContact O-N 2.69Å
222	M	87.7	Confident	83.1	Confident	3 Å²	3	59 Å²	59	2%	0.015	32%	0.323	C	S	.	.	H	α-helix	trans	-74.2	-35.6	178.8	-73.3	167.5	-157.5	0	0	112.6	A89 I130 T131 M134 L218 F219 T220 A224 L225 I226	A89-M222 HydrophobicContact CB-CE 4.24Å; I130-M222 HydrophobicContact CG1-CE 4.15Å; T131-M222 HydrophobicContact CG2-CB 4.22Å; M134-M222 HydrophobicContact CB-CE 3.99Å; M134-M222 HydrophobicContact CB-SD 3.57Å; M134-M222 VanDerWaalsContact CB-SD 3.57Å; M134-M222 HydrophobicContact CE-CE 4.39Å; M134-M222 HydrophobicContact CG-CE 3.48Å; M134-M222 VanDerWaalsContact CG-CE 3.48Å; M134-M222 HydrophobicContact CG-SD 3.66Å; M134-M222 HydrophobicContact SD-CE 4.44Å; L218-M222 HydrophobicContact CB-CE 3.98Å; L218-M222 WeakPolarHBondContact O-CB 3.35Å; L218-M222 VanDerWaalsContact O-CG 3.24Å; L218-M222 WeakPolarHBondContact O-CG 3.37Å; L218-M222 PolarHBondContact O-N 2.83Å; F219-M222 PolarHBondContact O-N 2.95Å; T220-M222 PolarHBondContact O-N 3.41Å; M222-A224 VanDerWaalsContact C-N 3.27Å; M222-A224 PolarHBondContact O-N 2.64Å; M222-L225 WeakPolarHBondContact O-CB 3.13Å; M222-L225 PolarHBondContact O-N 2.62Å; M222-L225 VanDerWaalsContact O-N 3.16Å; M222-I226 PolarHBondContact O-N 3.29Å
223	A	86.2	Confident	81.8	Confident	56 Å²	56	59.5 Å²	59.5	46%	0.463	33%	0.327	S	S	.	.	H	α-helix	trans	-60.9	-40.7	172.8	0	0	0	0	0	110.6	F219 T220 L225 I226 E227	F219-A223 VanDerWaalsContact O-CB 3.28Å; F219-A223 WeakPolarHBondContact O-CB 3.48Å; F219-A223 PolarHBondContact O-N 3.28Å; T220-A223 PolarHBondContact O-N 3.46Å; A223-L225 VanDerWaalsContact C-N 3.32Å; A223-L225 PolarHBondContact O-N 3.15Å; A223-I226 PolarHBondContact O-N 2.77Å; A223-E227 PolarHBondContact O-N 3.48Å
224	A	85.3	Confident	80.6	Confident	59 Å²	59	57.3 Å²	57.3	49%	0.488	33%	0.328	S	S	.	.	H	α-helix	trans	-61.8	-37.7	174.1	0	0	0	0	0	112.7	T220 D221 M222 I226	T220-A224 PolarHBondContact O-N 3.47Å; D221-A224 PolarHBondContact O-N 2.93Å; M222-A224 VanDerWaalsContact C-N 3.27Å; M222-A224 PolarHBondContact O-N 2.64Å; A224-I226 VanDerWaalsContact C-N 3.29Å; A224-I226 PolarHBondContact O-N 3.39Å
225	L	82.7	Confident	79.4	Confident	9 Å²	9	58.2 Å²	58.2	5%	0.047	33%	0.328	C	S	.	.	H	α-helix	trans	-70	-22.1	173.5	-70.4	173.7	0	0	0	113.5	R93 L96 F123 D221 M222 A223 T228 Q229	R93-L225 HydrophobicContact CG-CD1 4.01Å; L96-L225 HydrophobicContact CB-CD1 4.06Å; L96-L225 HydrophobicContact CB-CD2 4.36Å; L96-L225 HydrophobicContact CD1-CD1 4.04Å; F123-L225 HydrophobicContact CE2-CD2 4.41Å; F123-L225 HydrophobicContact CZ-CD2 4.38Å; D221-L225 PolarHBondContact O-N 2.69Å; M222-L225 WeakPolarHBondContact O-CB 3.13Å; M222-L225 PolarHBondContact O-N 2.62Å; M222-L225 VanDerWaalsContact O-N 3.16Å; A223-L225 VanDerWaalsContact C-N 3.32Å; A223-L225 PolarHBondContact O-N 3.15Å; L225-T228 PolarHBondContact O-OG1 2.9Å; L225-Q229 VanDerWaalsContact O-CG 3.23Å; L225-Q229 WeakPolarHBondContact O-CG 3.42Å; L225-Q229 PolarHBondContact O-NE2 2.91Å
226	I	79.2	Confident	78.2	Confident	67 Å²	67	58.5 Å²	58.5	34%	0.344	33%	0.33	S	S	.	.	H	α-helix	trans	-89.1	-38.4	177.8	-71.4	176.3	0	0	0	111.9	T131 M222 A223 A224 T228 Q229	T131-I226 HydrophobicContact CG2-CD1 3.5Å; T131-I226 VanDerWaalsContact CG2-CD1 3.5Å; T131-I226 WeakPolarHBondContact OG1-CD1 3.09Å; M222-I226 PolarHBondContact O-N 3.29Å; A223-I226 PolarHBondContact O-N 2.77Å; A224-I226 VanDerWaalsContact C-N 3.29Å; A224-I226 PolarHBondContact O-N 3.39Å; I226-T228 PolarHBondContact O-N 3.24Å; I226-Q229 WeakPolarHBondContact O-CA 3.23Å; I226-Q229 WeakPolarHBondContact O-CB 3.49Å; I226-Q229 WeakPolarHBondContact O-CG 3.43Å; I226-Q229 PolarHBondContact O-N 2.93Å
227	E	78.3	Confident	77.2	Confident	160 Å²	160	57 Å²	57	75%	0.748	33%	0.325	S	S	*	.	H	α-helix	trans	-57.3	-39.1	179.5	-172.6	59.9	-154.2	0	0	111.2	A223 Q229 G230	A223-E227 PolarHBondContact O-N 3.48Å; E227-Q229 PolarHBondContact O-N 3.37Å; E227-Q229 VanDerWaalsContact O-N 3.16Å; E227-G230 PolarHBondContact O-N 3.47Å
228	T	68.3	Low	76.1	Confident	37 Å²	37	58.9 Å²	58.9	23%	0.227	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-10.8	177.3	62.2	0	0	0	0	113.5	E100 R104 L225 I226 L232	E100-T228 WeakPolarHBondContact OE1-CB 3.2Å; E100-T228 VanDerWaalsContact OE1-CG2 3.26Å; E100-T228 WeakPolarHBondContact OE1-CG2 3.35Å; E100-T228 PolarHBondContact OE1-OG1 3.13Å; R104-T228 VanDerWaalsContact NH2-CG2 3.31Å; L225-T228 PolarHBondContact O-OG1 2.9Å; I226-T228 PolarHBondContact O-N 3.24Å; T228-L232 WeakPolarHBondContact O-CD1 3.44Å; T228-L232 WeakPolarHBondContact O-CG 3.47Å
229	Q	67.9	Low	74.9	Confident	17 Å²	17	60.1 Å²	60.1	8%	0.079	34%	0.337	C	S	.	.	H	α-helix	trans	-79.4	-29.8	-179.7	-60.1	-176.2	28.4	0	0	113.4	F123 L124 L225 I226 E227 E231 L232 V233	F123-Q229 HydrophobicContact CE1-CG 4.24Å; L124-Q229 HydrophobicContact CD2-CB 3.32Å; L124-Q229 HydrophobicContact CD2-CG 3.26Å; L225-Q229 VanDerWaalsContact O-CG 3.23Å; L225-Q229 WeakPolarHBondContact O-CG 3.42Å; L225-Q229 PolarHBondContact O-NE2 2.91Å; I226-Q229 WeakPolarHBondContact O-CA 3.23Å; I226-Q229 WeakPolarHBondContact O-CB 3.49Å; I226-Q229 WeakPolarHBondContact O-CG 3.43Å; I226-Q229 PolarHBondContact O-N 2.93Å; E227-Q229 PolarHBondContact O-N 3.37Å; E227-Q229 VanDerWaalsContact O-N 3.16Å; Q229-E231 VanDerWaalsContact C-N 3.26Å; Q229-E231 PolarHBondContact O-N 3.23Å; Q229-L232 CarbonylContact O-C 3.56Å; Q229-L232 WeakPolarHBondContact O-CA 3.24Å; Q229-L232 PolarHBondContact O-N 3.07Å; Q229-V233 HydrophobicContact CB-CG2 4.36Å; Q229-V233 WeakPolarHBondContact O-CB 3.35Å; Q229-V233 WeakPolarHBondContact O-CG2 3.33Å; Q229-V233 PolarHBondContact O-N 3.24Å
