A0A061I8Z5_CRIGR Loading...

Syntaxin-3

Potentially involved in docking of synaptic vesicles at presynaptic active zones. Apical receptor involved in membrane fusion of apical vesicles. Essential for survival of retinal photoreceetors.

AlphaFold DB , UniProt , Accession A0A061I8Z5, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Stx3, Length 289 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	44.8	Very low	66.7	Low	247 Å²	247	140.7 Å²	140.7	100%	1.217	68%	0.675	S	S	*	*				0	134.1	0	-85.6	177.7	-102.6	0	0	108.2
2	K	56.9	Low	65.9	Low	190 Å²	190	141.8 Å²	141.8	83%	0.826	68%	0.678	S	S	*	*			trans	-77.9	126.1	172.9	-75.5	179.3	176.7	178	0	107.9	R4	K2-R4 WeakPolarHBondContact O-CG 3.12Å; K2-R4 PolarHBondContact O-N 2.8Å
3	D	67.4	Low	65.1	Low	134 Å²	134	142.2 Å²	142.2	72%	0.717	69%	0.686	S	S	*	*			trans	-59.1	123.3	174.1	-171.1	-5.4	0	0	0	109.2	L5	D3-L5 WeakPolarHBondContact OD1-CB 3.34Å; D3-L5 PolarHBondContact OD1-N 2.87Å
4	R	76.1	Confident	64.2	Low	154 Å²	154	140.3 Å²	140.3	58%	0.581	69%	0.687	S	S	*	*			trans	-119.1	10.8	-179.9	-67.1	-139	-178.1	-152.8	13.1	111.9	K2 E6 Q7 L8	K2-R4 WeakPolarHBondContact O-CG 3.12Å; K2-R4 PolarHBondContact O-N 2.8Å; R4-E6 VanDerWaalsContact C-N 3.27Å; R4-E6 PolarHBondContact O-N 2.94Å; R4-Q7 PolarHBondContact O-N 3.23Å; R4-Q7 VanDerWaalsContact O-N 3.15Å; R4-L8 PolarHBondContact O-N 3.34Å; R4-L8 VanDerWaalsContact O-N 3.14Å
5	L	74.6	Confident	63.1	Low	98 Å²	98	140.3 Å²	140.3	51%	0.513	69%	0.685	S	S	.	*	H	α-helix	trans	-59.7	-40.3	-177.2	-167.4	71.7	0	0	0	111.5	D3 L8 K9	D3-L5 WeakPolarHBondContact OD1-CB 3.34Å; D3-L5 PolarHBondContact OD1-N 2.87Å; L5-L8 PolarHBondContact O-N 3.27Å; L5-K9 PolarHBondContact O-N 3.32Å
6	E	73.1	Confident	62.3	Low	166 Å²	166	142.1 Å²	142.1	78%	0.776	70%	0.699	S	S	*	*	H	α-helix	trans	-66.8	-37.1	177.4	-68.3	-168.2	156.7	0	0	113	R4 L8 K9 A10	R4-E6 VanDerWaalsContact C-N 3.27Å; R4-E6 PolarHBondContact O-N 2.94Å; E6-L8 VanDerWaalsContact C-N 3.27Å; E6-L8 PolarHBondContact O-N 3.07Å; E6-K9 PolarHBondContact O-N 3.41Å; E6-A10 WeakPolarHBondContact O-CB 3.49Å; E6-A10 PolarHBondContact O-N 3Å
7	Q	71.5	Confident	61.3	Low	114 Å²	114	139.5 Å²	139.5	53%	0.533	69%	0.689	S	S	.	*	H	α-helix	trans	-67.3	-31.6	177.2	-67.4	-178.5	4.3	0	0	111.8	R4 K11	R4-Q7 PolarHBondContact O-N 3.23Å; R4-Q7 VanDerWaalsContact O-N 3.15Å; Q7-K11 WeakPolarHBondContact O-CB 3.48Å; Q7-K11 PolarHBondContact O-N 3.14Å
8	L	66.8	Low	60.6	Low	116 Å²	116	141 Å²	141	61%	0.607	70%	0.7	S	S	*	*	H	α-helix	trans	-74.1	-44.6	176	-72.7	164.1	0	0	0	111.4	R4 L5 E6 A10 K11 Q12	R4-L8 PolarHBondContact O-N 3.34Å; R4-L8 VanDerWaalsContact O-N 3.14Å; L5-L8 PolarHBondContact O-N 3.27Å; E6-L8 VanDerWaalsContact C-N 3.27Å; E6-L8 PolarHBondContact O-N 3.07Å; L8-A10 PolarHBondContact O-N 3.17Å; L8-K11 PolarHBondContact O-N 3.34Å; L8-Q12 PolarHBondContact O-N 3.05Å; L8-Q12 VanDerWaalsContact O-N 3.1Å
9	K	70.6	Confident	59.9	Low	127 Å²	127	140.1 Å²	140.1	55%	0.552	70%	0.703	S	S	*	*	H	α-helix	trans	-61.1	-43.4	175.3	-75.8	-175.9	177.2	-177.2	0	112.4	L5 E6 K11 Q12 L13	L5-K9 PolarHBondContact O-N 3.32Å; E6-K9 PolarHBondContact O-N 3.41Å; K9-K11 VanDerWaalsContact C-N 3.25Å; K9-K11 PolarHBondContact O-N 3.4Å; K9-Q12 PolarHBondContact O-N 3.42Å; K9-L13 PolarHBondContact O-N 3.2Å
10	A	67.9	Low	59.3	Low	57 Å²	57	140.7 Å²	140.7	47%	0.471	71%	0.708	S	S	.	*	H	α-helix	trans	-62.9	-33.5	178.1	0	0	0	0	0	112.4	E6 L8 T14	E6-A10 WeakPolarHBondContact O-CB 3.49Å; E6-A10 PolarHBondContact O-N 3Å; L8-A10 PolarHBondContact O-N 3.17Å; A10-T14 WeakPolarHBondContact O-CG2 3.39Å
11	K	63.6	Low	58.5	Low	145 Å²	145	142.9 Å²	142.9	63%	0.63	72%	0.716	S	S	*	*	H	α-helix	trans	-76.2	-34.3	179.6	-156.9	175.8	-176.4	-174.3	0	112.6	Q7 L8 K9 L13 T14	Q7-K11 WeakPolarHBondContact O-CB 3.48Å; Q7-K11 PolarHBondContact O-N 3.14Å; L8-K11 PolarHBondContact O-N 3.34Å; K9-K11 VanDerWaalsContact C-N 3.25Å; K9-K11 PolarHBondContact O-N 3.4Å; K11-L13 VanDerWaalsContact C-N 3.34Å; K11-T14 PolarHBondContact O-N 3.42Å; K11-T14 PolarHBondContact O-OG1 3.36Å
12	Q	57.8	Low	58.7	Low	153 Å²	153	137.1 Å²	137.1	72%	0.715	69%	0.694	S	S	*	*	H	α-helix	trans	-63	-38	173.7	-114.7	171.5	-16.6	0	0	112.4	L8 K9 T14	L8-Q12 PolarHBondContact O-N 3.05Å; L8-Q12 VanDerWaalsContact O-N 3.1Å; K9-Q12 PolarHBondContact O-N 3.42Å; Q12-T14 VanDerWaalsContact C-N 3.28Å; Q12-T14 PolarHBondContact O-N 3.43Å
13	L	54.8	Low	57.9	Low	148 Å²	148	136.6 Å²	136.6	78%	0.775	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-16.4	179.6	-71.7	162.5	0	0	0	114.2	K9 K11	K9-L13 PolarHBondContact O-N 3.2Å; K11-L13 VanDerWaalsContact C-N 3.34Å
14	T	53.2	Low	57	Low	115 Å²	115	136.8 Å²	136.8	71%	0.706	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-0.7	-178.4	54.6	0	0	0	0	114	A10 K11 Q12	A10-T14 WeakPolarHBondContact O-CG2 3.39Å; K11-T14 PolarHBondContact O-N 3.42Å; K11-T14 PolarHBondContact O-OG1 3.36Å; Q12-T14 VanDerWaalsContact C-N 3.28Å; Q12-T14 PolarHBondContact O-N 3.43Å
15	Q	47.6	Very low	55.3	Low	140 Å²	140	133.4 Å²	133.4	65%	0.654	70%	0.7	S	S	*	*			trans	-109.2	79.3	-175.5	-158.5	168.5	-3.3	0	0	109.3	D17	Q15-D17 VanDerWaalsContact C-N 3.3Å; Q15-D17 PolarHBondContact O-N 3.29Å
16	D	50.3	Low	54.2	Low	170 Å²	170	135.5 Å²	135.5	91%	0.909	71%	0.71	S	S	*	*			trans	-64.7	91.6	159.1	-81.9	-23.1	0	0	0	107.9
17	D	44.7	Very low	53	Low	98 Å²	98	134.6 Å²	134.6	52%	0.524	71%	0.71	S	S	.	*	S	Bend	trans	-154.5	128.5	156.8	-150.9	12.7	0	0	0	107.2	Q15 T19 R261	Q15-D17 VanDerWaalsContact C-N 3.3Å; Q15-D17 PolarHBondContact O-N 3.29Å; D17-T19 VanDerWaalsContact C-N 3.32Å; D17-T19 PolarHBondContact O-N 3.48Å; D17-R261 IonicContact OD2-NH1 2.86Å
18	D	49.2	Very low	52.3	Low	166 Å²	166	134.2 Å²	134.2	89%	0.888	71%	0.712	S	S	*	*			trans	-50.4	84	-177.1	-63.2	-57.9	0	0	0	112.7
19	T	46.8	Very low	51.7	Low	123 Å²	123	134.6 Å²	134.6	76%	0.755	72%	0.719	S	S	*	*			trans	-89.4	109.5	161.8	47.2	0	0	0	0	106.8	D17 E21	D17-T19 VanDerWaalsContact C-N 3.32Å; D17-T19 PolarHBondContact O-N 3.48Å; T19-E21 PolarHBondContact O-N 2.82Å
20	D	47.3	Very low	51.7	Low	153 Å²	153	132.1 Å²	132.1	82%	0.818	72%	0.722	S	S	*	*			trans	-38	114.6	157	-73.9	-43.9	0	0	0	107	V22	D20-V22 PolarHBondContact O-N 3.02Å
21	E	43.2	Very low	52	Low	187 Å²	187	134 Å²	134	87%	0.874	72%	0.72	S	S	*	*			trans	-56.3	96	171.5	-105.5	179.6	158.7	0	0	105.9	T19 E23	T19-E21 PolarHBondContact O-N 2.82Å; E21-E23 PolarHBondContact O-N 3.45Å
22	V	48.5	Very low	52.7	Low	125 Å²	125	127.8 Å²	127.8	76%	0.758	69%	0.694	S	S	*	*			trans	-69	88.8	162.8	-179.5	0	0	0	0	103.7	D20 I24	D20-V22 PolarHBondContact O-N 3.02Å; V22-I24 PolarHBondContact O-N 3.05Å
23	E	39.8	Very low	54.1	Low	179 Å²	179	125 Å²	125	84%	0.836	68%	0.684	S	S	*	*			trans	-55.4	95.1	166.4	-129.3	-178.4	179.1	0	0	105.8	E21 A25	E21-E23 PolarHBondContact O-N 3.45Å; E23-A25 PolarHBondContact O-N 3.23Å
24	I	48.6	Very low	55.6	Low	138 Å²	138	125.3 Å²	125.3	71%	0.708	68%	0.681	S	S	*	*			trans	-67.4	98.9	164.7	-59.6	173.7	0	0	0	102.9	V22 I26	V22-I24 PolarHBondContact O-N 3.05Å; I24-I26 VanDerWaalsContact C-N 3.26Å; I24-I26 PolarHBondContact O-N 3.2Å
25	A	41.4	Very low	57.2	Low	84 Å²	84	120.2 Å²	120.2	69%	0.694	65%	0.649	S	S	*	*			trans	-55.4	99.3	168.1	0	0	0	0	0	106.7	E23 D27	E23-A25 PolarHBondContact O-N 3.23Å; A25-D27 PolarHBondContact O-N 2.88Å
26	I	50.8	Low	59.2	Low	142 Å²	142	117.3 Å²	117.3	73%	0.728	63%	0.634	S	S	*	*			trans	-75	70.8	165.7	-55.4	174.2	0	0	0	104.7	I24 N28	I24-I26 VanDerWaalsContact C-N 3.26Å; I24-I26 PolarHBondContact O-N 3.2Å; I26-N28 HydrophobicContact CG2-CB 3.6Å; I26-N28 PolarHBondContact O-N 3.23Å
27	D	48	Very low	61.1	Low	146 Å²	146	112.9 Å²	112.9	78%	0.781	62%	0.617	S	S	*	*			trans	-77.3	73.7	167.7	-165.4	21.8	0	0	0	106.6	A25	A25-D27 PolarHBondContact O-N 2.88Å
28	N	57.7	Low	63.4	Low	106 Å²	106	110.5 Å²	110.5	57%	0.567	60%	0.602	S	S	*	*			trans	-131.3	54.1	-170.4	-148.6	26.6	0	0	0	111.8	I26 F31	I26-N28 HydrophobicContact CG2-CB 3.6Å; I26-N28 PolarHBondContact O-N 3.23Å; N28-F31 WeakPolarHBondContact OD1-CB 3.43Å
29	T	54.8	Low	65.4	Low	125 Å²	125	102.8 Å²	102.8	77%	0.767	56%	0.561	S	S	*	*	S	Bend	trans	-104.4	-5.2	169.3	26.5	0	0	0	0	114.1
30	A	69.1	Low	67.7	Low	74 Å²	74	100.6 Å²	100.6	61%	0.612	54%	0.542	S	S	*	.			trans	-150.9	35.4	-177.8	0	0	0	0	0	115.1	M32	A30-M32 PolarHBondContact O-N 2.77Å; A30-M32 VanDerWaalsContact O-N 3.11Å
31	F	74.9	Confident	69.9	Low	96 Å²	96	97 Å²	97	42%	0.421	52%	0.521	S	S	.	.	S	Bend	trans	-71.2	107.8	176.8	175.7	-103.9	0	0	0	110.9	N28 D33 F36 I115	N28-F31 WeakPolarHBondContact OD1-CB 3.43Å; F31-D33 PolarHBondContact O-N 3.43Å; F31-D33 VanDerWaalsContact O-N 3.16Å; F31-F36 HydrophobicContact CD1-CE2 4.3Å; F31-F36 HydrophobicContact CE1-CE2 4.43Å; F31-I115 HydrophobicContact CE1-CD1 4.19Å; F31-I115 HydrophobicContact CZ-CD1 4.18Å
32	M	78.3	Confident	72.4	Confident	16 Å²	16	88.1 Å²	88.1	8%	0.079	48%	0.479	C	S	.	.	S	Bend	trans	57.3	22.1	178.1	-74.5	-154	-62.4	0	0	115.4	A30 E34 F35 F36 D112 I115 R116	A30-M32 PolarHBondContact O-N 2.77Å; A30-M32 VanDerWaalsContact O-N 3.11Å; M32-E34 VanDerWaalsContact C-N 3.3Å; M32-E34 PolarHBondContact O-N 2.66Å; M32-F35 HydrophobicContact CB-CB 4.21Å; M32-F35 HydrophobicContact CB-CD1 4.46Å; M32-F35 HydrophobicContact CE-CD1 4.25Å; M32-F35 WeakPolarHBondContact O-CB 3.28Å; M32-F35 PolarHBondContact O-N 2.99Å; M32-F35 HydrophobicContact SD-CB 4.47Å; M32-F35 HydrophobicContact SD-CD1 3.69Å; M32-F35 HydrophobicContact SD-CE1 4.34Å; M32-F35 HydrophobicContact SD-CG 4.29Å; M32-F36 HydrophobicContact CB-CD2 3.76Å; M32-F36 HydrophobicContact CB-CE2 3.57Å; M32-F36 HydrophobicContact CB-CZ 4.29Å; M32-F36 HydrophobicContact CE-CE1 4.15Å; M32-F36 HydrophobicContact CE-CE2 3.82Å; M32-F36 HydrophobicContact CE-CZ 3.44Å; M32-F36 VanDerWaalsContact CE-CZ 3.44Å; M32-F36 VanDerWaalsContact O-CD2 3.25Å; M32-F36 WeakPolarHBondContact O-CD2 3.41Å; M32-F36 PolarHBondContact O-N 3.28Å; M32-D112 WeakPolarHBondContact CG-OD1 3.44Å; M32-I115 HydrophobicContact CE-CB 3.7Å; M32-I115 HydrophobicContact CE-CD1 3.66Å; M32-I115 HydrophobicContact CE-CG1 4.28Å; M32-I115 HydrophobicContact CE-CG2 3.36Å; M32-I115 HydrophobicContact SD-CG2 4.5Å; M32-R116 HydrophobicContact SD-CG 4.2Å
33	D	86.3	Confident	74.7	Confident	94 Å²	94	86 Å²	86	50%	0.503	46%	0.458	S	S	.	.	H	α-helix	trans	-54.8	-43.6	-176.2	-79.4	8.8	0	0	0	113.3	F31 F36 S37	F31-D33 PolarHBondContact O-N 3.43Å; F31-D33 VanDerWaalsContact O-N 3.16Å; D33-F36 PolarHBondContact O-N 3.28Å; D33-S37 WeakPolarHBondContact O-CB 3.47Å; D33-S37 PolarHBondContact O-N 3.48Å
34	E	86.6	Confident	77.4	Confident	155 Å²	155	81.3 Å²	81.3	72%	0.724	44%	0.438	S	S	*	.	H	α-helix	trans	-61.7	-47.3	176.3	-176.2	173.1	-163.8	0	0	111.2	M32 F36 S37 E38	M32-E34 VanDerWaalsContact C-N 3.3Å; M32-E34 PolarHBondContact O-N 2.66Å; E34-F36 PolarHBondContact O-N 3.01Å; E34-S37 WeakPolarHBondContact O-CB 3.12Å; E34-S37 PolarHBondContact O-N 2.89Å; E34-E38 WeakPolarHBondContact O-CG 3.44Å; E34-E38 PolarHBondContact O-N 3.04Å
35	F	86.4	Confident	79.8	Confident	7 Å²	7	75.6 Å²	75.6	3%	0.031	41%	0.409	C	S	.	.	H	α-helix	trans	-61.3	-46	177.2	174.8	-107.5	0	0	0	111.8	M32 S37 E38 I39 M98 I115 R116 Q119	M32-F35 HydrophobicContact CB-CB 4.21Å; M32-F35 HydrophobicContact CB-CD1 4.46Å; M32-F35 HydrophobicContact CE-CD1 4.25Å; M32-F35 WeakPolarHBondContact O-CB 3.28Å; M32-F35 PolarHBondContact O-N 2.99Å; M32-F35 HydrophobicContact SD-CB 4.47Å; M32-F35 HydrophobicContact SD-CD1 3.69Å; M32-F35 HydrophobicContact SD-CE1 4.34Å; M32-F35 HydrophobicContact SD-CG 4.29Å; F35-S37 VanDerWaalsContact C-N 3.29Å; F35-S37 PolarHBondContact O-N 3.01Å; F35-E38 WeakPolarHBondContact O-CB 3.43Å; F35-E38 PolarHBondContact O-N 3.22Å; F35-I39 HydrophobicContact CD1-CG1 4.21Å; F35-I39 HydrophobicContact CD2-CG1 4.34Å; F35-I39 HydrophobicContact CE1-CD1 4.25Å; F35-I39 HydrophobicContact CE1-CG1 3.73Å; F35-I39 HydrophobicContact CE2-CD1 3.84Å; F35-I39 HydrophobicContact CE2-CG1 3.88Å; F35-I39 HydrophobicContact CG-CG1 4.49Å; F35-I39 HydrophobicContact CZ-CD1 3.57Å; F35-I39 HydrophobicContact CZ-CG1 3.53Å; F35-I39 VanDerWaalsContact O-CG1 3.3Å; F35-I39 WeakPolarHBondContact O-CG1 3.34Å; F35-I39 PolarHBondContact O-N 3.39Å; F35-M98 HydrophobicContact CE2-CG 4.29Å; F35-M98 HydrophobicContact CE2-SD 4.14Å; F35-I115 HydrophobicContact CE1-CG2 4.28Å; F35-R116 HydrophobicContact CD1-CG 4.22Å; F35-R116 HydrophobicContact CD2-CG 4.18Å; F35-R116 HydrophobicContact CE1-CB 4.5Å; F35-R116 HydrophobicContact CE1-CG 3.94Å; F35-R116 HydrophobicContact CE2-CB 4.27Å; F35-R116 HydrophobicContact CE2-CG 3.89Å; F35-R116 HydrophobicContact CG-CG 4.34Å; F35-R116 HydrophobicContact CZ-CB 4.01Å; F35-R116 HydrophobicContact CZ-CG 3.77Å; F35-Q119 HydrophobicContact CE1-CB 4.21Å; F35-Q119 HydrophobicContact CE1-CG 4.19Å; F35-Q119 HydrophobicContact CZ-CB 3.92Å; F35-Q119 HydrophobicContact CZ-CG 4.42Å
36	F	90.1	Very high	82.4	Confident	79 Å²	79	71.6 Å²	71.6	35%	0.346	38%	0.376	S	S	.	.	H	α-helix	trans	-65.9	-33.4	177.7	-70.7	-53.6	0	0	0	112.5	F31 M32 D33 E34 I39 E40 I115	F31-F36 HydrophobicContact CD1-CE2 4.3Å; F31-F36 HydrophobicContact CE1-CE2 4.43Å; M32-F36 HydrophobicContact CB-CD2 3.76Å; M32-F36 HydrophobicContact CB-CE2 3.57Å; M32-F36 HydrophobicContact CB-CZ 4.29Å; M32-F36 HydrophobicContact CE-CE1 4.15Å; M32-F36 HydrophobicContact CE-CE2 3.82Å; M32-F36 HydrophobicContact CE-CZ 3.44Å; M32-F36 VanDerWaalsContact CE-CZ 3.44Å; M32-F36 VanDerWaalsContact O-CD2 3.25Å; M32-F36 WeakPolarHBondContact O-CD2 3.41Å; M32-F36 PolarHBondContact O-N 3.28Å; D33-F36 PolarHBondContact O-N 3.28Å; E34-F36 PolarHBondContact O-N 3.01Å; F36-I39 PolarHBondContact O-N 3.01Å; F36-E40 WeakPolarHBondContact O-CB 3.44Å; F36-E40 PolarHBondContact O-N 2.97Å; F36-I115 HydrophobicContact CE1-CG2 4.1Å; F36-I115 HydrophobicContact CZ-CG2 4.2Å
37	S	91.6	Very high	84.6	Confident	77 Å²	77	68.1 Å²	68.1	54%	0.538	36%	0.359	S	S	.	.	H	α-helix	trans	-62.3	-44.3	171.5	-168.6	0	0	0	0	111.3	D33 E34 F35 E40 E41	D33-S37 WeakPolarHBondContact O-CB 3.47Å; D33-S37 PolarHBondContact O-N 3.48Å; E34-S37 WeakPolarHBondContact O-CB 3.12Å; E34-S37 PolarHBondContact O-N 2.89Å; F35-S37 VanDerWaalsContact C-N 3.29Å; F35-S37 PolarHBondContact O-N 3.01Å; S37-E40 PolarHBondContact O-N 3.34Å; S37-E41 WeakPolarHBondContact O-CB 3.46Å; S37-E41 PolarHBondContact O-N 3.42Å
38	E	91.5	Very high	87	Confident	48 Å²	48	65.8 Å²	65.8	22%	0.224	34%	0.341	C	S	.	.	H	α-helix	trans	-64	-41	175.6	-68.9	-172.9	155.4	0	0	113	E34 F35 E40 E41 T42	E34-E38 WeakPolarHBondContact O-CG 3.44Å; E34-E38 PolarHBondContact O-N 3.04Å; F35-E38 WeakPolarHBondContact O-CB 3.43Å; F35-E38 PolarHBondContact O-N 3.22Å; E38-E40 VanDerWaalsContact C-N 3.35Å; E38-E41 PolarHBondContact O-N 2.74Å; E38-T42 WeakPolarHBondContact O-CB 3.19Å; E38-T42 PolarHBondContact O-N 3.43Å; E38-T42 PolarHBondContact O-OG1 3.06Å
39	I	92.6	Very high	88.8	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-61	-45.4	175.3	-69.9	-60.2	0	0	0	110.8	F35 F36 T42 R43 M98 Q119 L123	F35-I39 HydrophobicContact CD1-CG1 4.21Å; F35-I39 HydrophobicContact CD2-CG1 4.34Å; F35-I39 HydrophobicContact CE1-CD1 4.25Å; F35-I39 HydrophobicContact CE1-CG1 3.73Å; F35-I39 HydrophobicContact CE2-CD1 3.84Å; F35-I39 HydrophobicContact CE2-CG1 3.88Å; F35-I39 HydrophobicContact CG-CG1 4.49Å; F35-I39 HydrophobicContact CZ-CD1 3.57Å; F35-I39 HydrophobicContact CZ-CG1 3.53Å; F35-I39 VanDerWaalsContact O-CG1 3.3Å; F35-I39 WeakPolarHBondContact O-CG1 3.34Å; F35-I39 PolarHBondContact O-N 3.39Å; F36-I39 PolarHBondContact O-N 3.01Å; I39-T42 PolarHBondContact O-N 3Å; I39-R43 WeakPolarHBondContact O-CB 3.43Å; I39-R43 PolarHBondContact O-N 3.36Å; I39-M98 HydrophobicContact CD1-CE 4.27Å; I39-M98 HydrophobicContact CD1-SD 3.39Å; I39-M98 WeakPolarHBondContact CD1-SD 3.42Å; I39-Q119 HydrophobicContact CD1-CB 3.69Å; I39-Q119 HydrophobicContact CG1-CB 4.17Å; I39-L123 HydrophobicContact CB-CD1 4.47Å; I39-L123 HydrophobicContact CD1-CD1 3.34Å; I39-L123 HydrophobicContact CD1-CG 4.46Å; I39-L123 HydrophobicContact CG1-CD1 4.47Å; I39-L123 HydrophobicContact CG2-CD1 4.19Å
40	E	93.8	Very high	90.9	Very high	77 Å²	77	56.6 Å²	56.6	36%	0.36	29%	0.291	S	S	.	.	H	α-helix	trans	-68.1	-42.6	-179.5	-171.7	57.8	-158.5	0	0	111.4	F36 S37 E38 T42 R43 L44	F36-E40 WeakPolarHBondContact O-CB 3.44Å; F36-E40 PolarHBondContact O-N 2.97Å; S37-E40 PolarHBondContact O-N 3.34Å; E38-E40 VanDerWaalsContact C-N 3.35Å; E40-T42 VanDerWaalsContact C-N 3.29Å; E40-T42 PolarHBondContact O-N 2.96Å; E40-R43 PolarHBondContact O-N 3.18Å; E40-R43 IonicContact OE2-CZ 2.72Å; E40-R43 IonicContact OE2-NH1 2.8Å; E40-R43 PolarHBondContact OE2-NH1 3.17Å; E40-L44 HydrophobicContact CG-CD1 4.22Å; E40-L44 HydrophobicContact CG-CG 4.48Å; E40-L44 WeakPolarHBondContact O-CB 3.02Å; E40-L44 VanDerWaalsContact O-CG 3.25Å; E40-L44 WeakPolarHBondContact O-CG 2.75Å; E40-L44 PolarHBondContact O-N 3.29Å
41	E	94.7	Very high	92.2	Very high	79 Å²	79	59.6 Å²	59.6	37%	0.369	29%	0.292	S	S	.	.	H	α-helix	trans	-59.5	-42.2	173.7	-169.7	-171.5	157	0	0	111.6	S37 E38 L44 N45 K94	S37-E41 WeakPolarHBondContact O-CB 3.46Å; S37-E41 PolarHBondContact O-N 3.42Å; E38-E41 PolarHBondContact O-N 2.74Å; E41-L44 PolarHBondContact O-N 3.29Å; E41-N45 PolarHBondContact O-N 2.95Å; E41-N45 PolarHBondContact O-ND2 3.1Å; E41-K94 VanDerWaalsContact CD-NZ 3.32Å; E41-K94 IonicContact OE1-NZ 2.71Å; E41-K94 WeakPolarHBondContact OE2-CE 3.46Å; E41-K94 IonicContact OE2-NZ 2.95Å; E41-K94 PolarHBondContact OE2-NZ 2.85Å
42	T	95.9	Very high	93.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.9	-45.5	178.2	-54	0	0	0	0	110.8	E38 I39 E40 L44 N45 I46 V91 M98 L123	E38-T42 WeakPolarHBondContact O-CB 3.19Å; E38-T42 PolarHBondContact O-N 3.43Å; E38-T42 PolarHBondContact O-OG1 3.06Å; I39-T42 PolarHBondContact O-N 3Å; E40-T42 VanDerWaalsContact C-N 3.29Å; E40-T42 PolarHBondContact O-N 2.96Å; T42-L44 PolarHBondContact O-N 3.23Å; T42-N45 PolarHBondContact O-N 3.07Å; T42-I46 HydrophobicContact CG2-CD1 4.2Å; T42-I46 WeakPolarHBondContact O-CG1 3.43Å; T42-I46 PolarHBondContact O-N 3.34Å; T42-V91 HydrophobicContact CG2-CG1 3.94Å; T42-V91 HydrophobicContact CG2-CG2 4.38Å; T42-M98 HydrophobicContact CG2-CE 4.18Å; T42-L123 HydrophobicContact CG2-CD1 3.9Å
43	R	96.3	Very high	94.1	Very high	81 Å²	81	55 Å²	55	31%	0.306	27%	0.274	S	S	.	.	H	α-helix	trans	-58.1	-48.5	176.2	-179.1	-177.6	-67.4	147.1	-2.6	111.5	I39 E40 N45 I46 D47 L123	I39-R43 WeakPolarHBondContact O-CB 3.43Å; I39-R43 PolarHBondContact O-N 3.36Å; E40-R43 PolarHBondContact O-N 3.18Å; E40-R43 IonicContact OE2-CZ 2.72Å; E40-R43 IonicContact OE2-NH1 2.8Å; E40-R43 PolarHBondContact OE2-NH1 3.17Å; R43-N45 VanDerWaalsContact C-N 3.3Å; R43-N45 PolarHBondContact O-N 3.05Å; R43-I46 PolarHBondContact O-N 3.24Å; R43-I46 VanDerWaalsContact O-N 3.14Å; R43-D47 PolarHBondContact O-N 2.69Å; R43-L123 HydrophobicContact CB-CD2 4.07Å