230	G	66.7	Low	74	Confident	44 Å²	44	60.8 Å²	60.8	45%	0.454	35%	0.345	S	S	.	.	H	α-helix	trans	-54.1	-47.3	-177	0	0	0	0	0	111.5	E227 L232 D234	E227-G230 PolarHBondContact O-N 3.47Å; G230-L232 VanDerWaalsContact C-N 3.35Å; G230-L232 PolarHBondContact O-N 3.27Å; G230-D234 PolarHBondContact O-N 3.38Å
231	E	67.9	Low	73.1	Confident	130 Å²	130	62.9 Å²	62.9	61%	0.607	35%	0.346	S	S	*	.	H	α-helix	trans	-69.3	-29.5	177.3	-166.9	179.2	-177.9	0	0	113.5	Q229 R235	Q229-E231 VanDerWaalsContact C-N 3.26Å; Q229-E231 PolarHBondContact O-N 3.23Å; E231-R235 VanDerWaalsContact CD-NH2 3.29Å; E231-R235 WeakPolarHBondContact O-CG 3.24Å; E231-R235 PolarHBondContact O-NE 2.7Å; E231-R235 IonicContact OE1-CZ 2.66Å; E231-R235 IonicContact OE1-NH2 3.57Å; E231-R235 PolarHBondContact OE1-NH2 3.4Å
232	L	68.5	Low	72.3	Confident	11 Å²	11	64.1 Å²	64.1	6%	0.058	35%	0.351	C	S	.	.	H	α-helix	trans	-77.5	-40.5	178.2	-70.2	170.1	0	0	0	112.2	I103 K120 F123 L124 T228 Q229 G230 R235 I236	I103-L232 HydrophobicContact CG2-CD2 4.2Å; K120-L232 HydrophobicContact CD-CD2 3.79Å; K120-L232 VanDerWaalsContact CE-CD2 3.4Å; K120-L232 HydrophobicContact CG-CD2 4.1Å; F123-L232 HydrophobicContact CD1-CD1 4.02Å; F123-L232 HydrophobicContact CE1-CD1 3.86Å; L124-L232 HydrophobicContact CD2-CB 4.23Å; T228-L232 WeakPolarHBondContact O-CD1 3.44Å; T228-L232 WeakPolarHBondContact O-CG 3.47Å; Q229-L232 CarbonylContact O-C 3.56Å; Q229-L232 WeakPolarHBondContact O-CA 3.24Å; Q229-L232 PolarHBondContact O-N 3.07Å; G230-L232 VanDerWaalsContact C-N 3.35Å; G230-L232 PolarHBondContact O-N 3.27Å; L232-R235 PolarHBondContact O-N 2.92Å; L232-I236 WeakPolarHBondContact O-CD1 3.3Å; L232-I236 VanDerWaalsContact O-CG1 3.23Å; L232-I236 WeakPolarHBondContact O-CG1 3.29Å; L232-I236 PolarHBondContact O-N 2.65Å; L232-I236 VanDerWaalsContact O-N 3.11Å
233	V	66.2	Low	71.4	Confident	52 Å²	52	65.6 Å²	65.6	32%	0.315	36%	0.36	S	S	.	.	H	α-helix	trans	-62	-49.5	-178	170.5	0	0	0	0	110.4	L124 Q229 R235 I236 D237	L124-V233 HydrophobicContact CD1-CB 4.37Å; L124-V233 HydrophobicContact CD1-CG2 3.5Å; L124-V233 VanDerWaalsContact CD1-CG2 3.5Å; L124-V233 HydrophobicContact CD2-CG2 3.99Å; L124-V233 HydrophobicContact CG-CG2 4.37Å; Q229-V233 HydrophobicContact CB-CG2 4.36Å; Q229-V233 WeakPolarHBondContact O-CB 3.35Å; Q229-V233 WeakPolarHBondContact O-CG2 3.33Å; Q229-V233 PolarHBondContact O-N 3.24Å; V233-R235 VanDerWaalsContact C-N 3.28Å; V233-R235 PolarHBondContact O-N 2.88Å; V233-I236 PolarHBondContact O-N 3.12Å; V233-D237 PolarHBondContact O-N 2.78Å
234	D	66.4	Low	70.9	Confident	117 Å²	117	69.4 Å²	69.4	63%	0.626	37%	0.368	S	S	*	.	H	α-helix	trans	-58.9	-41.4	-177.7	-76.9	-9.1	0	0	0	111.6	G230 V238	G230-D234 PolarHBondContact O-N 3.38Å; D234-V238 VanDerWaalsContact O-CG2 3.3Å; D234-V238 WeakPolarHBondContact O-CG2 3.33Å; D234-V238 PolarHBondContact O-N 3.43Å
235	R	65.9	Low	70.4	Confident	94 Å²	94	71.8 Å²	71.8	36%	0.355	37%	0.373	S	S	.	.	H	α-helix	trans	-68.1	-36.3	176.8	-62.7	-171.6	-138.5	-162.1	-0.8	112.3	E107 E231 L232 V233 N239	E107-R235 WeakPolarHBondContact OE1-CD 3.31Å; E107-R235 IonicContact OE1-CZ 3.41Å; E107-R235 VanDerWaalsContact OE1-CZ 3.3Å; E107-R235 IonicContact OE1-NE 3.57Å; E107-R235 IonicContact OE1-NH1 3.74Å; E107-R235 PolarHBondContact OE1-NH1 3.47Å; E107-R235 IonicContact OE2-NH1 3.3Å; E231-R235 VanDerWaalsContact CD-NH2 3.29Å; E231-R235 WeakPolarHBondContact O-CG 3.24Å; E231-R235 PolarHBondContact O-NE 2.7Å; E231-R235 IonicContact OE1-CZ 2.66Å; E231-R235 IonicContact OE1-NH2 3.57Å; E231-R235 PolarHBondContact OE1-NH2 3.4Å; L232-R235 PolarHBondContact O-N 2.92Å; V233-R235 VanDerWaalsContact C-N 3.28Å; V233-R235 PolarHBondContact O-N 2.88Å; R235-N239 VanDerWaalsContact O-CB 3.24Å; R235-N239 WeakPolarHBondContact O-CB 3.41Å; R235-N239 PolarHBondContact O-N 3.2Å; R235-N239 PolarHBondContact O-ND2 3.33Å; R235-N239 PolarHBondContact O-OD1 2.89Å
236	I	67.9	Low	70.2	Confident	10 Å²	10	78.6 Å²	78.6	5%	0.051	40%	0.399	C	S	.	.	H	α-helix	trans	-69.5	-45.8	178.5	-67.3	162.3	0	0	0	110.9	K120 L124 L232 V233 V238 N239 V240	K120-I236 HydrophobicContact CB-CD1 3.29Å; K120-I236 HydrophobicContact CB-CG1 3.74Å; K120-I236 HydrophobicContact CD-CD1 4.28Å; K120-I236 HydrophobicContact CD-CG1 3.97Å; K120-I236 HydrophobicContact CG-CD1 4.39Å; L124-I236 HydrophobicContact CD1-CD1 3.25Å; L124-I236 HydrophobicContact CG-CD1 4.16Å; L232-I236 WeakPolarHBondContact O-CD1 3.3Å; L232-I236 VanDerWaalsContact O-CG1 3.23Å; L232-I236 WeakPolarHBondContact O-CG1 3.29Å; L232-I236 PolarHBondContact O-N 2.65Å; L232-I236 VanDerWaalsContact O-N 3.11Å; V233-I236 PolarHBondContact O-N 3.12Å; I236-V238 VanDerWaalsContact C-N 3.27Å; I236-V238 PolarHBondContact O-N 2.84Å; I236-N239 CarbonylContact O-C 3.59Å; I236-N239 PolarHBondContact O-N 3.45Å; I236-N239 VanDerWaalsContact O-N 3.13Å; I236-V240 HydrophobicContact CG2-CG2 3.67Å; I236-V240 VanDerWaalsContact O-CB 3.29Å; I236-V240 WeakPolarHBondContact O-CB 3.3Å; I236-V240 VanDerWaalsContact O-CG2 3.24Å; I236-V240 WeakPolarHBondContact O-CG2 3.46Å; I236-V240 PolarHBondContact O-N 2.93Å