44	L	97	Very high	94.6	Very high	79 Å²	79	54.5 Å²	54.5	41%	0.414	27%	0.268	S	S	.	.	H	α-helix	trans	-61.7	-37.4	178.8	-72.3	171.8	0	0	0	112.2	E40 E41 T42 K48	E40-L44 HydrophobicContact CG-CD1 4.22Å; E40-L44 HydrophobicContact CG-CG 4.48Å; E40-L44 WeakPolarHBondContact O-CB 3.02Å; E40-L44 VanDerWaalsContact O-CG 3.25Å; E40-L44 WeakPolarHBondContact O-CG 2.75Å; E40-L44 PolarHBondContact O-N 3.29Å; E41-L44 PolarHBondContact O-N 3.29Å; T42-L44 PolarHBondContact O-N 3.23Å; L44-K48 WeakPolarHBondContact O-CB 3.12Å; L44-K48 VanDerWaalsContact O-CG 3.3Å; L44-K48 WeakPolarHBondContact O-CG 3.37Å; L44-K48 PolarHBondContact O-N 2.93Å
45	N	97.1	Very high	95.1	Very high	18 Å²	18	51.7 Å²	51.7	10%	0.096	26%	0.255	C	S	.	.	H	α-helix	trans	-67	-41.4	174.3	-80.7	-63.6	0	0	0	112	E41 T42 R43 D47 K48 I49 R87 V91	E41-N45 PolarHBondContact O-N 2.95Å; E41-N45 PolarHBondContact O-ND2 3.1Å; T42-N45 PolarHBondContact O-N 3.07Å; R43-N45 VanDerWaalsContact C-N 3.3Å; R43-N45 PolarHBondContact O-N 3.05Å; N45-D47 VanDerWaalsContact C-N 3.34Å; N45-D47 PolarHBondContact O-N 3.47Å; N45-K48 PolarHBondContact O-N 3.05Å; N45-I49 VanDerWaalsContact O-CG1 3.24Å; N45-I49 WeakPolarHBondContact O-CG1 3.33Å; N45-I49 PolarHBondContact O-N 3.04Å; N45-R87 PolarHBondContact OD1-NH1 3.08Å; N45-V91 HydrophobicContact CB-CG2 3.56Å
46	I	96.9	Very high	95.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.9	-44.1	175	-65.9	166	0	0	0	110.9	T42 R43 K48 I49 S50 V91 L123 K126 F127 V130	T42-I46 HydrophobicContact CG2-CD1 4.2Å; T42-I46 WeakPolarHBondContact O-CG1 3.43Å; T42-I46 PolarHBondContact O-N 3.34Å; R43-I46 PolarHBondContact O-N 3.24Å; R43-I46 VanDerWaalsContact O-N 3.14Å; I46-K48 PolarHBondContact O-N 3.12Å; I46-I49 PolarHBondContact O-N 2.98Å; I46-S50 PolarHBondContact O-N 2.89Å; I46-V91 HydrophobicContact CD1-CG1 4.08Å; I46-V91 HydrophobicContact CG1-CG1 3.85Å; I46-V91 HydrophobicContact CG1-CG2 3.92Å; I46-L123 HydrophobicContact CD1-CB 4.4Å; I46-L123 HydrophobicContact CD1-CD2 4.1Å; I46-K126 HydrophobicContact CG2-CB 4.49Å; I46-K126 HydrophobicContact CG2-CD 4.02Å; I46-K126 HydrophobicContact CG2-CG 3.86Å; I46-F127 HydrophobicContact CD1-CB 3.96Å; I46-F127 HydrophobicContact CG1-CB 4.23Å; I46-F127 HydrophobicContact CG1-CD2 4.27Å; I46-V130 HydrophobicContact CG2-CG2 3.94Å
47	D	97.5	Very high	95.8	Very high	70 Å²	70	50.9 Å²	50.9	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-63.7	-41.8	178.6	-71.1	-29.8	0	0	0	111.8	R43 N45 S50 E51 K126	R43-D47 PolarHBondContact O-N 2.69Å; N45-D47 VanDerWaalsContact C-N 3.34Å; N45-D47 PolarHBondContact O-N 3.47Å; D47-S50 WeakPolarHBondContact O-CB 3.34Å; D47-S50 PolarHBondContact O-N 2.92Å; D47-E51 PolarHBondContact O-N 3.02Å; D47-K126 WeakPolarHBondContact OD1-CE 3.39Å; D47-K126 IonicContact OD1-NZ 3.41Å; D47-K126 PolarHBondContact OD1-NZ 2.69Å; D47-K126 IonicContact OD2-NZ 2.91Å
48	K	97.6	Very high	96.1	Very high	96 Å²	96	53.8 Å²	53.8	42%	0.417	25%	0.254	S	S	.	.	H	α-helix	trans	-64.3	-38.6	174.2	-74.2	176.1	-177.8	177.3	0	112.9	L44 N45 I46 S50 E51 S52 R87	L44-K48 WeakPolarHBondContact O-CB 3.12Å; L44-K48 VanDerWaalsContact O-CG 3.3Å; L44-K48 WeakPolarHBondContact O-CG 3.37Å; L44-K48 PolarHBondContact O-N 2.93Å; N45-K48 PolarHBondContact O-N 3.05Å; I46-K48 PolarHBondContact O-N 3.12Å; K48-S50 VanDerWaalsContact C-N 3.31Å; K48-E51 PolarHBondContact O-N 3.31Å; K48-S52 PolarHBondContact O-N 3.48Å; K48-S52 PolarHBondContact O-OG 3.13Å; K48-S52 VanDerWaalsContact O-OG 3.14Å; K48-R87 VanDerWaalsContact CD-NH1 3.34Å
49	I	96.4	Very high	96.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-46.9	172.8	-65.9	161.9	0	0	0	109.1	N45 I46 E51 S52 V53 I84 R87 A88 V91 F127 V130 M131	N45-I49 VanDerWaalsContact O-CG1 3.24Å; N45-I49 WeakPolarHBondContact O-CG1 3.33Å; N45-I49 PolarHBondContact O-N 3.04Å; I46-I49 PolarHBondContact O-N 2.98Å; I49-E51 VanDerWaalsContact C-N 3.29Å; I49-E51 PolarHBondContact O-N 3.21Å; I49-S52 PolarHBondContact O-N 3.34Å; I49-V53 HydrophobicContact CG2-CG2 4.14Å; I49-V53 WeakPolarHBondContact O-CG2 3.01Å; I49-V53 PolarHBondContact O-N 3.44Å; I49-I84 HydrophobicContact CG2-CG2 4.09Å; I49-R87 HydrophobicContact CD1-CB 3.74Å; I49-R87 HydrophobicContact CG1-CB 3.46Å; I49-R87 VanDerWaalsContact CG1-CB 3.46Å; I49-R87 HydrophobicContact CG1-CG 4.44Å; I49-A88 HydrophobicContact CD1-CB 4.06Å; I49-V91 HydrophobicContact CD1-CG2 4.19Å; I49-F127 HydrophobicContact CD1-CE2 4.04Å; I49-V130 HydrophobicContact CB-CG1 4.1Å; I49-V130 HydrophobicContact CG2-CG1 3.56Å; I49-M131 HydrophobicContact CG2-SD 4.13Å
50	S	97.3	Very high	96.4	Very high	38 Å²	38	52.7 Å²	52.7	27%	0.266	25%	0.249	S	C	.	.	H	α-helix	trans	-58.1	-41.4	178.6	-168.5	0	0	0	0	112.2	I46 D47 K48 V53 E54	I46-S50 PolarHBondContact O-N 2.89Å; D47-S50 WeakPolarHBondContact O-CB 3.34Å; D47-S50 PolarHBondContact O-N 2.92Å; K48-S50 VanDerWaalsContact C-N 3.31Å; S50-V53 PolarHBondContact O-N 2.93Å; S50-E54 PolarHBondContact O-N 3.44Å
51	E	97.6	Very high	96.4	Very high	137 Å²	137	52.6 Å²	52.6	64%	0.64	26%	0.257	S	S	*	.	H	α-helix	trans	-63.5	-48.4	175.1	-176	177.4	-163.3	0	0	111.9	D47 K48 I49 V53 E54 E55	D47-E51 PolarHBondContact O-N 3.02Å; K48-E51 PolarHBondContact O-N 3.31Å; I49-E51 VanDerWaalsContact C-N 3.29Å; I49-E51 PolarHBondContact O-N 3.21Å; E51-V53 VanDerWaalsContact C-N 3.26Å; E51-V53 PolarHBondContact O-N 3.3Å; E51-E54 PolarHBondContact O-N 2.65Å; E51-E54 VanDerWaalsContact O-N 3.14Å; E51-E55 PolarHBondContact O-N 3.02Å
52	S	96.8	Very high	96.4	Very high	15 Å²	15	52.9 Å²	52.9	11%	0.105	26%	0.26	C	S	.	.	H	α-helix	trans	-61.4	-33.2	177.2	-62.5	0	0	0	0	112.8	K48 I49 E55 A56	K48-S52 PolarHBondContact O-N 3.48Å; K48-S52 PolarHBondContact O-OG 3.13Å; K48-S52 VanDerWaalsContact O-OG 3.14Å; I49-S52 PolarHBondContact O-N 3.34Å; S52-E55 PolarHBondContact O-N 2.92Å; S52-A56 WeakPolarHBondContact O-CB 3.18Å; S52-A56 PolarHBondContact O-N 2.91Å
53	V	96	Very high	96.3	Very high	2 Å²	2	53 Å²	53	1%	0.012	26%	0.261	C	S	.	.	H	α-helix	trans	-65.8	-42.8	174.8	168.8	0	0	0	0	111.1	I49 S50 E51 E55 A56 K57 I84 Y134	I49-V53 HydrophobicContact CG2-CG2 4.14Å; I49-V53 WeakPolarHBondContact O-CG2 3.01Å; I49-V53 PolarHBondContact O-N 3.44Å; S50-V53 PolarHBondContact O-N 2.93Å; E51-V53 VanDerWaalsContact C-N 3.26Å; E51-V53 PolarHBondContact O-N 3.3Å; V53-E55 VanDerWaalsContact C-N 3.31Å; V53-E55 PolarHBondContact O-N 3.38Å; V53-A56 PolarHBondContact O-N 2.96Å; V53-K57 WeakPolarHBondContact O-CG 3.4Å; V53-K57 PolarHBondContact O-N 3.06Å; V53-I84 HydrophobicContact CG2-CD1 4.05Å; V53-Y134 HydrophobicContact CB-CD2 4.47Å; V53-Y134 HydrophobicContact CG1-CD2 4.23Å; V53-Y134 HydrophobicContact CG2-CD2 3.78Å; V53-Y134 HydrophobicContact CG2-CG 3.76Å
54	E	96.9	Very high	96.1	Very high	83 Å²	83	49.9 Å²	49.9	39%	0.388	25%	0.25	S	C	.	.	H	α-helix	trans	-66.9	-33.9	175.5	-68	-55.1	131.8	0	0	112.2	S50 E51 K57 K58	S50-E54 PolarHBondContact O-N 3.44Å; E51-E54 PolarHBondContact O-N 2.65Å; E51-E54 VanDerWaalsContact O-N 3.14Å; E54-K57 IonicContact OE1-NZ 3.19Å; E54-K57 PolarHBondContact OE1-NZ 3.27Å; E54-K57 IonicContact OE2-NZ 3.34Å; E54-K58 WeakPolarHBondContact O-CG 3.44Å; E54-K58 PolarHBondContact O-N 3.26Å
55	E	96.9	Very high	95.8	Very high	96 Å²	96	50.2 Å²	50.2	45%	0.449	26%	0.259	S	S	.	.	H	α-helix	trans	-68.8	-42.9	172.6	-164.3	175.5	-168.8	0	0	112.1	E51 S52 V53 K57 K58 L59 L80	E51-E55 PolarHBondContact O-N 3.02Å; S52-E55 PolarHBondContact O-N 2.92Å; V53-E55 VanDerWaalsContact C-N 3.31Å; V53-E55 PolarHBondContact O-N 3.38Å; E55-K57 VanDerWaalsContact C-N 3.3Å; E55-K57 PolarHBondContact O-N 3.44Å; E55-K58 WeakPolarHBondContact O-CB 3.48Å; E55-K58 PolarHBondContact O-N 3.04Å; E55-L59 PolarHBondContact O-N 2.94Å; E55-L80 HydrophobicContact CB-CD1 3.81Å; E55-L80 HydrophobicContact CG-CD1 3.67Å; E55-L80 WeakPolarHBondContact OE2-CD2 3.42Å
56	A	96.1	Very high	95.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.3	-41.5	175	0	0	0	0	0	111.6	S52 V53 K58 L59 Y60 L77 L80 Y134	S52-A56 WeakPolarHBondContact O-CB 3.18Å; S52-A56 PolarHBondContact O-N 2.91Å; V53-A56 PolarHBondContact O-N 2.96Å; A56-K58 VanDerWaalsContact C-N 3.31Å; A56-K58 PolarHBondContact O-N 2.9Å; A56-L59 PolarHBondContact O-N 3.49Å; A56-Y60 HydrophobicContact CB-CE2 4.33Å; A56-Y60 WeakPolarHBondContact O-CD2 3.39Å; A56-Y60 VanDerWaalsContact O-CG 3.28Å; A56-Y60 PolarHBondContact O-N 2.98Å; A56-L77 HydrophobicContact CB-CD1 4.18Å; A56-L80 HydrophobicContact CB-CD1 4.42Å; A56-Y134 HydrophobicContact CB-CE2 4.49Å
57	K	96.1	Very high	94.7	Very high	68 Å²	68	54.1 Å²	54.1	30%	0.296	29%	0.288	S	S	.	.	H	α-helix	trans	-57.3	-41	173.1	-74.9	173.6	-176.7	172.4	0	112.8	V53 E54 E55 Y60 S61 A137	V53-K57 WeakPolarHBondContact O-CG 3.4Å; V53-K57 PolarHBondContact O-N 3.06Å; E54-K57 IonicContact OE1-NZ 3.19Å; E54-K57 PolarHBondContact OE1-NZ 3.27Å; E54-K57 IonicContact OE2-NZ 3.34Å; E55-K57 VanDerWaalsContact C-N 3.3Å; E55-K57 PolarHBondContact O-N 3.44Å; K57-Y60 PolarHBondContact O-N 3.07Å; K57-S61 PolarHBondContact O-N 3.46Å; K57-A137 HydrophobicContact CD-CB 4.29Å; K57-A137 HydrophobicContact CG-CB 3.69Å
58	K	96.1	Very high	93.9	Very high	139 Å²	139	56.4 Å²	56.4	60%	0.604	30%	0.299	S	S	*	.	H	α-helix	trans	-64.8	-45.2	176.2	-66.2	170.1	-173.2	169.6	0	110.8	E54 E55 A56 S61 I62	E54-K58 WeakPolarHBondContact O-CG 3.44Å; E54-K58 PolarHBondContact O-N 3.26Å; E55-K58 WeakPolarHBondContact O-CB 3.48Å; E55-K58 PolarHBondContact O-N 3.04Å; A56-K58 VanDerWaalsContact C-N 3.31Å; A56-K58 PolarHBondContact O-N 2.9Å; K58-S61 WeakPolarHBondContact O-CB 3.49Å; K58-S61 PolarHBondContact O-N 2.92Å; K58-I62 WeakPolarHBondContact O-CG1 3.48Å; K58-I62 PolarHBondContact O-N 3.47Å