237	D	68.4	Low	70.2	Confident	93 Å²	93	79.9 Å²	79.9	50%	0.497	41%	0.409	S	S	.	.	H	α-helix	trans	-60.3	-41.6	-179.5	-98.4	10.1	0	0	0	111.2	V233 K241	V233-D237 PolarHBondContact O-N 2.78Å; D237-K241 WeakPolarHBondContact O-CB 3.28Å; D237-K241 VanDerWaalsContact O-CG 3.28Å; D237-K241 WeakPolarHBondContact O-CG 3.39Å; D237-K241 PolarHBondContact O-N 3.48Å; D237-K241 VanDerWaalsContact O-N 3.12Å
238	V	68.1	Low	70.3	Confident	77 Å²	77	75 Å²	75	47%	0.467	40%	0.397	S	S	.	.	H	α-helix	trans	-62.4	-50.2	172.8	173.3	0	0	0	0	110.6	D234 I236 V240 K241 Q242	D234-V238 VanDerWaalsContact O-CG2 3.3Å; D234-V238 WeakPolarHBondContact O-CG2 3.33Å; D234-V238 PolarHBondContact O-N 3.43Å; I236-V238 VanDerWaalsContact C-N 3.27Å; I236-V238 PolarHBondContact O-N 2.84Å; V238-V240 PolarHBondContact O-N 3.24Å; V238-K241 PolarHBondContact O-N 2.83Å; V238-Q242 WeakPolarHBondContact O-CB 3.31Å; V238-Q242 VanDerWaalsContact O-CG 3.31Å; V238-Q242 WeakPolarHBondContact O-CG 3.49Å; V238-Q242 PolarHBondContact O-N 2.97Å
239	N	66.5	Low	71	Confident	30 Å²	30	78.5 Å²	78.5	16%	0.16	41%	0.41	C	S	.	.	H	α-helix	trans	-73.1	-28.7	-174.9	-64.8	-17.6	0	0	0	113.3	R117 R235 I236 Q242 T243	R117-N239 HydrophobicContact CG-CB 4.15Å; R235-N239 VanDerWaalsContact O-CB 3.24Å; R235-N239 WeakPolarHBondContact O-CB 3.41Å; R235-N239 PolarHBondContact O-N 3.2Å; R235-N239 PolarHBondContact O-ND2 3.33Å; R235-N239 PolarHBondContact O-OD1 2.89Å; I236-N239 CarbonylContact O-C 3.59Å; I236-N239 PolarHBondContact O-N 3.45Å; I236-N239 VanDerWaalsContact O-N 3.13Å; N239-Q242 PolarHBondContact OD1-OE1 2.62Å; N239-T243 VanDerWaalsContact O-CB 3.3Å; N239-T243 WeakPolarHBondContact O-CB 3.42Å; N239-T243 PolarHBondContact O-N 3.41Å; N239-T243 PolarHBondContact O-OG1 3.21Å
240	V	69.6	Low	71.7	Confident	66 Å²	66	80.1 Å²	80.1	40%	0.4	43%	0.427	S	S	.	.	H	α-helix	trans	-70	-44.5	174.4	167.6	0	0	0	0	109.6	I236 V238 T243 Q244	I236-V240 HydrophobicContact CG2-CG2 3.67Å; I236-V240 VanDerWaalsContact O-CB 3.29Å; I236-V240 WeakPolarHBondContact O-CB 3.3Å; I236-V240 VanDerWaalsContact O-CG2 3.24Å; I236-V240 WeakPolarHBondContact O-CG2 3.46Å; I236-V240 PolarHBondContact O-N 2.93Å; V238-V240 PolarHBondContact O-N 3.24Å; V240-T243 PolarHBondContact O-N 3.26Å; V240-Q244 WeakPolarHBondContact O-CB 3.25Å; V240-Q244 PolarHBondContact O-N 3.21Å
241	K	70.9	Confident	72.7	Confident	130 Å²	130	86.1 Å²	86.1	57%	0.565	44%	0.436	S	S	*	.	H	α-helix	trans	-57.3	-49.6	171.4	-75.8	174	-177.8	169.5	0	110.8	D237 V238 T243 Q244 D245	D237-K241 WeakPolarHBondContact O-CB 3.28Å; D237-K241 VanDerWaalsContact O-CG 3.28Å; D237-K241 WeakPolarHBondContact O-CG 3.39Å; D237-K241 PolarHBondContact O-N 3.48Å; D237-K241 VanDerWaalsContact O-N 3.12Å; V238-K241 PolarHBondContact O-N 2.83Å; K241-T243 VanDerWaalsContact C-N 3.35Å; K241-T243 PolarHBondContact O-N 2.8Å; K241-Q244 WeakPolarHBondContact O-CB 3.25Å; K241-Q244 PolarHBondContact O-N 3.03Å; K241-D245 PolarHBondContact O-N 3.49Å
242	Q	68.9	Low	73.7	Confident	85 Å²	85	85.1 Å²	85.1	40%	0.397	43%	0.431	S	S	.	.	H	α-helix	trans	-61.2	-40.2	176.2	-72.6	175.6	-15.5	0	0	112.8	V238 N239 Q244 D245 Y246	V238-Q242 WeakPolarHBondContact O-CB 3.31Å; V238-Q242 VanDerWaalsContact O-CG 3.31Å; V238-Q242 WeakPolarHBondContact O-CG 3.49Å; V238-Q242 PolarHBondContact O-N 2.97Å; N239-Q242 PolarHBondContact OD1-OE1 2.62Å; Q242-Q244 VanDerWaalsContact C-N 3.34Å; Q242-Q244 PolarHBondContact O-N 3.24Å; Q242-D245 WeakPolarHBondContact O-CB 3.36Å; Q242-D245 PolarHBondContact O-N 3.3Å; Q242-Y246 HydrophobicContact CB-CD2 4.38Å; Q242-Y246 HydrophobicContact CB-CE2 4.16Å; Q242-Y246 WeakPolarHBondContact O-CD2 3.47Å; Q242-Y246 PolarHBondContact O-N 3.2Å
243	T	70.6	Confident	74.7	Confident	34 Å²	34	88.7 Å²	88.7	21%	0.209	45%	0.448	C	S	.	.	H	α-helix	trans	-64.3	-40.8	177	-59.3	0	0	0	0	111.4	R117 N239 V240 K241 D245 Y246 V247	R117-T243 PolarHBondContact NE-OG1 3.26Å; R117-T243 PolarHBondContact NH2-OG1 3.45Å; N239-T243 VanDerWaalsContact O-CB 3.3Å; N239-T243 WeakPolarHBondContact O-CB 3.42Å; N239-T243 PolarHBondContact O-N 3.41Å; N239-T243 PolarHBondContact O-OG1 3.21Å; V240-T243 PolarHBondContact O-N 3.26Å; K241-T243 VanDerWaalsContact C-N 3.35Å; K241-T243 PolarHBondContact O-N 2.8Å; T243-D245 VanDerWaalsContact C-N 3.26Å; T243-D245 PolarHBondContact O-N 3.42Å; T243-Y246 PolarHBondContact O-N 2.89Å; T243-V247 HydrophobicContact CG2-CG2 4.19Å; T243-V247 WeakPolarHBondContact O-CB 3.31Å; T243-V247 VanDerWaalsContact O-CG2 3.25Å; T243-V247 WeakPolarHBondContact O-CG2 3.44Å; T243-V247 PolarHBondContact O-N 2.83Å
244	Q	75.5	Confident	75.7	Confident	136 Å²	136	90.2 Å²	90.2	64%	0.636	46%	0.457	S	S	*	.	H	α-helix	trans	-60.1	-41.7	175.1	-176	177	-0.1	0	0	110.6	V240 K241 Q242 A248	V240-Q244 WeakPolarHBondContact O-CB 3.25Å; V240-Q244 PolarHBondContact O-N 3.21Å; K241-Q244 WeakPolarHBondContact O-CB 3.25Å; K241-Q244 PolarHBondContact O-N 3.03Å; Q242-Q244 VanDerWaalsContact C-N 3.34Å; Q242-Q244 PolarHBondContact O-N 3.24Å; Q244-A248 WeakPolarHBondContact O-CB 3.03Å; Q244-A248 PolarHBondContact O-N 2.98Å
245	D	75	Confident	76.8	Confident	109 Å²	109	90.8 Å²	90.8	58%	0.583	45%	0.454	S	S	*	.	H	α-helix	trans	-64.4	-47.5	175.5	-63.7	-24.5	0	0	0	111.5	K241 Q242 T243 V247 A248 E249	K241-D245 PolarHBondContact O-N 3.49Å; Q242-D245 WeakPolarHBondContact O-CB 3.36Å; Q242-D245 PolarHBondContact O-N 3.3Å; T243-D245 VanDerWaalsContact C-N 3.26Å; T243-D245 PolarHBondContact O-N 3.42Å; D245-V247 PolarHBondContact O-N 2.88Å; D245-A248 WeakPolarHBondContact O-CB 3.45Å; D245-A248 PolarHBondContact O-N 3.22Å; D245-E249 PolarHBondContact O-N 3.39Å