59	L	95.5	Very high	93.4	Very high	17 Å²	17	52.6 Å²	52.6	9%	0.089	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-42.5	177	-62.8	-176.6	0	0	0	111.9	E55 A56 S61 I62 I63 T73 D76 L77 L80	E55-L59 PolarHBondContact O-N 2.94Å; A56-L59 PolarHBondContact O-N 3.49Å; L59-S61 VanDerWaalsContact C-N 3.3Å; L59-S61 PolarHBondContact O-N 3.34Å; L59-I62 HydrophobicContact CD2-CD1 4.4Å; L59-I62 PolarHBondContact O-N 3.08Å; L59-I62 VanDerWaalsContact O-N 3.15Å; L59-I63 WeakPolarHBondContact O-CB 3.2Å; L59-I63 WeakPolarHBondContact O-CG1 3.29Å; L59-I63 PolarHBondContact O-N 3.41Å; L59-T73 HydrophobicContact CB-CG2 4.49Å; L59-T73 HydrophobicContact CD2-CG2 3.88Å; L59-D76 HydrophobicContact CD1-CB 3.87Å; L59-L77 HydrophobicContact CB-CB 4.41Å; L59-L77 HydrophobicContact CB-CD1 4.42Å; L59-L77 HydrophobicContact CD1-CB 3.9Å; L59-L80 HydrophobicContact CD1-CD1 3.62Å; L59-L80 HydrophobicContact CG-CD1 4.47Å
60	Y	95.3	Very high	93	Very high	11 Å²	11	58.9 Å²	58.9	4%	0.043	31%	0.314	C	S	.	.	H	α-helix	trans	-54.1	-46.5	172.1	-69.2	-32.5	0	0	0	111.7	A56 K57 I62 I63 L64 L77 A137 F141 L204	A56-Y60 HydrophobicContact CB-CE2 4.33Å; A56-Y60 WeakPolarHBondContact O-CD2 3.39Å; A56-Y60 VanDerWaalsContact O-CG 3.28Å; A56-Y60 PolarHBondContact O-N 2.98Å; K57-Y60 PolarHBondContact O-N 3.07Å; Y60-I62 PolarHBondContact O-N 2.96Å; Y60-I63 PolarHBondContact O-N 3.03Å; Y60-L64 WeakPolarHBondContact O-CB 3.45Å; Y60-L64 VanDerWaalsContact O-CG 3.3Å; Y60-L64 WeakPolarHBondContact O-CG 3.38Å; Y60-L64 PolarHBondContact O-N 3.1Å; Y60-L77 HydrophobicContact CD1-CD1 4.02Å; Y60-L77 HydrophobicContact CD1-CD2 3.87Å; Y60-L77 HydrophobicContact CE1-CD1 3.48Å; Y60-L77 VanDerWaalsContact CE1-CD1 3.48Å; Y60-L77 HydrophobicContact CE1-CD2 3.57Å; Y60-L77 HydrophobicContact CE1-CG 4.13Å; Y60-A137 HydrophobicContact CE2-CB 4.33Å; Y60-F141 HydrophobicContact CD1-CB 4.03Å; Y60-F141 AromaticContact CD1-CD1 3.76Å; Y60-F141 HydrophobicContact CD1-CD1 3.76Å; Y60-F141 AromaticContact CD1-CD2 3.54Å; Y60-F141 HydrophobicContact CD1-CD2 3.54Å; Y60-F141 HydrophobicContact CD1-CE1 4.09Å; Y60-F141 AromaticContact CD1-CE2 3.86Å; Y60-F141 HydrophobicContact CD1-CE2 3.86Å; Y60-F141 AromaticContact CD1-CG 3.48Å; Y60-F141 HydrophobicContact CD1-CG 3.48Å; Y60-F141 VanDerWaalsContact CD1-CG 3.48Å; Y60-F141 HydrophobicContact CD1-CZ 4.14Å; Y60-F141 HydrophobicContact CD2-CB 4Å; Y60-F141 HydrophobicContact CD2-CG 4.36Å; Y60-F141 HydrophobicContact CE1-CB 4.4Å; Y60-F141 AromaticContact CE1-CD1 3.86Å; Y60-F141 HydrophobicContact CE1-CD1 3.86Å; Y60-F141 HydrophobicContact CE1-CD2 4.44Å; Y60-F141 HydrophobicContact CE1-CE1 4.25Å; Y60-F141 AromaticContact CE1-CG 3.98Å; Y60-F141 HydrophobicContact CE1-CG 3.98Å; Y60-F141 HydrophobicContact CE2-CB 4.41Å; Y60-F141 HydrophobicContact CG-CB 3.84Å; Y60-F141 HydrophobicContact CG-CD1 4.43Å; Y60-F141 AromaticContact CG-CD2 3.69Å; Y60-F141 HydrophobicContact CG-CD2 3.69Å; Y60-F141 HydrophobicContact CG-CE2 4.36Å; Y60-F141 AromaticContact CG-CG 3.73Å; Y60-F141 HydrophobicContact CG-CG 3.73Å; Y60-L204 HydrophobicContact CE1-CD1 4.46Å
61	S	94.6	Very high	92.6	Very high	76 Å²	76	61.8 Å²	61.8	53%	0.531	33%	0.331	S	S	.	.	H	α-helix	trans	-62.8	-42.1	177.2	-172.1	0	0	0	0	112.6	K57 K58 L59 L64 S65	K57-S61 PolarHBondContact O-N 3.46Å; K58-S61 WeakPolarHBondContact O-CB 3.49Å; K58-S61 PolarHBondContact O-N 2.92Å; L59-S61 VanDerWaalsContact C-N 3.3Å; L59-S61 PolarHBondContact O-N 3.34Å; S61-L64 PolarHBondContact O-N 2.85Å; S61-S65 WeakPolarHBondContact O-CB 3.23Å; S61-S65 PolarHBondContact O-N 3.41Å; S61-S65 VanDerWaalsContact O-N 3.1Å
62	I	94.1	Very high	92.4	Very high	85 Å²	85	61.8 Å²	61.8	44%	0.436	33%	0.329	S	S	.	.	H	α-helix	trans	-64.2	-47.3	177.8	-67.1	165.4	0	0	0	109.9	K58 L59 Y60 L64 S65 T73	K58-I62 WeakPolarHBondContact O-CG1 3.48Å; K58-I62 PolarHBondContact O-N 3.47Å; L59-I62 HydrophobicContact CD2-CD1 4.4Å; L59-I62 PolarHBondContact O-N 3.08Å; L59-I62 VanDerWaalsContact O-N 3.15Å; Y60-I62 PolarHBondContact O-N 2.96Å; I62-L64 VanDerWaalsContact C-N 3.28Å; I62-L64 PolarHBondContact O-N 3.26Å; I62-S65 WeakPolarHBondContact O-CB 3.29Å; I62-S65 PolarHBondContact O-N 3.1Å; I62-S65 PolarHBondContact O-OG 3.48Å; I62-T73 HydrophobicContact CB-CG2 4.25Å; I62-T73 HydrophobicContact CG2-CG2 3.87Å
63	I	93.3	Very high	92.2	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-59	-39.4	178.6	-71.3	170.1	0	0	0	111.2	L59 Y60 S65 P69 T73 L77 F141 R197	L59-I63 WeakPolarHBondContact O-CB 3.2Å; L59-I63 WeakPolarHBondContact O-CG1 3.29Å; L59-I63 PolarHBondContact O-N 3.41Å; Y60-I63 PolarHBondContact O-N 3.03Å; I63-S65 VanDerWaalsContact C-N 3.33Å; I63-P69 HydrophobicContact CB-CG 4.41Å; I63-P69 HydrophobicContact CG1-CB 4.34Å; I63-P69 HydrophobicContact CG2-CB 4.5Å; I63-P69 HydrophobicContact CG2-CG 3.9Å; I63-T73 HydrophobicContact CD1-CG2 4.22Å; I63-T73 HydrophobicContact CG1-CG2 3.72Å; I63-L77 HydrophobicContact CD1-CB 4.34Å; I63-L77 HydrophobicContact CD1-CD2 3.56Å; I63-F141 HydrophobicContact CB-CE2 4.29Å; I63-F141 HydrophobicContact CG2-CE2 3.85Å; I63-F141 HydrophobicContact CG2-CZ 3.87Å; I63-R197 PolarHBondContact O-NH1 2.92Å; I63-R197 PolarHBondContact O-NH2 3.32Å
64	L	91.9	Very high	91.9	Very high	16 Å²	16	63.4 Å²	63.4	8%	0.084	34%	0.336	C	S	.	.	H	α-helix	trans	-76.9	-15.4	177.2	-71.5	171.8	0	0	0	114.2	Y60 S61 I62 F141 R144 R148	Y60-L64 WeakPolarHBondContact O-CB 3.45Å; Y60-L64 VanDerWaalsContact O-CG 3.3Å; Y60-L64 WeakPolarHBondContact O-CG 3.38Å; Y60-L64 PolarHBondContact O-N 3.1Å; S61-L64 PolarHBondContact O-N 2.85Å; I62-L64 VanDerWaalsContact C-N 3.28Å; I62-L64 PolarHBondContact O-N 3.26Å; L64-F141 HydrophobicContact CD1-CD2 3.74Å; L64-F141 HydrophobicContact CD1-CE2 4.22Å; L64-F141 HydrophobicContact CD2-CD2 4.19Å; L64-F141 HydrophobicContact CD2-CE2 3.99Å; L64-F141 HydrophobicContact CG-CD2 3.81Å; L64-F141 HydrophobicContact CG-CE2 3.74Å; L64-R144 HydrophobicContact CD1-CB 3.63Å; L64-R144 HydrophobicContact CD1-CG 4.27Å; L64-R144 HydrophobicContact CD2-CB 4.06Å; L64-R148 PolarHBondContact O-NH2 2.75Å
65	S	91.6	Very high	91.7	Very high	86 Å²	86	64 Å²	64	60%	0.601	34%	0.341	S	S	*	.	H	α-helix	trans	-82.6	-23.6	-178.7	75.1	0	0	0	0	113.3	S61 I62 I63	S61-S65 WeakPolarHBondContact O-CB 3.23Å; S61-S65 PolarHBondContact O-N 3.41Å; S61-S65 VanDerWaalsContact O-N 3.1Å; I62-S65 WeakPolarHBondContact O-CB 3.29Å; I62-S65 PolarHBondContact O-N 3.1Å; I62-S65 PolarHBondContact O-OG 3.48Å; I63-S65 VanDerWaalsContact C-N 3.33Å
66	A	88	Confident	91.6	Very high	31 Å²	31	62.2 Å²	62.2	26%	0.256	34%	0.335	S	S	.	.	S	Bend	trans	-109.7	137	-178.7	0	0	0	0	0	111.7	I68	A66-I68 VanDerWaalsContact C-N 3.26Å; A66-I68 PolarHBondContact O-N 2.83Å
67	P	82.4	Confident	91.5	Very high	70 Å²	70	63.2 Å²	63.2	46%	0.455	34%	0.34	S	S	.	.	S	Bend	trans	-56.7	-40.6	171	-27.1	36.2	0	0	0	112.6	E193	P67-E193 WeakPolarHBondContact CB-OE2 3.44Å; P67-E193 WeakPolarHBondContact O-CG 3.47Å
68	I	82.3	Confident	91.4	Very high	117 Å²	117	63.6 Å²	63.6	60%	0.6	34%	0.343	S	S	*	.	S	Bend	trans	-128.7	99.9	176.6	-55	173.6	0	0	0	106.7	A66	A66-I68 VanDerWaalsContact C-N 3.26Å; A66-I68 PolarHBondContact O-N 2.83Å
69	P	85.4	Confident	91.3	Very high	16 Å²	16	63 Å²	63	10%	0.104	34%	0.342	C	S	.	.			trans	-65.7	153.2	177.9	-13.6	24.2	0	0	0	111.7	I63	I63-P69 HydrophobicContact CB-CG 4.41Å; I63-P69 HydrophobicContact CG1-CB 4.34Å; I63-P69 HydrophobicContact CG2-CB 4.5Å; I63-P69 HydrophobicContact CG2-CG 3.9Å
70	E	89.2	Confident	91.2	Very high	133 Å²	133	63 Å²	63	62%	0.621	34%	0.343	S	S	*	.			trans	-62.8	138.4	172.1	-65.2	-167.1	170.3	0	0	110.8	K72 T73	E70-K72 PolarHBondContact O-N 3.07Å; E70-T73 PolarHBondContact O-N 3.26Å; E70-T73 VanDerWaalsContact O-N 3.12Å
71	P	89.2	Confident	91.1	Very high	98 Å²	98	64 Å²	64	64%	0.636	35%	0.349	S	S	*	.	H	α-helix	trans	-53.1	-40	177.1	-27	34.4	0	0	0	112.4	T73 K74 D75	P71-T73 VanDerWaalsContact C-N 3.34Å; P71-T73 PolarHBondContact O-N 2.9Å; P71-K74 WeakPolarHBondContact O-CB 3.41Å; P71-K74 PolarHBondContact O-N 3.4Å; P71-D75 PolarHBondContact O-N 3.07Å
72	K	92.1	Very high	91	Very high	137 Å²	137	64.6 Å²	64.6	60%	0.596	35%	0.35	S	S	*	.	H	α-helix	trans	-57.3	-43	179.1	-174.3	178	177.4	-175.4	0	113	E70 K74 D75 D76	E70-K72 PolarHBondContact O-N 3.07Å; K72-K74 PolarHBondContact O-N 3.22Å; K72-D75 PolarHBondContact O-N 3.4Å; K72-D76 WeakPolarHBondContact O-CB 3.45Å; K72-D76 PolarHBondContact O-N 2.93Å
73	T	92.8	Very high	91	Very high	17 Å²	17	63.1 Å²	63.1	10%	0.104	34%	0.342	C	S	.	.	H	α-helix	trans	-63.7	-33.7	178.5	-48.3	0	0	0	0	111.8	L59 I62 I63 E70 P71 L77	L59-T73 HydrophobicContact CB-CG2 4.49Å; L59-T73 HydrophobicContact CD2-CG2 3.88Å; I62-T73 HydrophobicContact CB-CG2 4.25Å; I62-T73 HydrophobicContact CG2-CG2 3.87Å; I63-T73 HydrophobicContact CD1-CG2 4.22Å; I63-T73 HydrophobicContact CG1-CG2 3.72Å; E70-T73 PolarHBondContact O-N 3.26Å; E70-T73 VanDerWaalsContact O-N 3.12Å; P71-T73 VanDerWaalsContact C-N 3.34Å; P71-T73 PolarHBondContact O-N 2.9Å; T73-L77 PolarHBondContact O-N 3.23Å
74	K	89.9	Confident	91.1	Very high	34 Å²	34	63.1 Å²	63.1	15%	0.148	34%	0.341	C	S	.	.	H	α-helix	trans	-71.3	-41.3	175	-63.7	-166.3	174.4	-153.7	0	111.3	P71 K72 L77 E78 D200	P71-K74 WeakPolarHBondContact O-CB 3.41Å; P71-K74 PolarHBondContact O-N 3.4Å; K72-K74 PolarHBondContact O-N 3.22Å; K74-L77 PolarHBondContact O-N 3.4Å; K74-E78 WeakPolarHBondContact O-CG 3.31Å; K74-E78 PolarHBondContact O-N 3.37Å; K74-D200 WeakPolarHBondContact CE-OD1 3.49Å; K74-D200 VanDerWaalsContact NZ-CG 3.3Å; K74-D200 IonicContact NZ-OD1 2.96Å; K74-D200 PolarHBondContact NZ-OD1 3.5Å; K74-D200 IonicContact NZ-OD2 3.66Å; K74-D200 PolarHBondContact NZ-OD2 3.14Å; K74-D200 VanDerWaalsContact NZ-OD2 3.08Å
75	D	93.1	Very high	91.1	Very high	95 Å²	95	65.9 Å²	65.9	51%	0.508	35%	0.353	S	S	.	.	H	α-helix	trans	-63.2	-43.8	176.8	-62.3	-18.7	0	0	0	111.2	P71 K72 L77 E78 Q79	P71-D75 PolarHBondContact O-N 3.07Å; K72-D75 PolarHBondContact O-N 3.4Å; D75-L77 VanDerWaalsContact C-N 3.3Å; D75-L77 PolarHBondContact O-N 2.94Å; D75-E78 PolarHBondContact O-N 3.26Å; D75-Q79 PolarHBondContact O-N 2.99Å
76	D	94.8	Very high	91.2	Very high	59 Å²	59	68.5 Å²	68.5	32%	0.316	35%	0.354	S	S	.	.	H	α-helix	trans	-59.7	-40.4	175.8	-66.3	-22.2	0	0	0	111	L59 K72 Q79 L80	L59-D76 HydrophobicContact CD1-CB 3.87Å; K72-D76 WeakPolarHBondContact O-CB 3.45Å; K72-D76 PolarHBondContact O-N 2.93Å; D76-Q79 PolarHBondContact O-N 3.47Å; D76-L80 WeakPolarHBondContact O-CG 3.46Å; D76-L80 PolarHBondContact O-N 2.9Å
77	L	94.6	Very high	91.5	Very high	22 Å²	22	69.6 Å²	69.6	12%	0.115	35%	0.351	C	S	.	.	H	α-helix	trans	-67.5	-41.4	176.6	175.4	65.7	0	0	0	112.4	A56 L59 Y60 I63 T73 K74 D75 Q79 L80 T81	A56-L77 HydrophobicContact CB-CD1 4.18Å; L59-L77 HydrophobicContact CB-CB 4.41Å; L59-L77 HydrophobicContact CB-CD1 4.42Å; L59-L77 HydrophobicContact CD1-CB 3.9Å; Y60-L77 HydrophobicContact CD1-CD1 4.02Å; Y60-L77 HydrophobicContact CD1-CD2 3.87Å; Y60-L77 HydrophobicContact CE1-CD1 3.48Å; Y60-L77 VanDerWaalsContact CE1-CD1 3.48Å; Y60-L77 HydrophobicContact CE1-CD2 3.57Å; Y60-L77 HydrophobicContact CE1-CG 4.13Å; I63-L77 HydrophobicContact CD1-CB 4.34Å; I63-L77 HydrophobicContact CD1-CD2 3.56Å; T73-L77 PolarHBondContact O-N 3.23Å; K74-L77 PolarHBondContact O-N 3.4Å; D75-L77 VanDerWaalsContact C-N 3.3Å; D75-L77 PolarHBondContact O-N 2.94Å; L77-Q79 VanDerWaalsContact C-N 3.31Å; L77-L80 PolarHBondContact O-N 3Å; L77-T81 WeakPolarHBondContact O-CB 3.49Å; L77-T81 PolarHBondContact O-N 2.91Å; L77-T81 PolarHBondContact O-OG1 2.95Å
78	E	92.3	Very high	92.1	Very high	75 Å²	75	66.3 Å²	66.3	35%	0.35	33%	0.329	S	S	.	.	H	α-helix	trans	-63.7	-38.5	175.8	-74.7	178.9	-159.5	0	0	111.2	K74 D75 T81 T82 R203	K74-E78 WeakPolarHBondContact O-CG 3.31Å; K74-E78 PolarHBondContact O-N 3.37Å; D75-E78 PolarHBondContact O-N 3.26Å; E78-T81 PolarHBondContact O-N 2.94Å; E78-T82 PolarHBondContact O-N 3.42Å; E78-T82 PolarHBondContact O-OG1 3.19Å; E78-R203 IonicContact OE1-CZ 2.92Å; E78-R203 IonicContact OE1-NE 3.26Å; E78-R203 PolarHBondContact OE1-NE 3.01Å; E78-R203 IonicContact OE1-NH1 3.1Å; E78-R203 PolarHBondContact OE1-NH1 3.42Å; E78-R203 IonicContact OE1-NH2 3.5Å; E78-R203 PolarHBondContact OE1-NH2 2.93Å
79	Q	94.6	Very high	92.5	Very high	126 Å²	126	62.8 Å²	62.8	59%	0.589	31%	0.312	S	S	*	.	H	α-helix	trans	-63.7	-47.4	174.3	-173.5	176.8	3.1	0	0	111.6	D75 D76 L77 T81 T82 E83	D75-Q79 PolarHBondContact O-N 2.99Å; D76-Q79 PolarHBondContact O-N 3.47Å; L77-Q79 VanDerWaalsContact C-N 3.31Å; Q79-T81 VanDerWaalsContact C-N 3.33Å; Q79-T81 PolarHBondContact O-N 3.49Å; Q79-T82 WeakPolarHBondContact O-CB 3.31Å; Q79-T82 PolarHBondContact O-N 3.41Å; Q79-E83 PolarHBondContact O-N 2.88Å
80	L	94.8	Very high	92.9	Very high	19 Å²	19	64.8 Å²	64.8	10%	0.099	32%	0.322	C	S	.	.	H	α-helix	trans	-60.9	-41.7	176.1	-74.9	178.7	0	0	0	112.2	E55 A56 L59 D76 L77 T82 E83 I84	E55-L80 HydrophobicContact CB-CD1 3.81Å; E55-L80 HydrophobicContact CG-CD1 3.67Å; E55-L80 WeakPolarHBondContact OE2-CD2 3.42Å; A56-L80 HydrophobicContact CB-CD1 4.42Å; L59-L80 HydrophobicContact CD1-CD1 3.62Å; L59-L80 HydrophobicContact CG-CD1 4.47Å; D76-L80 WeakPolarHBondContact O-CG 3.46Å; D76-L80 PolarHBondContact O-N 2.9Å; L77-L80 PolarHBondContact O-N 3Å; L80-T82 VanDerWaalsContact C-N 3.28Å; L80-T82 PolarHBondContact O-N 3.18Å; L80-E83 PolarHBondContact O-N 3.16Å; L80-I84 WeakPolarHBondContact O-CB 3.49Å; L80-I84 VanDerWaalsContact O-CG1 3.27Å; L80-I84 WeakPolarHBondContact O-CG1 3.34Å; L80-I84 PolarHBondContact O-N 3.39Å
81	T	92.9	Very high	93.2	Very high	30 Å²	30	58.4 Å²	58.4	18%	0.184	29%	0.292	C	S	.	.	H	α-helix	trans	-58.8	-43.6	176.6	-58.3	0	0	0	0	110.8	L77 E78 Q79 K85 S207	L77-T81 WeakPolarHBondContact O-CB 3.49Å; L77-T81 PolarHBondContact O-N 2.91Å; L77-T81 PolarHBondContact O-OG1 2.95Å; E78-T81 PolarHBondContact O-N 2.94Å; Q79-T81 VanDerWaalsContact C-N 3.33Å; Q79-T81 PolarHBondContact O-N 3.49Å; T81-K85 WeakPolarHBondContact O-CB 3.42Å; T81-K85 PolarHBondContact O-N 3.08Å; T81-S207 WeakPolarHBondContact CG2-OG 3.32Å
82	T	92.7	Very high	93.3	Very high	89 Å²	89	56.1 Å²	56.1	55%	0.546	27%	0.271	S	S	.	.	H	α-helix	trans	-66	-43	177.6	-57.7	0	0	0	0	111.9	E78 Q79 L80 K85 K86	E78-T82 PolarHBondContact O-N 3.42Å; E78-T82 PolarHBondContact O-OG1 3.19Å; Q79-T82 WeakPolarHBondContact O-CB 3.31Å; Q79-T82 PolarHBondContact O-N 3.41Å; L80-T82 VanDerWaalsContact C-N 3.28Å; L80-T82 PolarHBondContact O-N 3.18Å; T82-K85 PolarHBondContact O-N 3.45Å; T82-K86 WeakPolarHBondContact O-CB 3.42Å; T82-K86 PolarHBondContact O-N 3.44Å
83	E	94.1	Very high	93.3	Very high	55 Å²	55	54.2 Å²	54.2	26%	0.257	27%	0.267	S	S	.	.	H	α-helix	trans	-64.7	-45.2	177.2	-80.1	-65.8	122.2	0	0	112.1	Q79 L80 K85 K86 R87	Q79-E83 PolarHBondContact O-N 2.88Å; L80-E83 PolarHBondContact O-N 3.16Å; E83-K85 VanDerWaalsContact C-N 3.34Å; E83-K85 PolarHBondContact O-N 2.78Å; E83-K86 PolarHBondContact O-N 2.9Å; E83-R87 WeakPolarHBondContact O-CG 3.41Å; E83-R87 PolarHBondContact O-N 2.76Å; E83-R87 IonicContact OE2-CZ 2.76Å; E83-R87 IonicContact OE2-NE 3.08Å; E83-R87 IonicContact OE2-NH2 3.21Å; E83-R87 PolarHBondContact OE2-NH2 2.72Å
84	I	94.6	Very high	93.2	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-56.8	-50.6	174.3	-71.2	165.5	0	0	0	109.6	I49 V53 L80 K86 R87 A88 Y134	I49-I84 HydrophobicContact CG2-CG2 4.09Å; V53-I84 HydrophobicContact CG2-CD1 4.05Å; L80-I84 WeakPolarHBondContact O-CB 3.49Å; L80-I84 VanDerWaalsContact O-CG1 3.27Å; L80-I84 WeakPolarHBondContact O-CG1 3.34Å; L80-I84 PolarHBondContact O-N 3.39Å; I84-K86 VanDerWaalsContact C-N 3.34Å; I84-K86 PolarHBondContact O-N 3.17Å; I84-R87 PolarHBondContact O-N 2.75Å; I84-A88 WeakPolarHBondContact O-CB 3.37Å; I84-A88 PolarHBondContact O-N 3.18Å; I84-Y134 HydrophobicContact CB-CE1 4.37Å; I84-Y134 HydrophobicContact CD1-CD2 4.27Å; I84-Y134 HydrophobicContact CD1-CE1 4.19Å; I84-Y134 HydrophobicContact CD1-CE2 3.81Å; I84-Y134 HydrophobicContact CG2-CD1 3.77Å; I84-Y134 HydrophobicContact CG2-CE1 3.54Å
85	K	91.9	Very high	93.3	Very high	75 Å²	75	53.4 Å²	53.4	33%	0.326	26%	0.262	S	S	.	.	H	α-helix	trans	-57.3	-45.9	178.4	-179.7	-179.6	-179	177.8	0	112.1	T81 T82 E83 N89 E210	T81-K85 WeakPolarHBondContact O-CB 3.42Å; T81-K85 PolarHBondContact O-N 3.08Å; T82-K85 PolarHBondContact O-N 3.45Å; E83-K85 VanDerWaalsContact C-N 3.34Å; E83-K85 PolarHBondContact O-N 2.78Å; K85-N89 WeakPolarHBondContact O-CB 3.47Å; K85-N89 PolarHBondContact O-N 3.09Å; K85-N89 PolarHBondContact O-ND2 2.94Å; K85-E210 WeakPolarHBondContact CD-OE2 3.43Å; K85-E210 VanDerWaalsContact CE-OE2 3.27Å; K85-E210 WeakPolarHBondContact CE-OE2 3.39Å; K85-E210 IonicContact NZ-OE1 2.62Å; K85-E210 PolarHBondContact NZ-OE1 3.22Å; K85-E210 IonicContact NZ-OE2 2.76Å; K85-E210 PolarHBondContact NZ-OE2 3.07Å
86	K	93.7	Very high	93.1	Very high	141 Å²	141	52.5 Å²	52.5	61%	0.613	25%	0.254	S	S	*	.	H	α-helix	trans	-63.2	-47.6	-179.4	-178.7	-179.6	175.4	-175.4	0	111.6	T82 E83 I84 N89 N90	T82-K86 WeakPolarHBondContact O-CB 3.42Å; T82-K86 PolarHBondContact O-N 3.44Å; E83-K86 PolarHBondContact O-N 2.9Å; I84-K86 VanDerWaalsContact C-N 3.34Å; I84-K86 PolarHBondContact O-N 3.17Å; K86-N89 PolarHBondContact O-N 3.26Å; K86-N90 PolarHBondContact O-N 3.38Å; K86-N90 VanDerWaalsContact O-N 3.09Å
87	R	95.2	Very high	92.9	Very high	54 Å²	54	52.1 Å²	52.1	20%	0.204	26%	0.255	C	S	.	.	H	α-helix	trans	-66.4	-43.1	179.1	-68.7	178.2	-171	-64.7	-14.5	111.7	N45 K48 I49 E83 I84 N89 N90 V91	N45-R87 PolarHBondContact OD1-NH1 3.08Å; K48-R87 VanDerWaalsContact CD-NH1 3.34Å; I49-R87 HydrophobicContact CD1-CB 3.74Å; I49-R87 HydrophobicContact CG1-CB 3.46Å; I49-R87 VanDerWaalsContact CG1-CB 3.46Å; I49-R87 HydrophobicContact CG1-CG 4.44Å; E83-R87 WeakPolarHBondContact O-CG 3.41Å; E83-R87 PolarHBondContact O-N 2.76Å; E83-R87 IonicContact OE2-CZ 2.76Å; E83-R87 IonicContact OE2-NE 3.08Å; E83-R87 IonicContact OE2-NH2 3.21Å; E83-R87 PolarHBondContact OE2-NH2 2.72Å; I84-R87 PolarHBondContact O-N 2.75Å; R87-N89 VanDerWaalsContact C-N 3.31Å; R87-N89 PolarHBondContact O-N 3.21Å; R87-N90 WeakPolarHBondContact O-CB 3.42Å; R87-N90 PolarHBondContact O-N 3.4Å; R87-N90 VanDerWaalsContact O-N 3.09Å; R87-V91 WeakPolarHBondContact O-CG2 3.44Å; R87-V91 PolarHBondContact O-N 3.2Å
88	A	93.3	Very high	92.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.2	-38.9	179.4	0	0	0	0	0	111.4	I49 I84 V91 R92 F127 M131 M214	I49-A88 HydrophobicContact CD1-CB 4.06Å; I84-A88 WeakPolarHBondContact O-CB 3.37Å; I84-A88 PolarHBondContact O-N 3.18Å; A88-V91 PolarHBondContact O-N 2.86Å; A88-R92 WeakPolarHBondContact O-CB 3.44Å; A88-R92 PolarHBondContact O-N 3.42Å; A88-F127 HydrophobicContact CB-CE2 3.93Å; A88-F127 HydrophobicContact CB-CZ 3.93Å; A88-F127 WeakPolarHBondContact O-CZ 3.39Å; A88-M131 HydrophobicContact CB-CE 4.12Å; A88-M131 HydrophobicContact CB-SD 3.92Å; A88-M214 HydrophobicContact CB-CE 3.69Å; A88-M214 HydrophobicContact CB-SD 3.5Å; A88-M214 VanDerWaalsContact CB-SD 3.5Å