246	Y	77.3	Confident	77.9	Confident	152 Å²	152	90.2 Å²	90.2	60%	0.596	45%	0.454	S	S	*	.	H	α-helix	trans	-62.3	-39.9	177	-74.7	-56.4	0	0	0	112.9	Q242 T243 E249 A250	Q242-Y246 HydrophobicContact CB-CD2 4.38Å; Q242-Y246 HydrophobicContact CB-CE2 4.16Å; Q242-Y246 WeakPolarHBondContact O-CD2 3.47Å; Q242-Y246 PolarHBondContact O-N 3.2Å; T243-Y246 PolarHBondContact O-N 2.89Å; Y246-E249 PolarHBondContact O-N 3.1Å; Y246-A250 WeakPolarHBondContact O-CB 3.21Å; Y246-A250 PolarHBondContact O-N 3.41Å
247	V	80.1	Confident	78.8	Confident	93 Å²	93	92.4 Å²	92.4	56%	0.564	47%	0.473	S	S	*	.	H	α-helix	trans	-68.6	-38	177.1	170.5	0	0	0	0	110.5	T243 D245 R251	T243-V247 HydrophobicContact CG2-CG2 4.19Å; T243-V247 WeakPolarHBondContact O-CB 3.31Å; T243-V247 VanDerWaalsContact O-CG2 3.25Å; T243-V247 WeakPolarHBondContact O-CG2 3.44Å; T243-V247 PolarHBondContact O-N 2.83Å; D245-V247 PolarHBondContact O-N 2.88Å; V247-R251 VanDerWaalsContact O-CB 3.25Å; V247-R251 WeakPolarHBondContact O-CB 3.27Å; V247-R251 PolarHBondContact O-N 2.88Å
248	A	80.3	Confident	79.8	Confident	59 Å²	59	92.7 Å²	92.7	49%	0.488	48%	0.478	S	S	.	.	H	α-helix	trans	-63	-44.9	174.3	0	0	0	0	0	111.4	Q244 D245 R251 Q252	Q244-A248 WeakPolarHBondContact O-CB 3.03Å; Q244-A248 PolarHBondContact O-N 2.98Å; D245-A248 WeakPolarHBondContact O-CB 3.45Å; D245-A248 PolarHBondContact O-N 3.22Å; A248-R251 PolarHBondContact O-N 3.43Å; A248-Q252 PolarHBondContact O-N 3.47Å
249	E	81.9	Confident	80.8	Confident	109 Å²	109	92.6 Å²	92.6	51%	0.509	48%	0.478	S	S	.	.	H	α-helix	trans	-64	-48.3	175.8	-172.4	176.5	-171.1	0	0	111.7	D245 Y246 R251 Q252 E253	D245-E249 PolarHBondContact O-N 3.39Å; Y246-E249 PolarHBondContact O-N 3.1Å; E249-R251 VanDerWaalsContact C-N 3.26Å; E249-R251 PolarHBondContact O-N 3.01Å; E249-Q252 CarbonylContact O-C 3.55Å; E249-Q252 WeakPolarHBondContact O-CA 3.32Å; E249-Q252 WeakPolarHBondContact O-CB 3.33Å; E249-Q252 PolarHBondContact O-N 3.29Å; E249-E253 PolarHBondContact O-N 3.36Å
250	A	82.5	Confident	81.7	Confident	52 Å²	52	98.7 Å²	98.7	43%	0.43	50%	0.5	S	S	.	.	H	α-helix	trans	-59.5	-37.3	176.2	0	0	0	0	0	111.9	Y246 Q252 E253 T254	Y246-A250 WeakPolarHBondContact O-CB 3.21Å; Y246-A250 PolarHBondContact O-N 3.41Å; A250-Q252 VanDerWaalsContact C-N 3.31Å; A250-Q252 PolarHBondContact O-N 3.37Å; A250-E253 PolarHBondContact O-N 3.29Å; A250-T254 WeakPolarHBondContact O-CB 3.39Å; A250-T254 VanDerWaalsContact O-CG2 3.27Å; A250-T254 WeakPolarHBondContact O-CG2 3.33Å; A250-T254 PolarHBondContact O-N 2.93Å; A250-T254 PolarHBondContact O-OG1 3.04Å
251	R	88.3	Confident	82.2	Confident	169 Å²	169	102 Å²	102	64%	0.638	51%	0.508	S	S	*	.	H	α-helix	trans	-65.5	-34.5	173	-170.6	177.5	-174.9	-178.9	2.3	111.9	V247 A248 E249 T254 K255	V247-R251 VanDerWaalsContact O-CB 3.25Å; V247-R251 WeakPolarHBondContact O-CB 3.27Å; V247-R251 PolarHBondContact O-N 2.88Å; A248-R251 PolarHBondContact O-N 3.43Å; E249-R251 VanDerWaalsContact C-N 3.26Å; E249-R251 PolarHBondContact O-N 3.01Å; R251-T254 WeakPolarHBondContact CA-OG1 3.35Å; R251-T254 PolarHBondContact O-OG1 2.96Å; R251-K255 WeakPolarHBondContact O-CG 3.44Å; R251-K255 PolarHBondContact O-N 3.2Å
252	Q	88.5	Confident	82.7	Confident	109 Å²	109	102.6 Å²	102.6	51%	0.509	51%	0.511	S	S	.	.	H	α-helix	trans	-71.6	-43.4	174.8	-171.4	179	-3.8	0	0	111.5	A248 E249 A250 K255 K256	A248-Q252 PolarHBondContact O-N 3.47Å; E249-Q252 CarbonylContact O-C 3.55Å; E249-Q252 WeakPolarHBondContact O-CA 3.32Å; E249-Q252 WeakPolarHBondContact O-CB 3.33Å; E249-Q252 PolarHBondContact O-N 3.29Å; A250-Q252 VanDerWaalsContact C-N 3.31Å; A250-Q252 PolarHBondContact O-N 3.37Å; Q252-K255 WeakPolarHBondContact O-CB 3.42Å; Q252-K255 PolarHBondContact O-N 2.78Å; Q252-K256 WeakPolarHBondContact O-CG 3.33Å; Q252-K256 PolarHBondContact O-N 3.07Å
253	E	89.5	Confident	83.2	Confident	87 Å²	87	104.4 Å²	104.4	41%	0.407	52%	0.518	S	S	.	.	H	α-helix	trans	-64.9	-41	177.4	-73.9	-53.8	135	0	0	112.2	E249 A250 K255 K256 A257	E249-E253 PolarHBondContact O-N 3.36Å; A250-E253 PolarHBondContact O-N 3.29Å; E253-K255 VanDerWaalsContact C-N 3.34Å; E253-K255 PolarHBondContact O-N 2.95Å; E253-K256 PolarHBondContact O-N 3.39Å; E253-K256 WeakPolarHBondContact OE1-CD 3.35Å; E253-K256 IonicContact OE1-NZ 2.7Å; E253-K256 PolarHBondContact OE1-NZ 3.21Å; E253-A257 WeakPolarHBondContact O-CB 3.42Å; E253-A257 PolarHBondContact O-N 3.42Å
254	T	88.7	Confident	83.5	Confident	84 Å²	84	105.5 Å²	105.5	52%	0.515	53%	0.527	S	S	.	.	H	α-helix	trans	-62.7	-39	173.2	50.7	0	0	0	0	112.2	A250 R251 A257 V258	A250-T254 WeakPolarHBondContact O-CB 3.39Å; A250-T254 VanDerWaalsContact O-CG2 3.27Å; A250-T254 WeakPolarHBondContact O-CG2 3.33Å; A250-T254 PolarHBondContact O-N 2.93Å; A250-T254 PolarHBondContact O-OG1 3.04Å; R251-T254 WeakPolarHBondContact CA-OG1 3.35Å; R251-T254 PolarHBondContact O-OG1 2.96Å; T254-A257 PolarHBondContact O-N 3.25Å; T254-V258 WeakPolarHBondContact O-CG2 3.34Å; T254-V258 PolarHBondContact O-N 2.84Å