89	N	92.1	Very high	92.2	Very high	43 Å²	43	49.8 Å²	49.8	23%	0.23	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-40.3	170.9	-83.4	-64.2	0	0	0	113.3	K85 K86 R87 R92 N93	K85-N89 WeakPolarHBondContact O-CB 3.47Å; K85-N89 PolarHBondContact O-N 3.09Å; K85-N89 PolarHBondContact O-ND2 2.94Å; K86-N89 PolarHBondContact O-N 3.26Å; R87-N89 VanDerWaalsContact C-N 3.31Å; R87-N89 PolarHBondContact O-N 3.21Å; N89-R92 PolarHBondContact O-N 2.84Å; N89-R92 PolarHBondContact OD1-NH2 3.1Å; N89-N93 PolarHBondContact O-N 3.02Å; N89-N93 PolarHBondContact O-ND2 3Å; N89-N93 PolarHBondContact O-OD1 3.43Å
90	N	93.6	Very high	91.8	Very high	58 Å²	58	49.6 Å²	49.6	31%	0.31	24%	0.241	S	C	.	.	H	α-helix	trans	-62.4	-48	175.7	179.6	-78.2	0	0	0	111.3	K86 R87 R92 N93 K94	K86-N90 PolarHBondContact O-N 3.38Å; K86-N90 VanDerWaalsContact O-N 3.09Å; R87-N90 WeakPolarHBondContact O-CB 3.42Å; R87-N90 PolarHBondContact O-N 3.4Å; R87-N90 VanDerWaalsContact O-N 3.09Å; N90-R92 PolarHBondContact O-N 3.01Å; N90-N93 PolarHBondContact O-N 3.38Å; N90-K94 WeakPolarHBondContact O-CG 3.25Å; N90-K94 PolarHBondContact O-N 3.1Å
91	V	94.1	Very high	91	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-58.7	-47.3	175.9	172.6	0	0	0	0	110.8	T42 N45 I46 I49 R87 A88 N93 K94 L95 F127	T42-V91 HydrophobicContact CG2-CG1 3.94Å; T42-V91 HydrophobicContact CG2-CG2 4.38Å; N45-V91 HydrophobicContact CB-CG2 3.56Å; I46-V91 HydrophobicContact CD1-CG1 4.08Å; I46-V91 HydrophobicContact CG1-CG1 3.85Å; I46-V91 HydrophobicContact CG1-CG2 3.92Å; I49-V91 HydrophobicContact CD1-CG2 4.19Å; R87-V91 WeakPolarHBondContact O-CG2 3.44Å; R87-V91 PolarHBondContact O-N 3.2Å; A88-V91 PolarHBondContact O-N 2.86Å; V91-N93 VanDerWaalsContact C-N 3.33Å; V91-N93 PolarHBondContact O-N 3.37Å; V91-K94 PolarHBondContact O-N 3.5Å; V91-L95 HydrophobicContact CG1-CD1 3.83Å; V91-L95 HydrophobicContact CG1-CG 4.27Å; V91-L95 WeakPolarHBondContact O-CG 3.21Å; V91-L95 PolarHBondContact O-N 3.12Å; V91-F127 HydrophobicContact CB-CD2 4.26Å; V91-F127 HydrophobicContact CB-CE1 4.38Å; V91-F127 HydrophobicContact CB-CE2 4.04Å; V91-F127 HydrophobicContact CB-CZ 4.1Å; V91-F127 HydrophobicContact CG1-CB 4.12Å; V91-F127 HydrophobicContact CG1-CD1 3.69Å; V91-F127 HydrophobicContact CG1-CD2 3.64Å; V91-F127 HydrophobicContact CG1-CE1 3.88Å; V91-F127 HydrophobicContact CG1-CE2 3.88Å; V91-F127 HydrophobicContact CG1-CG 3.55Å; V91-F127 HydrophobicContact CG1-CZ 4Å
92	R	91.6	Very high	90.3	Very high	50 Å²	50	51.5 Å²	51.5	19%	0.189	25%	0.247	C	C	.	.	H	α-helix	trans	-54.5	-48.8	176.1	179.2	178.8	63.2	168.5	-7.1	111.7	A88 N89 N90 L95 K96 F127 M214 D217	A88-R92 WeakPolarHBondContact O-CB 3.44Å; A88-R92 PolarHBondContact O-N 3.42Å; N89-R92 PolarHBondContact O-N 2.84Å; N89-R92 PolarHBondContact OD1-NH2 3.1Å; N90-R92 PolarHBondContact O-N 3.01Å; R92-L95 PolarHBondContact O-N 3.03Å; R92-K96 WeakPolarHBondContact O-CG 3.47Å; R92-K96 PolarHBondContact O-N 3.47Å; R92-F127 HydrophobicContact CB-CE1 4.41Å; R92-M214 HydrophobicContact CB-CG 4.48Å; R92-D217 WeakPolarHBondContact CD-OD2 3.35Å; R92-D217 IonicContact CZ-OD2 3.69Å; R92-D217 IonicContact NE-OD2 3.69Å; R92-D217 IonicContact NH1-OD2 2.73Å; R92-D217 PolarHBondContact NH1-OD2 3.49Å
93	N	91.8	Very high	89.5	Confident	96 Å²	96	53.6 Å²	53.6	51%	0.513	25%	0.251	S	S	.	.	H	α-helix	trans	-66.1	-40.2	-177.9	-67.7	-13.3	0	0	0	111.8	N89 N90 V91 K96 S97	N89-N93 PolarHBondContact O-N 3.02Å; N89-N93 PolarHBondContact O-ND2 3Å; N89-N93 PolarHBondContact O-OD1 3.43Å; N90-N93 PolarHBondContact O-N 3.38Å; V91-N93 VanDerWaalsContact C-N 3.33Å; V91-N93 PolarHBondContact O-N 3.37Å; N93-K96 PolarHBondContact O-N 3.14Å; N93-S97 WeakPolarHBondContact O-CB 3.37Å; N93-S97 PolarHBondContact O-N 3.09Å
94	K	92.5	Very high	88.4	Confident	34 Å²	34	56.6 Å²	56.6	15%	0.148	27%	0.265	C	S	.	.	H	α-helix	trans	-62.9	-44.8	175	-74.5	-119.5	178.3	-171.3	0	111.8	E41 N90 V91 S97 M98	E41-K94 VanDerWaalsContact CD-NZ 3.32Å; E41-K94 IonicContact OE1-NZ 2.71Å; E41-K94 WeakPolarHBondContact OE2-CE 3.46Å; E41-K94 IonicContact OE2-NZ 2.95Å; E41-K94 PolarHBondContact OE2-NZ 2.85Å; N90-K94 WeakPolarHBondContact O-CG 3.25Å; N90-K94 PolarHBondContact O-N 3.1Å; V91-K94 PolarHBondContact O-N 3.5Å; K94-S97 PolarHBondContact O-N 3.06Å; K94-M98 HydrophobicContact CB-CE 4.07Å; K94-M98 WeakPolarHBondContact O-CE 3.35Å; K94-M98 WeakPolarHBondContact O-CG 3.3Å; K94-M98 PolarHBondContact O-N 3.36Å
95	L	91.4	Very high	86.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.6	-48.2	175.9	-70.5	173.6	0	0	0	111.7	V91 R92 S97 M98 E99 H120 L123 F127	V91-L95 HydrophobicContact CG1-CD1 3.83Å; V91-L95 HydrophobicContact CG1-CG 4.27Å; V91-L95 WeakPolarHBondContact O-CG 3.21Å; V91-L95 PolarHBondContact O-N 3.12Å; R92-L95 PolarHBondContact O-N 3.03Å; L95-S97 VanDerWaalsContact C-N 3.29Å; L95-S97 PolarHBondContact O-N 3.21Å; L95-M98 HydrophobicContact CD2-CE 3.9Å; L95-M98 HydrophobicContact CG-CE 4.48Å; L95-M98 WeakPolarHBondContact O-CB 3.33Å; L95-M98 PolarHBondContact O-N 3.32Å; L95-E99 PolarHBondContact O-N 3.03Å; L95-H120 PolarHBondContact O-CD2 3.48Å; L95-H120 PolarHBondContact O-NE2 3.31Å; L95-L123 HydrophobicContact CD2-CB 3.79Å; L95-F127 HydrophobicContact CD1-CB 4.31Å; L95-F127 HydrophobicContact CD1-CD1 3.74Å; L95-F127 HydrophobicContact CD1-CE1 4.47Å; L95-F127 HydrophobicContact CD1-CG 4.36Å
96	K	89.3	Confident	85.3	Confident	77 Å²	77	61.9 Å²	61.9	34%	0.335	30%	0.297	S	S	.	.	H	α-helix	trans	-60.1	-37.6	175.4	-72.8	-169.2	175.9	-170.7	0	112.7	R92 N93 K100 D217 L221	R92-K96 WeakPolarHBondContact O-CG 3.47Å; R92-K96 PolarHBondContact O-N 3.47Å; N93-K96 PolarHBondContact O-N 3.14Å; K96-K100 PolarHBondContact O-N 3.42Å; K96-K100 VanDerWaalsContact O-N 3.12Å; K96-D217 IonicContact NZ-OD1 3.74Å; K96-D217 PolarHBondContact NZ-OD1 3.47Å; K96-D217 IonicContact NZ-OD2 3.6Å; K96-D217 PolarHBondContact NZ-OD2 3.38Å; K96-L221 HydrophobicContact CG-CD1 4.5Å
97	S	89.9	Confident	83.5	Confident	51 Å²	51	61.9 Å²	61.9	36%	0.357	31%	0.308	S	S	.	.	H	α-helix	trans	-65.4	-44.8	175.6	-161.6	0	0	0	0	111.8	N93 K94 L95 E99 K100 H101	N93-S97 WeakPolarHBondContact O-CB 3.37Å; N93-S97 PolarHBondContact O-N 3.09Å; K94-S97 PolarHBondContact O-N 3.06Å; L95-S97 VanDerWaalsContact C-N 3.29Å; L95-S97 PolarHBondContact O-N 3.21Å; S97-E99 VanDerWaalsContact C-N 3.35Å; S97-E99 PolarHBondContact O-N 2.97Å; S97-K100 PolarHBondContact O-N 2.65Å; S97-H101 PolarHBondContact O-CD2 3.48Å; S97-H101 PolarHBondContact O-N 3.05Å; S97-H101 VanDerWaalsContact O-N 3.16Å
98	M	87.4	Confident	81.5	Confident	3 Å²	3	69.2 Å²	69.2	2%	0.015	34%	0.336	C	S	.	.	H	α-helix	trans	-61.3	-42.3	176.1	-74.4	-177.4	-104.3	0	0	112	F35 I39 T42 K94 L95 H101 I102 L123	F35-M98 HydrophobicContact CE2-CG 4.29Å; F35-M98 HydrophobicContact CE2-SD 4.14Å; I39-M98 HydrophobicContact CD1-CE 4.27Å; I39-M98 HydrophobicContact CD1-SD 3.39Å; I39-M98 WeakPolarHBondContact CD1-SD 3.42Å; T42-M98 HydrophobicContact CG2-CE 4.18Å; K94-M98 HydrophobicContact CB-CE 4.07Å; K94-M98 WeakPolarHBondContact O-CE 3.35Å; K94-M98 WeakPolarHBondContact O-CG 3.3Å; K94-M98 PolarHBondContact O-N 3.36Å; L95-M98 HydrophobicContact CD2-CE 3.9Å; L95-M98 HydrophobicContact CG-CE 4.48Å; L95-M98 WeakPolarHBondContact O-CB 3.33Å; L95-M98 PolarHBondContact O-N 3.32Å; M98-H101 PolarHBondContact O-N 3.1Å; M98-I102 WeakPolarHBondContact O-CD1 3.43Å; M98-I102 VanDerWaalsContact O-CG1 3.27Å; M98-I102 WeakPolarHBondContact O-CG1 3.32Å; M98-I102 PolarHBondContact O-N 2.7Å; M98-I102 VanDerWaalsContact O-N 3.07Å; M98-L123 HydrophobicContact CE-CD1 4.04Å; M98-L123 HydrophobicContact SD-CD1 4.37Å
99	E	85.6	Confident	79.9	Confident	44 Å²	44	73.3 Å²	73.3	21%	0.206	37%	0.365	C	S	.	.	H	α-helix	trans	-59	-47.7	176	-178	178.4	-131.1	0	0	111.6	L95 S97 H101 I102 E103 L221	L95-E99 PolarHBondContact O-N 3.03Å; S97-E99 VanDerWaalsContact C-N 3.35Å; S97-E99 PolarHBondContact O-N 2.97Å; E99-H101 VanDerWaalsContact C-N 3.32Å; E99-H101 PolarHBondContact O-N 3.15Å; E99-I102 WeakPolarHBondContact O-CA 3.37Å; E99-I102 WeakPolarHBondContact O-CB 3.47Å; E99-I102 PolarHBondContact O-N 3.48Å; E99-E103 PolarHBondContact O-N 3.14Å; E99-L221 WeakPolarHBondContact OE1-CD2 3.28Å; E99-L221 WeakPolarHBondContact OE2-CD2 3.3Å
100	K	84.4	Confident	78.8	Confident	122 Å²	122	73.5 Å²	73.5	53%	0.53	37%	0.369	S	S	.	.	H	α-helix	trans	-58.3	-43	177.8	-172.3	-176.3	175	-163.9	0	112.5	K96 S97 I102 E103 E104	K96-K100 PolarHBondContact O-N 3.42Å; K96-K100 VanDerWaalsContact O-N 3.12Å; S97-K100 PolarHBondContact O-N 2.65Å; K100-I102 VanDerWaalsContact C-N 3.26Å; K100-I102 PolarHBondContact O-N 3.27Å; K100-E103 PolarHBondContact O-N 2.88Å; K100-E104 WeakPolarHBondContact CE-OE1 3.36Å; K100-E104 IonicContact NZ-OE1 3.51Å; K100-E104 WeakPolarHBondContact O-CG 3.48Å; K100-E104 PolarHBondContact O-N 3.37Å
101	H	79	Confident	77.9	Confident	80 Å²	80	73.2 Å²	73.2	37%	0.37	38%	0.375	S	S	.	.	H	α-helix	trans	-64.9	-30.3	175.9	-70.7	-54.3	0	0	0	112.9	S97 M98 E99	S97-H101 PolarHBondContact O-CD2 3.48Å; S97-H101 PolarHBondContact O-N 3.05Å; S97-H101 VanDerWaalsContact O-N 3.16Å; M98-H101 PolarHBondContact O-N 3.1Å; E99-H101 VanDerWaalsContact C-N 3.32Å; E99-H101 PolarHBondContact O-N 3.15Å