255	K	87.9	Confident	83.8	Confident	129 Å²	129	105.9 Å²	105.9	56%	0.561	52%	0.522	S	S	*	.	H	α-helix	trans	-61.4	-47.6	171.5	-77.7	175.5	-178.6	178.9	0	111.6	R251 Q252 E253 A257 V258 V259	R251-K255 WeakPolarHBondContact O-CG 3.44Å; R251-K255 PolarHBondContact O-N 3.2Å; Q252-K255 WeakPolarHBondContact O-CB 3.42Å; Q252-K255 PolarHBondContact O-N 2.78Å; E253-K255 VanDerWaalsContact C-N 3.34Å; E253-K255 PolarHBondContact O-N 2.95Å; K255-A257 VanDerWaalsContact C-N 3.34Å; K255-A257 PolarHBondContact O-N 3.43Å; K255-V258 PolarHBondContact O-N 3.47Å; K255-V259 WeakPolarHBondContact O-CG2 3.42Å; K255-V259 PolarHBondContact O-N 3.4Å
256	K	89.8	Confident	84.2	Confident	82 Å²	82	107.2 Å²	107.2	36%	0.357	52%	0.523	S	S	.	.	H	α-helix	trans	-58.9	-45.7	176.1	-72	176.7	-170.9	165.3	0	110.6	Q252 E253 V258 V259 Y260	Q252-K256 WeakPolarHBondContact O-CG 3.33Å; Q252-K256 PolarHBondContact O-N 3.07Å; E253-K256 PolarHBondContact O-N 3.39Å; E253-K256 WeakPolarHBondContact OE1-CD 3.35Å; E253-K256 IonicContact OE1-NZ 2.7Å; E253-K256 PolarHBondContact OE1-NZ 3.21Å; K256-V258 VanDerWaalsContact C-N 3.33Å; K256-V258 PolarHBondContact O-N 2.8Å; K256-V259 CarbonylContact O-C 3.53Å; K256-V259 WeakPolarHBondContact O-CA 3.49Å; K256-V259 WeakPolarHBondContact O-CB 3.08Å; K256-V259 PolarHBondContact O-N 3.43Å; K256-Y260 HydrophobicContact CB-CD2 4.2Å; K256-Y260 HydrophobicContact CB-CE2 4.02Å; K256-Y260 WeakPolarHBondContact O-CD2 3.45Å; K256-Y260 PolarHBondContact O-N 2.8Å
257	A	87.4	Confident	84.3	Confident	55 Å²	55	106.8 Å²	106.8	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-58.6	-41.4	178.1	0	0	0	0	0	112.4	E253 T254 K255 Y260 K261	E253-A257 WeakPolarHBondContact O-CB 3.42Å; E253-A257 PolarHBondContact O-N 3.42Å; T254-A257 PolarHBondContact O-N 3.25Å; K255-A257 VanDerWaalsContact C-N 3.34Å; K255-A257 PolarHBondContact O-N 3.43Å; A257-Y260 PolarHBondContact O-N 2.7Å; A257-K261 WeakPolarHBondContact O-CB 3.46Å; A257-K261 PolarHBondContact O-N 3.39Å
258	V	88.5	Confident	84.3	Confident	99 Å²	99	108.1 Å²	108.1	60%	0.6	52%	0.522	S	S	*	.	H	α-helix	trans	-62.4	-43	173.5	171.8	0	0	0	0	111.3	T254 K255 K256 K261 K262	T254-V258 WeakPolarHBondContact O-CG2 3.34Å; T254-V258 PolarHBondContact O-N 2.84Å; K255-V258 PolarHBondContact O-N 3.47Å; K256-V258 VanDerWaalsContact C-N 3.33Å; K256-V258 PolarHBondContact O-N 2.8Å; V258-K261 PolarHBondContact O-N 3.05Å; V258-K262 PolarHBondContact O-N 2.91Å
259	V	88.2	Confident	84.6	Confident	75 Å²	75	112.6 Å²	112.6	46%	0.455	53%	0.531	S	S	.	.	H	α-helix	trans	-63.6	-45.8	176.3	173.7	0	0	0	0	111.1	K255 K256 K261 K262 K263	K255-V259 WeakPolarHBondContact O-CG2 3.42Å; K255-V259 PolarHBondContact O-N 3.4Å; K256-V259 CarbonylContact O-C 3.53Å; K256-V259 WeakPolarHBondContact O-CA 3.49Å; K256-V259 WeakPolarHBondContact O-CB 3.08Å; K256-V259 PolarHBondContact O-N 3.43Å; V259-K261 PolarHBondContact O-N 3.44Å; V259-K262 PolarHBondContact O-N 3.45Å; V259-K263 HydrophobicContact CG1-CD 4.24Å; V259-K263 HydrophobicContact CG1-CG 4.45Å; V259-K263 WeakPolarHBondContact O-CG 3.45Å; V259-K263 PolarHBondContact O-N 2.95Å
260	Y	85.8	Confident	84.8	Confident	158 Å²	158	112.8 Å²	112.8	62%	0.62	54%	0.535	S	S	*	.	H	α-helix	trans	-61.1	-43.4	175.9	-75.5	-62.7	0	0	0	111.6	K256 A257 K262 K263 S264	K256-Y260 HydrophobicContact CB-CD2 4.2Å; K256-Y260 HydrophobicContact CB-CE2 4.02Å; K256-Y260 WeakPolarHBondContact O-CD2 3.45Å; K256-Y260 PolarHBondContact O-N 2.8Å; A257-Y260 PolarHBondContact O-N 2.7Å; Y260-K262 VanDerWaalsContact C-N 3.32Å; Y260-K262 PolarHBondContact O-N 3.26Å; Y260-K263 PolarHBondContact O-N 3.27Å; Y260-S264 VanDerWaalsContact O-CB 3.31Å; Y260-S264 WeakPolarHBondContact O-CB 3.43Å; Y260-S264 PolarHBondContact O-N 3.42Å
261	K	79.6	Confident	85	Confident	135 Å²	135	115.6 Å²	115.6	59%	0.587	54%	0.541	S	S	*	.	H	α-helix	trans	-59.4	-42	174.2	-171.4	176.1	-174.5	175.4	0	111.5	A257 V258 V259 R265	A257-K261 WeakPolarHBondContact O-CB 3.46Å; A257-K261 PolarHBondContact O-N 3.39Å; V258-K261 PolarHBondContact O-N 3.05Å; V259-K261 PolarHBondContact O-N 3.44Å; K261-R265 WeakPolarHBondContact O-CG 3.31Å; K261-R265 PolarHBondContact O-N 3.4Å
262	K	82.1	Confident	85.1	Confident	143 Å²	143	111.9 Å²	111.9	62%	0.622	53%	0.533	S	S	*	.	H	α-helix	trans	-67.8	-43	177.3	-168	173.8	-177.2	176.4	0	112	V258 V259 Y260 R265 K266	V258-K262 PolarHBondContact O-N 2.91Å; V259-K262 PolarHBondContact O-N 3.45Å; Y260-K262 VanDerWaalsContact C-N 3.32Å; Y260-K262 PolarHBondContact O-N 3.26Å; K262-R265 PolarHBondContact O-N 3.2Å; K262-K266 PolarHBondContact O-N 3.49Å
263	K	80.5	Confident	85.2	Confident	124 Å²	124	108.7 Å²	108.7	54%	0.539	53%	0.529	S	S	.	.	H	α-helix	trans	-64.7	-40.8	175.9	-75.1	-176.4	178.5	-179	0	112	V259 Y260 R265 K266 K267	V259-K263 HydrophobicContact CG1-CD 4.24Å; V259-K263 HydrophobicContact CG1-CG 4.45Å; V259-K263 WeakPolarHBondContact O-CG 3.45Å; V259-K263 PolarHBondContact O-N 2.95Å; Y260-K263 PolarHBondContact O-N 3.27Å; K263-R265 VanDerWaalsContact C-N 3.34Å; K263-R265 PolarHBondContact O-N 3.49Å; K263-K266 PolarHBondContact O-N 3.19Å; K263-K267 PolarHBondContact O-N 3.47Å
264	S	75.5	Confident	85.3	Confident	56 Å²	56	108.5 Å²	108.5	39%	0.392	53%	0.534	S	S	.	.	H	α-helix	trans	-60.2	-42.2	177.4	179.3	0	0	0	0	111.8	Y260 K266 K267 K268	Y260-S264 VanDerWaalsContact O-CB 3.31Å; Y260-S264 WeakPolarHBondContact O-CB 3.43Å; Y260-S264 PolarHBondContact O-N 3.42Å; S264-K266 PolarHBondContact O-N 2.81Å; S264-K267 PolarHBondContact O-N 3.29Å; S264-K268 WeakPolarHBondContact O-CG 3.34Å; S264-K268 PolarHBondContact O-N 2.86Å