102	I	78.2	Confident	77.1	Confident	9 Å²	9	75 Å²	75	5%	0.046	38%	0.384	C	S	.	.	H	α-helix	trans	-71	-39.1	175.5	-71.8	162.7	0	0	0	111.3	M98 E99 K100 L113 R116 K117 H120	M98-I102 WeakPolarHBondContact O-CD1 3.43Å; M98-I102 VanDerWaalsContact O-CG1 3.27Å; M98-I102 WeakPolarHBondContact O-CG1 3.32Å; M98-I102 PolarHBondContact O-N 2.7Å; M98-I102 VanDerWaalsContact O-N 3.07Å; E99-I102 WeakPolarHBondContact O-CA 3.37Å; E99-I102 WeakPolarHBondContact O-CB 3.47Å; E99-I102 PolarHBondContact O-N 3.48Å; K100-I102 VanDerWaalsContact C-N 3.26Å; K100-I102 PolarHBondContact O-N 3.27Å; I102-L113 HydrophobicContact CG2-CD1 4.15Å; I102-R116 HydrophobicContact CD1-CB 4.26Å; I102-R116 HydrophobicContact CG1-CB 3.91Å; I102-K117 HydrophobicContact CD1-CG 4.37Å; I102-K117 HydrophobicContact CG1-CG 4.38Å; I102-K117 HydrophobicContact CG2-CD 4.08Å; I102-K117 HydrophobicContact CG2-CG 3.5Å; I102-H120 HydrophobicContact CD1-CB 3.73Å
103	E	75.4	Confident	76.5	Confident	134 Å²	134	72.9 Å²	72.9	63%	0.626	38%	0.377	S	S	*	.	H	α-helix	trans	-69.3	-36.9	179.3	-69.5	-177.5	164.2	0	0	112.9	E99 K100 D105	E99-E103 PolarHBondContact O-N 3.14Å; K100-E103 PolarHBondContact O-N 2.88Å; E103-D105 VanDerWaalsContact C-N 3.31Å; E103-D105 PolarHBondContact O-N 3.15Å
104	E	71.6	Confident	75.8	Confident	117 Å²	117	70.9 Å²	70.9	55%	0.547	36%	0.362	S	S	.	.	H	α-helix	trans	-68.7	-27.4	180	-71.3	175.2	172.5	0	0	112.9	K100	K100-E104 WeakPolarHBondContact CE-OE1 3.36Å; K100-E104 IonicContact NZ-OE1 3.51Å; K100-E104 WeakPolarHBondContact O-CG 3.48Å; K100-E104 PolarHBondContact O-N 3.37Å
105	D	63.1	Low	75.3	Confident	84 Å²	84	71.8 Å²	71.8	45%	0.449	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	4.6	-175.1	-86	-16.5	0	0	0	114.9	E103 V107 R108 L113	E103-D105 VanDerWaalsContact C-N 3.31Å; E103-D105 PolarHBondContact O-N 3.15Å; D105-V107 PolarHBondContact O-N 3.14Å; D105-R108 PolarHBondContact O-N 3.43Å; D105-L113 HydrophobicContact CB-CD1 4.09Å
106	D	58.4	Low	75	Confident	102 Å²	102	74.1 Å²	74.1	55%	0.545	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-6.5	-170.9	-149.7	46.8	0	0	0	114.5	K117	D106-K117 IonicContact OD1-NZ 2.99Å; D106-K117 PolarHBondContact OD1-NZ 3.15Å
107	V	55.3	Low	74.7	Confident	141 Å²	141	72 Å²	72	86%	0.855	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-14.5	179.2	-171.7	0	0	0	0	112.9	D105	D105-V107 PolarHBondContact O-N 3.14Å
108	R	54.1	Low	74.4	Confident	208 Å²	208	71.6 Å²	71.6	79%	0.785	37%	0.365	S	S	*	.	S	Bend	trans	-132.3	107.3	172.7	-88.4	178.5	-169.8	162.8	5.5	111.2	D105 S110	D105-R108 PolarHBondContact O-N 3.43Å; R108-S110 VanDerWaalsContact C-N 3.26Å; R108-S110 PolarHBondContact O-N 2.95Å
109	S	58.2	Low	74.4	Confident	87 Å²	87	73.8 Å²	73.8	61%	0.608	38%	0.375	S	S	*	.			trans	-64.4	84.4	166.4	170.4	0	0	0	0	110.9
110	S	70.9	Confident	74.5	Confident	46 Å²	46	72 Å²	72	32%	0.322	37%	0.367	S	S	.	.			trans	-101.8	162.2	178.9	72.7	0	0	0	0	111.3	R108 D112 L113 R114	R108-S110 VanDerWaalsContact C-N 3.26Å; R108-S110 PolarHBondContact O-N 2.95Å; S110-D112 PolarHBondContact O-N 2.83Å; S110-D112 PolarHBondContact OG-N 3.39Å; S110-L113 PolarHBondContact O-N 2.96Å; S110-L113 PolarHBondContact OG-N 2.84Å; S110-L113 VanDerWaalsContact OG-N 3.1Å; S110-R114 PolarHBondContact O-N 3.33Å
111	A	73	Confident	74.6	Confident	52 Å²	52	66.4 Å²	66.4	43%	0.43	34%	0.343	S	S	.	.	H	α-helix	trans	-61.4	-32.8	172.1	0	0	0	0	0	112.1	R114 I115	A111-R114 PolarHBondContact O-N 2.93Å; A111-I115 VanDerWaalsContact O-CG1 3.32Å; A111-I115 WeakPolarHBondContact O-CG1 3.33Å; A111-I115 PolarHBondContact O-N 3.29Å; A111-I115 VanDerWaalsContact O-N 3.11Å
112	D	77.4	Confident	74.9	Confident	37 Å²	37	65.8 Å²	65.8	20%	0.198	35%	0.345	C	S	.	.	H	α-helix	trans	-60.7	-52	175.1	-177.9	100.4	0	0	0	111.5	M32 S110 R114 I115 R116	M32-D112 WeakPolarHBondContact CG-OD1 3.44Å; S110-D112 PolarHBondContact O-N 2.83Å; S110-D112 PolarHBondContact OG-N 3.39Å; D112-R114 VanDerWaalsContact C-N 3.29Å; D112-R114 PolarHBondContact O-N 3.11Å; D112-I115 PolarHBondContact O-N 3.39Å; D112-R116 WeakPolarHBondContact O-CG 3.39Å; D112-R116 PolarHBondContact O-N 3.15Å; D112-R116 IonicContact OD1-NE 3.96Å; D112-R116 IonicContact OD1-NH2 3.88Å; D112-R116 WeakPolarHBondContact OD2-CD 3.33Å; D112-R116 IonicContact OD2-CZ 3.46Å; D112-R116 IonicContact OD2-NE 3.78Å; D112-R116 PolarHBondContact OD2-NE 3.44Å; D112-R116 IonicContact OD2-NH2 3.33Å
113	L	79.1	Confident	75.6	Confident	7 Å²	7	65.5 Å²	65.5	4%	0.037	34%	0.343	C	S	.	.	H	α-helix	trans	-58.8	-39.2	178.1	-176.1	62.7	0	0	0	112.1	I102 D105 S110 R116 K117	I102-L113 HydrophobicContact CG2-CD1 4.15Å; D105-L113 HydrophobicContact CB-CD1 4.09Å; S110-L113 PolarHBondContact O-N 2.96Å; S110-L113 PolarHBondContact OG-N 2.84Å; S110-L113 VanDerWaalsContact OG-N 3.1Å; L113-R116 PolarHBondContact O-N 2.96Å; L113-K117 HydrophobicContact CD1-CD 4.38Å; L113-K117 HydrophobicContact CD1-CG 4.42Å; L113-K117 HydrophobicContact CG-CD 4.12Å; L113-K117 WeakPolarHBondContact O-CB 3.45Å; L113-K117 VanDerWaalsContact O-CG 3.3Å; L113-K117 WeakPolarHBondContact O-CG 3.45Å; L113-K117 PolarHBondContact O-N 2.83Å
114	R	77.6	Confident	76.3	Confident	53 Å²	53	59.1 Å²	59.1	20%	0.2	31%	0.313	C	S	.	.	H	α-helix	trans	-64.5	-41.5	175.9	-68.7	-166.4	-57.2	-94.5	6.2	112.4	S110 A111 D112 S118	S110-R114 PolarHBondContact O-N 3.33Å; A111-R114 PolarHBondContact O-N 2.93Å; D112-R114 VanDerWaalsContact C-N 3.29Å; D112-R114 PolarHBondContact O-N 3.11Å; R114-S118 VanDerWaalsContact O-CB 3.32Å; R114-S118 WeakPolarHBondContact O-CB 3.48Å; R114-S118 PolarHBondContact O-N 3.03Å
115	I	82	Confident	77.1	Confident	53 Å²	53	58.3 Å²	58.3	27%	0.272	31%	0.305	S	S	.	.	H	α-helix	trans	-64.8	-45	177.6	-67.2	163	0	0	0	109.7	F31 M32 F35 F36 A111 D112 S118 Q119	F31-I115 HydrophobicContact CE1-CD1 4.19Å; F31-I115 HydrophobicContact CZ-CD1 4.18Å; M32-I115 HydrophobicContact CE-CB 3.7Å; M32-I115 HydrophobicContact CE-CD1 3.66Å; M32-I115 HydrophobicContact CE-CG1 4.28Å; M32-I115 HydrophobicContact CE-CG2 3.36Å; M32-I115 HydrophobicContact SD-CG2 4.5Å; F35-I115 HydrophobicContact CE1-CG2 4.28Å; F36-I115 HydrophobicContact CE1-CG2 4.1Å; F36-I115 HydrophobicContact CZ-CG2 4.2Å; A111-I115 VanDerWaalsContact O-CG1 3.32Å; A111-I115 WeakPolarHBondContact O-CG1 3.33Å; A111-I115 PolarHBondContact O-N 3.29Å; A111-I115 VanDerWaalsContact O-N 3.11Å; D112-I115 PolarHBondContact O-N 3.39Å; I115-S118 PolarHBondContact O-N 3.19Å; I115-Q119 HydrophobicContact CG2-CG 4.16Å; I115-Q119 WeakPolarHBondContact O-CB 3.46Å; I115-Q119 VanDerWaalsContact O-CG 3.29Å; I115-Q119 WeakPolarHBondContact O-CG 3.37Å; I115-Q119 PolarHBondContact O-N 3.34Å
116	R	85.9	Confident	78.4	Confident	49 Å²	49	57.5 Å²	57.5	19%	0.185	30%	0.298	C	S	.	.	H	α-helix	trans	-58.6	-51.9	176.8	-67.1	177.9	-174.3	-91.8	-3.5	112.3	M32 F35 I102 D112 L113 S118 Q119 H120	M32-R116 HydrophobicContact SD-CG 4.2Å; F35-R116 HydrophobicContact CD1-CG 4.22Å; F35-R116 HydrophobicContact CD2-CG 4.18Å; F35-R116 HydrophobicContact CE1-CB 4.5Å; F35-R116 HydrophobicContact CE1-CG 3.94Å; F35-R116 HydrophobicContact CE2-CB 4.27Å; F35-R116 HydrophobicContact CE2-CG 3.89Å; F35-R116 HydrophobicContact CG-CG 4.34Å; F35-R116 HydrophobicContact CZ-CB 4.01Å; F35-R116 HydrophobicContact CZ-CG 3.77Å; I102-R116 HydrophobicContact CD1-CB 4.26Å; I102-R116 HydrophobicContact CG1-CB 3.91Å; D112-R116 WeakPolarHBondContact O-CG 3.39Å; D112-R116 PolarHBondContact O-N 3.15Å; D112-R116 IonicContact OD1-NE 3.96Å; D112-R116 IonicContact OD1-NH2 3.88Å; D112-R116 WeakPolarHBondContact OD2-CD 3.33Å; D112-R116 IonicContact OD2-CZ 3.46Å; D112-R116 IonicContact OD2-NE 3.78Å; D112-R116 PolarHBondContact OD2-NE 3.44Å; D112-R116 IonicContact OD2-NH2 3.33Å; L113-R116 PolarHBondContact O-N 2.96Å; R116-S118 PolarHBondContact O-N 3.44Å; R116-Q119 PolarHBondContact O-N 3.33Å; R116-H120 WeakPolarHBondContact O-CB 3.33Å; R116-H120 PolarHBondContact O-N 2.83Å
117	K	82.7	Confident	80	Confident	34 Å²	34	52.6 Å²	52.6	15%	0.148	27%	0.272	C	S	.	.	H	α-helix	trans	-54.8	-48	175.7	-75.4	-179	173.1	-177	0	111.8	I102 D106 L113 S121 M228 I232	I102-K117 HydrophobicContact CD1-CG 4.37Å; I102-K117 HydrophobicContact CG1-CG 4.38Å; I102-K117 HydrophobicContact CG2-CD 4.08Å; I102-K117 HydrophobicContact CG2-CG 3.5Å; D106-K117 IonicContact OD1-NZ 2.99Å; D106-K117 PolarHBondContact OD1-NZ 3.15Å; L113-K117 HydrophobicContact CD1-CD 4.38Å; L113-K117 HydrophobicContact CD1-CG 4.42Å; L113-K117 HydrophobicContact CG-CD 4.12Å; L113-K117 WeakPolarHBondContact O-CB 3.45Å; L113-K117 VanDerWaalsContact O-CG 3.3Å; L113-K117 WeakPolarHBondContact O-CG 3.45Å; L113-K117 PolarHBondContact O-N 2.83Å; K117-S121 WeakPolarHBondContact O-CB 3.41Å; K117-S121 PolarHBondContact O-N 3.03Å; K117-S121 VanDerWaalsContact O-N 3.13Å; K117-M228 HydrophobicContact CB-CG 4.34Å; K117-M228 HydrophobicContact CB-SD 3.6Å; K117-M228 HydrophobicContact CD-CE 4.02Å; K117-M228 HydrophobicContact CD-CG 4.01Å; K117-M228 HydrophobicContact CD-SD 3.49Å; K117-M228 WeakPolarHBondContact CD-SD 3.37Å; K117-M228 HydrophobicContact CG-CE 4.29Å; K117-M228 HydrophobicContact CG-CG 4.41Å; K117-M228 HydrophobicContact CG-SD 3.41Å; K117-M228 WeakPolarHBondContact CG-SD 3.44Å; K117-I232 HydrophobicContact CB-CD1 4.3Å
118	S	82.8	Confident	81.7	Confident	42 Å²	42	47.8 Å²	47.8	29%	0.294	24%	0.243	S	C	.	.	H	α-helix	trans	-63	-46.9	179.3	-173.6	0	0	0	0	112.8	R114 I115 R116 S121 V122	R114-S118 VanDerWaalsContact O-CB 3.32Å; R114-S118 WeakPolarHBondContact O-CB 3.48Å; R114-S118 PolarHBondContact O-N 3.03Å; I115-S118 PolarHBondContact O-N 3.19Å; R116-S118 PolarHBondContact O-N 3.44Å; S118-S121 PolarHBondContact O-N 3.49Å; S118-V122 WeakPolarHBondContact O-CG2 3.35Å; S118-V122 PolarHBondContact O-N 2.89Å