265	R	82.9	Confident	85.4	Confident	145 Å²	145	108.1 Å²	108.1	55%	0.547	53%	0.533	S	S	.	.	H	α-helix	trans	-58.5	-45.8	173.8	-66.7	-178.2	-144.6	-166.7	7.9	112.2	K261 K262 K263 K267 K268 F269	K261-R265 WeakPolarHBondContact O-CG 3.31Å; K261-R265 PolarHBondContact O-N 3.4Å; K262-R265 PolarHBondContact O-N 3.2Å; K263-R265 VanDerWaalsContact C-N 3.34Å; K263-R265 PolarHBondContact O-N 3.49Å; R265-K267 PolarHBondContact O-N 3.18Å; R265-K268 PolarHBondContact O-N 3.36Å; R265-F269 WeakPolarHBondContact O-CD2 3.49Å; R265-F269 PolarHBondContact O-N 3.28Å
266	K	82	Confident	85.6	Confident	137 Å²	137	105.5 Å²	105.5	60%	0.596	53%	0.531	S	S	*	.	H	α-helix	trans	-60.9	-44.9	177.1	-67.6	-171.2	175.5	-167.4	0	111.9	K262 K263 S264 K268 F269 I270	K262-K266 PolarHBondContact O-N 3.49Å; K263-K266 PolarHBondContact O-N 3.19Å; S264-K266 PolarHBondContact O-N 2.81Å; K266-K268 VanDerWaalsContact C-N 3.33Å; K266-K268 PolarHBondContact O-N 3.38Å; K266-F269 PolarHBondContact O-N 3.47Å; K266-I270 WeakPolarHBondContact O-CG1 3.1Å; K266-I270 PolarHBondContact O-N 2.99Å
267	K	79.9	Confident	85.6	Confident	142 Å²	142	104.1 Å²	104.1	62%	0.617	53%	0.534	S	S	*	.	H	α-helix	trans	-60.7	-40.5	176.8	-71.4	-171.3	177.3	-169.5	0	112.1	K263 S264 R265 F269 I270 I271	K263-K267 PolarHBondContact O-N 3.47Å; S264-K267 PolarHBondContact O-N 3.29Å; R265-K267 PolarHBondContact O-N 3.18Å; K267-F269 PolarHBondContact O-N 3.25Å; K267-I270 PolarHBondContact O-N 3.45Å; K267-I271 WeakPolarHBondContact O-CG1 3.26Å; K267-I271 PolarHBondContact O-N 3.49Å
268	K	81.4	Confident	85.9	Confident	121 Å²	121	105.8 Å²	105.8	53%	0.526	54%	0.535	S	S	.	.	H	α-helix	trans	-58.6	-46	175	-73.1	-174.5	179.1	-167.5	0	112	S264 R265 K266 I270 I271 I272	S264-K268 WeakPolarHBondContact O-CG 3.34Å; S264-K268 PolarHBondContact O-N 2.86Å; R265-K268 PolarHBondContact O-N 3.36Å; K266-K268 VanDerWaalsContact C-N 3.33Å; K266-K268 PolarHBondContact O-N 3.38Å; K268-I270 PolarHBondContact O-N 2.94Å; K268-I271 PolarHBondContact O-N 3.43Å; K268-I272 VanDerWaalsContact O-CG1 3.26Å; K268-I272 WeakPolarHBondContact O-CG1 3.38Å; K268-I272 PolarHBondContact O-N 3.37Å
269	F	85.4	Confident	86.1	Confident	154 Å²	154	105 Å²	105	68%	0.675	53%	0.53	S	S	*	.	H	α-helix	trans	-64	-39.3	176.7	-73.1	-67.4	0	0	0	113	R265 K266 K267 I272 G273	R265-F269 WeakPolarHBondContact O-CD2 3.49Å; R265-F269 PolarHBondContact O-N 3.28Å; K266-F269 PolarHBondContact O-N 3.47Å; K267-F269 PolarHBondContact O-N 3.25Å; F269-I272 PolarHBondContact O-N 2.94Å; F269-G273 PolarHBondContact O-N 3.34Å
270	I	85.9	Confident	86.4	Confident	113 Å²	113	105.2 Å²	105.2	58%	0.579	53%	0.531	S	S	*	.	H	α-helix	trans	-62.8	-47	176.2	-67.1	168	0	0	0	110.6	K266 K267 K268 I272 G273 V274	K266-I270 WeakPolarHBondContact O-CG1 3.1Å; K266-I270 PolarHBondContact O-N 2.99Å; K267-I270 PolarHBondContact O-N 3.45Å; K268-I270 PolarHBondContact O-N 2.94Å; I270-I272 PolarHBondContact O-N 3.29Å; I270-G273 PolarHBondContact O-N 3.48Å; I270-V274 WeakPolarHBondContact O-CG2 3.35Å; I270-V274 PolarHBondContact O-N 2.99Å
271	I	87	Confident	86.7	Confident	111 Å²	111	102.2 Å²	102.2	57%	0.569	53%	0.525	S	S	*	.	H	α-helix	trans	-61.9	-43.8	178.8	-68.7	168.2	0	0	0	111.1	K267 K268 G273 V274 C275	K267-I271 WeakPolarHBondContact O-CG1 3.26Å; K267-I271 PolarHBondContact O-N 3.49Å; K268-I271 PolarHBondContact O-N 3.43Å; I271-G273 VanDerWaalsContact C-N 3.34Å; I271-G273 PolarHBondContact O-N 3.26Å; I271-V274 PolarHBondContact O-N 2.98Å; I271-C275 PolarHBondContact O-N 3.04Å
272	I	90.8	Very high	87.3	Confident	91 Å²	91	100.3 Å²	100.3	47%	0.467	52%	0.52	S	S	.	.	H	α-helix	trans	-60.7	-44.3	175.6	-68.7	165.6	0	0	0	110.5	K268 F269 I270 V274 C275 C276	K268-I272 VanDerWaalsContact O-CG1 3.26Å; K268-I272 WeakPolarHBondContact O-CG1 3.38Å; K268-I272 PolarHBondContact O-N 3.37Å; F269-I272 PolarHBondContact O-N 2.94Å; I270-I272 PolarHBondContact O-N 3.29Å; I272-V274 PolarHBondContact O-N 3.46Å; I272-C275 PolarHBondContact O-N 2.92Å; I272-C276 PolarHBondContact O-N 3.21Å; I272-C276 PolarHBondContact O-SG 3.06Å; I272-C276 VanDerWaalsContact O-SG 3.37Å
273	G	89.7	Confident	87.8	Confident	41 Å²	41	97.7 Å²	97.7	42%	0.423	51%	0.512	S	S	.	.	H	α-helix	trans	-59.6	-43.3	177.2	0	0	0	0	0	113.2	F269 I270 I271 C276 A277	F269-G273 PolarHBondContact O-N 3.34Å; I270-G273 PolarHBondContact O-N 3.48Å; I271-G273 VanDerWaalsContact C-N 3.34Å; I271-G273 PolarHBondContact O-N 3.26Å; G273-C276 PolarHBondContact O-N 3.03Å; G273-A277 PolarHBondContact O-N 3.27Å
274	V	92	Very high	88.3	Confident	83 Å²	83	96.7 Å²	96.7	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-64.6	-43.8	175.9	174	0	0	0	0	111.4	I270 I271 I272 C276 A277 I278	I270-V274 WeakPolarHBondContact O-CG2 3.35Å; I270-V274 PolarHBondContact O-N 2.99Å; I271-V274 PolarHBondContact O-N 2.98Å; I272-V274 PolarHBondContact O-N 3.46Å; V274-C276 PolarHBondContact O-N 3.48Å; V274-A277 PolarHBondContact O-N 3.01Å; V274-I278 HydrophobicContact CG1-CD1 4.03Å; V274-I278 WeakPolarHBondContact O-CG1 3.41Å; V274-I278 PolarHBondContact O-N 3.48Å
275	C	90.7	Very high	89	Confident	76 Å²	76	98.6 Å²	98.6	51%	0.514	52%	0.517	S	S	.	.	H	α-helix	trans	-58.1	-47.3	174.3	-96.7	0	0	0	0	112.1	I271 I272 A277 I278 V279	I271-C275 PolarHBondContact O-N 3.04Å; I272-C275 PolarHBondContact O-N 2.92Å; C275-A277 VanDerWaalsContact C-N 3.32Å; C275-A277 PolarHBondContact O-N 3.33Å; C275-I278 PolarHBondContact O-N 3.08Å; C275-V279 WeakPolarHBondContact O-CG2 3.42Å; C275-V279 PolarHBondContact O-N 3.31Å; C275-V279 VanDerWaalsContact O-N 3.08Å
276	C	91.8	Very high	89.3	Confident	75 Å²	75	95.3 Å²	95.3	51%	0.507	51%	0.512	S	S	.	.	H	α-helix	trans	-60.3	-41.5	177.2	-70	0	0	0	0	112	I272 G273 V274 I278 V279 V280	I272-C276 PolarHBondContact O-N 3.21Å; I272-C276 PolarHBondContact O-SG 3.06Å; I272-C276 VanDerWaalsContact O-SG 3.37Å; G273-C276 PolarHBondContact O-N 3.03Å; V274-C276 PolarHBondContact O-N 3.48Å; C276-I278 PolarHBondContact O-N 3.28Å; C276-V279 PolarHBondContact O-N 3.5Å; C276-V280 WeakPolarHBondContact O-CG2 3.38Å; C276-V280 PolarHBondContact O-N 3.41Å
277	A	91.6	Very high	89.6	Confident	52 Å²	52	93.2 Å²	93.2	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-62.1	-42.1	177.6	0	0	0	0	0	112.3	G273 V274 C275 V280 I281	G273-A277 PolarHBondContact O-N 3.27Å; V274-A277 PolarHBondContact O-N 3.01Å; C275-A277 VanDerWaalsContact C-N 3.32Å; C275-A277 PolarHBondContact O-N 3.33Å; A277-V280 PolarHBondContact O-N 3.43Å; A277-I281 VanDerWaalsContact O-CG1 3.32Å; A277-I281 WeakPolarHBondContact O-CG1 3.19Å; A277-I281 PolarHBondContact O-N 3.5Å
278	I	93.3	Very high	89.8	Confident	91 Å²	91	90 Å²	90	47%	0.467	51%	0.506	S	S	.	.	H	α-helix	trans	-62.7	-44.8	176.6	-66.7	166	0	0	0	110.9	V274 C275 C276 V280 I281 I282	V274-I278 HydrophobicContact CG1-CD1 4.03Å; V274-I278 WeakPolarHBondContact O-CG1 3.41Å; V274-I278 PolarHBondContact O-N 3.48Å; C275-I278 PolarHBondContact O-N 3.08Å; C276-I278 PolarHBondContact O-N 3.28Å; I278-V280 VanDerWaalsContact C-N 3.33Å; I278-V280 PolarHBondContact O-N 3.4Å; I278-I281 PolarHBondContact O-N 2.98Å; I278-I282 HydrophobicContact CG2-CD1 3.92Å; I278-I282 HydrophobicContact CG2-CG1 4.49Å; I278-I282 WeakPolarHBondContact O-CG1 3.2Å; I278-I282 PolarHBondContact O-N 3.35Å
279	V	92.8	Very high	89.9	Confident	82 Å²	82	89.3 Å²	89.3	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-60.2	-43	177.6	172.9	0	0	0	0	111.2	C275 C276 I281 I282 I283	C275-V279 WeakPolarHBondContact O-CG2 3.42Å; C275-V279 PolarHBondContact O-N 3.31Å; C275-V279 VanDerWaalsContact O-N 3.08Å; C276-V279 PolarHBondContact O-N 3.5Å; V279-I281 PolarHBondContact O-N 2.96Å; V279-I282 PolarHBondContact O-N 2.97Å; V279-I283 HydrophobicContact CG1-CD1 3.88Å; V279-I283 VanDerWaalsContact O-CG1 3.3Å; V279-I283 WeakPolarHBondContact O-CG1 3.48Å; V279-I283 PolarHBondContact O-N 3.22Å
280	V	93.3	Very high	89.7	Confident	79 Å²	79	87 Å²	87	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-62.4	-42.8	176.4	171.7	0	0	0	0	111.6	C276 A277 I278 I282 I283 I284	C276-V280 WeakPolarHBondContact O-CG2 3.38Å; C276-V280 PolarHBondContact O-N 3.41Å; A277-V280 PolarHBondContact O-N 3.43Å; I278-V280 VanDerWaalsContact C-N 3.33Å; I278-V280 PolarHBondContact O-N 3.4Å; V280-I282 VanDerWaalsContact C-N 3.35Å; V280-I282 PolarHBondContact O-N 3.37Å; V280-I283 PolarHBondContact O-N 2.87Å; V280-I284 HydrophobicContact CG1-CD1 3.87Å; V280-I284 HydrophobicContact CG1-CG1 4.45Å; V280-I284 WeakPolarHBondContact O-CG1 3.3Å; V280-I284 PolarHBondContact O-N 2.89Å
281	I	93	Very high	89	Confident	95 Å²	95	86 Å²	86	49%	0.487	51%	0.509	S	S	.	.	H	α-helix	trans	-61.2	-44.5	176.6	-69.1	165.7	0	0	0	110.8	A277 I278 V279 I283 I284 I285	A277-I281 VanDerWaalsContact O-CG1 3.32Å; A277-I281 WeakPolarHBondContact O-CG1 3.19Å; A277-I281 PolarHBondContact O-N 3.5Å; I278-I281 PolarHBondContact O-N 2.98Å; V279-I281 PolarHBondContact O-N 2.96Å; I281-I283 VanDerWaalsContact C-N 3.33Å; I281-I283 PolarHBondContact O-N 3.14Å; I281-I284 PolarHBondContact O-N 3.43Å; I281-I285 HydrophobicContact CG2-CD1 3.77Å; I281-I285 HydrophobicContact CG2-CG1 4.44Å; I281-I285 VanDerWaalsContact O-CG1 3.3Å; I281-I285 WeakPolarHBondContact O-CG1 3.36Å; I281-I285 PolarHBondContact O-N 2.91Å
282	I	92.3	Very high	87.7	Confident	95 Å²	95	85.8 Å²	85.8	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-60.1	-45.2	176.7	-67.8	168	0	0	0	110.4	I278 V279 V280 I284 I285 V286	I278-I282 HydrophobicContact CG2-CD1 3.92Å; I278-I282 HydrophobicContact CG2-CG1 4.49Å; I278-I282 WeakPolarHBondContact O-CG1 3.2Å; I278-I282 PolarHBondContact O-N 3.35Å; V279-I282 PolarHBondContact O-N 2.97Å; V280-I282 VanDerWaalsContact C-N 3.35Å; V280-I282 PolarHBondContact O-N 3.37Å; I282-I284 PolarHBondContact O-N 3.31Å; I282-I285 PolarHBondContact O-N 3.47Å; I282-V286 HydrophobicContact CG2-CG2 4.36Å; I282-V286 VanDerWaalsContact O-CG2 3.28Å; I282-V286 WeakPolarHBondContact O-CG2 3.3Å; I282-V286 PolarHBondContact O-N 3.25Å
283	I	91.5	Very high	86.4	Confident	88 Å²	88	91.5 Å²	91.5	45%	0.451	54%	0.537	S	S	.	.	H	α-helix	trans	-60.2	-44.7	177.2	-69.3	166.4	0	0	0	110.9	V279 V280 I281 I285 V286 I287	V279-I283 HydrophobicContact CG1-CD1 3.88Å; V279-I283 VanDerWaalsContact O-CG1 3.3Å; V279-I283 WeakPolarHBondContact O-CG1 3.48Å; V279-I283 PolarHBondContact O-N 3.22Å; V280-I283 PolarHBondContact O-N 2.87Å; I281-I283 VanDerWaalsContact C-N 3.33Å; I281-I283 PolarHBondContact O-N 3.14Å; I283-I285 VanDerWaalsContact C-N 3.35Å; I283-I285 PolarHBondContact O-N 3.27Å; I283-V286 PolarHBondContact O-N 2.93Å; I283-I287 HydrophobicContact CG2-CD1 3.61Å; I283-I287 HydrophobicContact CG2-CG1 4.31Å; I283-I287 WeakPolarHBondContact O-CB 3.28Å; I283-I287 VanDerWaalsContact O-CG1 3.25Å; I283-I287 WeakPolarHBondContact O-CG1 3.25Å; I283-I287 PolarHBondContact O-N 3.01Å
284	I	91.2	Very high	84.5	Confident	103 Å²	103	102.8 Å²	102.8	53%	0.528	58%	0.575	S	S	.	*	H	α-helix	trans	-61.6	-43.7	177.6	-69	166.9	0	0	0	111	V280 I281 I282 I287 A288	V280-I284 HydrophobicContact CG1-CD1 3.87Å; V280-I284 HydrophobicContact CG1-CG1 4.45Å; V280-I284 WeakPolarHBondContact O-CG1 3.3Å; V280-I284 PolarHBondContact O-N 2.89Å; I281-I284 PolarHBondContact O-N 3.43Å; I282-I284 PolarHBondContact O-N 3.31Å; I284-I287 PolarHBondContact O-N 2.85Å; I284-A288 VanDerWaalsContact O-CB 3.26Å; I284-A288 WeakPolarHBondContact O-CB 3.32Å; I284-A288 PolarHBondContact O-N 3Å
285	I	90.3	Very high	84.1	Confident	97 Å²	97	103.8 Å²	103.8	50%	0.497	58%	0.578	S	S	.	*	H	α-helix	trans	-62	-46.1	177.5	-68.6	165.4	0	0	0	110.4	I281 I282 I283 I287 A288 T289	I281-I285 HydrophobicContact CG2-CD1 3.77Å; I281-I285 HydrophobicContact CG2-CG1 4.44Å; I281-I285 VanDerWaalsContact O-CG1 3.3Å; I281-I285 WeakPolarHBondContact O-CG1 3.36Å; I281-I285 PolarHBondContact O-N 2.91Å; I282-I285 PolarHBondContact O-N 3.47Å; I283-I285 VanDerWaalsContact C-N 3.35Å; I283-I285 PolarHBondContact O-N 3.27Å; I285-I287 PolarHBondContact O-N 2.84Å; I285-A288 PolarHBondContact O-N 2.94Å; I285-T289 HydrophobicContact CG2-CG2 4.37Å; I285-T289 WeakPolarHBondContact O-CG2 3.32Å; I285-T289 PolarHBondContact O-N 3.46Å; I285-T289 PolarHBondContact O-OG1 2.92Å
286	V	89.6	Confident	83.8	Confident	75 Å²	75	105.3 Å²	105.3	46%	0.455	58%	0.582	S	S	.	*	H	α-helix	trans	-61.9	-44	177.9	171.8	0	0	0	0	110.9	I282 I283 T289 V290	I282-V286 HydrophobicContact CG2-CG2 4.36Å; I282-V286 VanDerWaalsContact O-CG2 3.28Å; I282-V286 WeakPolarHBondContact O-CG2 3.3Å; I282-V286 PolarHBondContact O-N 3.25Å; I283-V286 PolarHBondContact O-N 2.93Å; V286-T289 PolarHBondContact O-N 3.46Å; V286-T289 PolarHBondContact O-OG1 3.27Å; V286-V290 HydrophobicContact CG1-CG2 4.1Å; V286-V290 WeakPolarHBondContact O-CB 3.25Å; V286-V290 WeakPolarHBondContact O-CG2 3.26Å; V286-V290 PolarHBondContact O-N 3.48Å
287	I	87.6	Confident	83.3	Confident	93 Å²	93	106.9 Å²	106.9	48%	0.477	59%	0.586	S	S	.	*	H	α-helix	trans	-64	-43.7	176.7	-67.8	168.5	0	0	0	110.4	I283 I284 I285 T289 V291	I283-I287 HydrophobicContact CG2-CD1 3.61Å; I283-I287 HydrophobicContact CG2-CG1 4.31Å; I283-I287 WeakPolarHBondContact O-CB 3.28Å; I283-I287 VanDerWaalsContact O-CG1 3.25Å; I283-I287 WeakPolarHBondContact O-CG1 3.25Å; I283-I287 PolarHBondContact O-N 3.01Å; I284-I287 PolarHBondContact O-N 2.85Å; I285-I287 PolarHBondContact O-N 2.84Å; I287-T289 VanDerWaalsContact C-N 3.33Å; I287-T289 PolarHBondContact O-N 3.43Å; I287-V291 HydrophobicContact CG2-CG2 3.83Å; I287-V291 WeakPolarHBondContact O-CB 3.33Å; I287-V291 VanDerWaalsContact O-CG2 3.25Å; I287-V291 WeakPolarHBondContact O-CG2 3.14Å; I287-V291 PolarHBondContact O-N 3.29Å
288	A	85.3	Confident	82.8	Confident	74 Å²	74	110.2 Å²	110.2	61%	0.612	60%	0.595	S	S	*	*	H	α-helix	trans	-68	-29.1	-179.3	0	0	0	0	0	113.6	I284 I285	I284-A288 VanDerWaalsContact O-CB 3.26Å; I284-A288 WeakPolarHBondContact O-CB 3.32Å; I284-A288 PolarHBondContact O-N 3Å; I285-A288 PolarHBondContact O-N 2.94Å
289	T	83.5	Confident	82.2	Confident	107 Å²	107	111.4 Å²	111.4	66%	0.656	60%	0.603	S	S	*	*	H	α-helix	trans	-86.5	-34.9	177	55.6	0	0	0	0	112.8	I285 V286 I287	I285-T289 HydrophobicContact CG2-CG2 4.37Å; I285-T289 WeakPolarHBondContact O-CG2 3.32Å; I285-T289 PolarHBondContact O-N 3.46Å; I285-T289 PolarHBondContact O-OG1 2.92Å; V286-T289 PolarHBondContact O-N 3.46Å; V286-T289 PolarHBondContact O-OG1 3.27Å; I287-T289 VanDerWaalsContact C-N 3.33Å; I287-T289 PolarHBondContact O-N 3.43Å
290	V	80.3	Confident	81.5	Confident	105 Å²	105	113.3 Å²	113.3	64%	0.636	61%	0.61	S	S	*	*	H	α-helix	trans	-87.6	-33.6	-176.6	177.5	0	0	0	0	112.1	V286 P292	V286-V290 HydrophobicContact CG1-CG2 4.1Å; V286-V290 WeakPolarHBondContact O-CB 3.25Å; V286-V290 WeakPolarHBondContact O-CG2 3.26Å; V286-V290 PolarHBondContact O-N 3.48Å; V290-P292 WeakPolarHBondContact O-CD 3.16Å
291	V	70.7	Confident	80.6	Confident	92 Å²	92	115.8 Å²	115.8	56%	0.558	62%	0.619	S	S	*	*	S	Bend	trans	-79.8	106.4	175.9	-178.7	0	0	0	0	107.8	I287 K293	I287-V291 HydrophobicContact CG2-CG2 3.83Å; I287-V291 WeakPolarHBondContact O-CB 3.33Å; I287-V291 VanDerWaalsContact O-CG2 3.25Å; I287-V291 WeakPolarHBondContact O-CG2 3.14Å; I287-V291 PolarHBondContact O-N 3.29Å; V291-K293 PolarHBondContact O-N 3.31Å
292	P	60.8	Low	79.7	Confident	107 Å²	107	117.4 Å²	117.4	70%	0.695	63%	0.629	S	S	*	*			trans	-65.1	130.9	179.3	25.6	-24.3	0	0	0	107.9	V290 K294	V290-P292 WeakPolarHBondContact O-CD 3.16Å; P292-K294 PolarHBondContact O-N 2.95Å
293	K	63.6	Low	78.6	Confident	211 Å²	211	119.3 Å²	119.3	92%	0.917	64%	0.641	S	S	*	*			trans	-50.6	112.6	167.1	-83.8	-177.7	174.8	179.3	0	107.2	V291	V291-K293 PolarHBondContact O-N 3.31Å
294	K	49.4	Very low	77.5	Confident	279 Å²	279	122.1 Å²	122.1	100%	1.213	66%	0.659	S	S	*	*			trans	-59.5	0	169.4	-118.9	-175.2	179.5	-175.3	0	110.3	P292	P292-K294 PolarHBondContact O-N 2.95Å

Retrieved 294 of 294 residues in 61.5 ms (Link to these results)

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