119	Q	87.4	Confident	83.4	Confident	49 Å²	49	42.7 Å²	42.7	23%	0.229	23%	0.228	C	C	.	.	H	α-helix	trans	-69.5	-44.8	-176.4	-70.6	-66	-20.1	0	0	111.6	F35 I39 I115 R116 S121 V122 L123	F35-Q119 HydrophobicContact CE1-CB 4.21Å; F35-Q119 HydrophobicContact CE1-CG 4.19Å; F35-Q119 HydrophobicContact CZ-CB 3.92Å; F35-Q119 HydrophobicContact CZ-CG 4.42Å; I39-Q119 HydrophobicContact CD1-CB 3.69Å; I39-Q119 HydrophobicContact CG1-CB 4.17Å; I115-Q119 HydrophobicContact CG2-CG 4.16Å; I115-Q119 WeakPolarHBondContact O-CB 3.46Å; I115-Q119 VanDerWaalsContact O-CG 3.29Å; I115-Q119 WeakPolarHBondContact O-CG 3.37Å; I115-Q119 PolarHBondContact O-N 3.34Å; R116-Q119 PolarHBondContact O-N 3.33Å; Q119-S121 PolarHBondContact O-N 3.37Å; Q119-V122 PolarHBondContact O-N 3.3Å; Q119-L123 WeakPolarHBondContact O-CG 3.19Å; Q119-L123 PolarHBondContact O-N 3.34Å
120	H	88	Confident	85.1	Confident	6 Å²	6	38.8 Å²	38.8	3%	0.028	20%	0.2	C	C	.	.	H	α-helix	trans	-52.4	-41.9	172.4	176.7	-104.7	0	0	0	110.9	L95 I102 R116 L123 S124 Q225	L95-H120 PolarHBondContact O-CD2 3.48Å; L95-H120 PolarHBondContact O-NE2 3.31Å; I102-H120 HydrophobicContact CD1-CB 3.73Å; R116-H120 WeakPolarHBondContact O-CB 3.33Å; R116-H120 PolarHBondContact O-N 2.83Å; H120-L123 PolarHBondContact O-N 3.11Å; H120-S124 WeakPolarHBondContact O-CB 3.34Å; H120-S124 PolarHBondContact O-N 3.45Å; H120-S124 PolarHBondContact O-OG 2.93Å; H120-Q225 PolarHBondContact CE1-NE2 2.93Å
121	S	85.7	Confident	86.2	Confident	4 Å²	4	36.7 Å²	36.7	3%	0.028	19%	0.185	C	C	.	.	H	α-helix	trans	-71	-41.1	-177.8	-165.2	0	0	0	0	114.9	K117 S118 Q119 R125 Q225	K117-S121 WeakPolarHBondContact O-CB 3.41Å; K117-S121 PolarHBondContact O-N 3.03Å; K117-S121 VanDerWaalsContact O-N 3.13Å; S118-S121 PolarHBondContact O-N 3.49Å; Q119-S121 PolarHBondContact O-N 3.37Å; S121-R125 PolarHBondContact O-N 2.95Å; S121-R125 VanDerWaalsContact O-N 3.12Å; S121-R125 PolarHBondContact OG-NH1 2.86Å; S121-R125 PolarHBondContact OG-NH2 2.88Å; S121-Q225 PolarHBondContact OG-OE1 2.76Å
122	V	86.9	Confident	87	Confident	68 Å²	68	36.9 Å²	36.9	41%	0.412	18%	0.181	S	C	.	.	H	α-helix	trans	-62.8	-45.2	174.2	171.3	0	0	0	0	111	S118 Q119 K126	S118-V122 WeakPolarHBondContact O-CG2 3.35Å; S118-V122 PolarHBondContact O-N 2.89Å; Q119-V122 PolarHBondContact O-N 3.3Å; V122-K126 WeakPolarHBondContact O-CB 3.35Å; V122-K126 PolarHBondContact O-N 2.94Å
123	L	92	Very high	87.8	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-65.9	-42.2	179.1	-68.5	177.8	0	0	0	112.2	I39 T42 R43 I46 L95 M98 Q119 H120 R125 K126 F127	I39-L123 HydrophobicContact CB-CD1 4.47Å; I39-L123 HydrophobicContact CD1-CD1 3.34Å; I39-L123 HydrophobicContact CD1-CG 4.46Å; I39-L123 HydrophobicContact CG1-CD1 4.47Å; I39-L123 HydrophobicContact CG2-CD1 4.19Å; T42-L123 HydrophobicContact CG2-CD1 3.9Å; R43-L123 HydrophobicContact CB-CD2 4.07Å; I46-L123 HydrophobicContact CD1-CB 4.4Å; I46-L123 HydrophobicContact CD1-CD2 4.1Å; L95-L123 HydrophobicContact CD2-CB 3.79Å; M98-L123 HydrophobicContact CE-CD1 4.04Å; M98-L123 HydrophobicContact SD-CD1 4.37Å; Q119-L123 WeakPolarHBondContact O-CG 3.19Å; Q119-L123 PolarHBondContact O-N 3.34Å; H120-L123 PolarHBondContact O-N 3.11Å; L123-R125 PolarHBondContact O-N 2.71Å; L123-K126 PolarHBondContact O-N 3.32Å; L123-F127 WeakPolarHBondContact O-CB 3.41Å; L123-F127 PolarHBondContact O-N 2.88Å
124	S	90.6	Very high	88.5	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-57.8	-49.7	177	-63.6	0	0	0	0	111.4	H120 F127 V128 Q225	H120-S124 WeakPolarHBondContact O-CB 3.34Å; H120-S124 PolarHBondContact O-N 3.45Å; H120-S124 PolarHBondContact O-OG 2.93Å; S124-F127 PolarHBondContact O-N 3.34Å; S124-V128 WeakPolarHBondContact O-CG2 3.24Å; S124-V128 PolarHBondContact O-N 2.66Å; S124-Q225 PolarHBondContact OG-NE2 3.41Å
125	R	87.3	Confident	89.2	Confident	101 Å²	101	38.2 Å²	38.2	38%	0.381	19%	0.189	S	C	.	.	H	α-helix	trans	-60.9	-46.7	176.9	-79.4	-170.6	-69.8	-80	-8.3	112.5	S121 L123 F127 V128 E129 L229	S121-R125 PolarHBondContact O-N 2.95Å; S121-R125 VanDerWaalsContact O-N 3.12Å; S121-R125 PolarHBondContact OG-NH1 2.86Å; S121-R125 PolarHBondContact OG-NH2 2.88Å; L123-R125 PolarHBondContact O-N 2.71Å; R125-F127 VanDerWaalsContact C-N 3.27Å; R125-F127 PolarHBondContact O-N 3.45Å; R125-V128 PolarHBondContact O-N 2.95Å; R125-E129 WeakPolarHBondContact O-CB 3.42Å; R125-E129 PolarHBondContact O-N 2.74Å; R125-L229 VanDerWaalsContact NH1-CD1 3.32Å
126	K	91.1	Very high	89.8	Confident	66 Å²	66	41.3 Å²	41.3	29%	0.287	20%	0.202	S	C	.	.	H	α-helix	trans	-62	-38.7	179.6	-166.4	-178.9	176.4	-177.2	0	111.4	I46 D47 V122 L123 E129 V130	I46-K126 HydrophobicContact CG2-CB 4.49Å; I46-K126 HydrophobicContact CG2-CD 4.02Å; I46-K126 HydrophobicContact CG2-CG 3.86Å; D47-K126 WeakPolarHBondContact OD1-CE 3.39Å; D47-K126 IonicContact OD1-NZ 3.41Å; D47-K126 PolarHBondContact OD1-NZ 2.69Å; D47-K126 IonicContact OD2-NZ 2.91Å; V122-K126 WeakPolarHBondContact O-CB 3.35Å; V122-K126 PolarHBondContact O-N 2.94Å; L123-K126 PolarHBondContact O-N 3.32Å; K126-E129 PolarHBondContact O-N 3.48Å; K126-V130 WeakPolarHBondContact O-CG2 3.37Å; K126-V130 PolarHBondContact O-N 3.39Å; K126-V130 VanDerWaalsContact O-N 3.1Å
127	F	92.6	Very high	90.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.3	-47.4	176.6	-177.7	-136.4	0	0	0	111.9	I46 I49 A88 V91 R92 L95 L123 S124 R125 E129 V130 M131 M214 I218	I46-F127 HydrophobicContact CD1-CB 3.96Å; I46-F127 HydrophobicContact CG1-CB 4.23Å; I46-F127 HydrophobicContact CG1-CD2 4.27Å; I49-F127 HydrophobicContact CD1-CE2 4.04Å; A88-F127 HydrophobicContact CB-CE2 3.93Å; A88-F127 HydrophobicContact CB-CZ 3.93Å; A88-F127 WeakPolarHBondContact O-CZ 3.39Å; V91-F127 HydrophobicContact CB-CD2 4.26Å; V91-F127 HydrophobicContact CB-CE1 4.38Å; V91-F127 HydrophobicContact CB-CE2 4.04Å; V91-F127 HydrophobicContact CB-CZ 4.1Å; V91-F127 HydrophobicContact CG1-CB 4.12Å; V91-F127 HydrophobicContact CG1-CD1 3.69Å; V91-F127 HydrophobicContact CG1-CD2 3.64Å; V91-F127 HydrophobicContact CG1-CE1 3.88Å; V91-F127 HydrophobicContact CG1-CE2 3.88Å; V91-F127 HydrophobicContact CG1-CG 3.55Å; V91-F127 HydrophobicContact CG1-CZ 4Å; R92-F127 HydrophobicContact CB-CE1 4.41Å; L95-F127 HydrophobicContact CD1-CB 4.31Å; L95-F127 HydrophobicContact CD1-CD1 3.74Å; L95-F127 HydrophobicContact CD1-CE1 4.47Å; L95-F127 HydrophobicContact CD1-CG 4.36Å; L123-F127 WeakPolarHBondContact O-CB 3.41Å; L123-F127 PolarHBondContact O-N 2.88Å; S124-F127 PolarHBondContact O-N 3.34Å; R125-F127 VanDerWaalsContact C-N 3.27Å; R125-F127 PolarHBondContact O-N 3.45Å; F127-E129 VanDerWaalsContact C-N 3.3Å; F127-E129 PolarHBondContact O-N 2.94Å; F127-V130 PolarHBondContact O-N 3.3Å; F127-M131 HydrophobicContact CD2-CG 3.79Å; F127-M131 HydrophobicContact CD2-SD 4.43Å; F127-M131 HydrophobicContact CE2-CG 3.47Å; F127-M131 VanDerWaalsContact CE2-CG 3.47Å; F127-M131 HydrophobicContact CE2-SD 3.74Å; F127-M131 HydrophobicContact CG-CG 4.48Å; F127-M131 HydrophobicContact CZ-CG 3.96Å; F127-M131 HydrophobicContact CZ-SD 4.36Å; F127-M131 VanDerWaalsContact O-CG 3.3Å; F127-M131 WeakPolarHBondContact O-CG 3.47Å; F127-M131 PolarHBondContact O-N 3.3Å; F127-M214 HydrophobicContact CE1-SD 4.38Å; F127-M214 HydrophobicContact CZ-SD 3.73Å; F127-I218 HydrophobicContact CD1-CD1 3.58Å; F127-I218 HydrophobicContact CD1-CG1 4.05Å; F127-I218 HydrophobicContact CD1-CG2 4.33Å; F127-I218 HydrophobicContact CE1-CD1 3.15Å; F127-I218 HydrophobicContact CE1-CG1 3.79Å; F127-I218 HydrophobicContact CZ-CD1 3.91Å
128	V	90.5	Very high	90.8	Very high	40 Å²	40	37.9 Å²	37.9	24%	0.242	19%	0.19	C	C	.	.	H	α-helix	trans	-56.3	-45.5	173.8	172.5	0	0	0	0	111.5	S124 R125 V130 M131 T132 I218 V222	S124-V128 WeakPolarHBondContact O-CG2 3.24Å; S124-V128 PolarHBondContact O-N 2.66Å; R125-V128 PolarHBondContact O-N 2.95Å; V128-V130 PolarHBondContact O-N 3.04Å; V128-M131 PolarHBondContact O-N 3.1Å; V128-T132 WeakPolarHBondContact O-CB 3.25Å; V128-T132 PolarHBondContact O-N 3.1Å; V128-T132 PolarHBondContact O-OG1 3.35Å; V128-I218 HydrophobicContact CG2-CB 4.15Å; V128-I218 HydrophobicContact CG2-CG2 3.16Å; V128-V222 HydrophobicContact CG2-CG2 3.76Å
129	E	90.3	Very high	91.3	Very high	100 Å²	100	38.9 Å²	38.9	47%	0.467	19%	0.194	S	C	.	.	H	α-helix	trans	-57.7	-49.5	180	-173.5	-168.2	158.7	0	0	111.5	R125 K126 F127 T132 K133	R125-E129 WeakPolarHBondContact O-CB 3.42Å; R125-E129 PolarHBondContact O-N 2.74Å; K126-E129 PolarHBondContact O-N 3.48Å; F127-E129 VanDerWaalsContact C-N 3.3Å; F127-E129 PolarHBondContact O-N 2.94Å; E129-T132 PolarHBondContact O-N 3.44Å; E129-K133 WeakPolarHBondContact O-CG 3.16Å; E129-K133 PolarHBondContact O-N 3.17Å; E129-K133 WeakPolarHBondContact OE1-CE 3.25Å; E129-K133 IonicContact OE1-NZ 3.81Å; E129-K133 PolarHBondContact OE1-NZ 3.38Å
130	V	94.1	Very high	91.7	Very high	6 Å²	6	40.1 Å²	40.1	4%	0.036	20%	0.203	C	C	.	.	H	α-helix	trans	-64.9	-42.6	-179.9	171.3	0	0	0	0	111.4	I46 I49 K126 F127 V128 K133 Y134	I46-V130 HydrophobicContact CG2-CG2 3.94Å; I49-V130 HydrophobicContact CB-CG1 4.1Å; I49-V130 HydrophobicContact CG2-CG1 3.56Å; K126-V130 WeakPolarHBondContact O-CG2 3.37Å; K126-V130 PolarHBondContact O-N 3.39Å; K126-V130 VanDerWaalsContact O-N 3.1Å; F127-V130 PolarHBondContact O-N 3.3Å; V128-V130 PolarHBondContact O-N 3.04Å; V130-K133 PolarHBondContact O-N 3.02Å; V130-Y134 PolarHBondContact O-N 3.45Å
131	M	92.3	Very high	92.1	Very high	2 Å²	2	40 Å²	40	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-67.3	-38.7	178.9	-65.5	-55	-60.4	0	0	111.6	I49 A88 F127 V128 K133 Y134 N135 L211 M214 F215	I49-M131 HydrophobicContact CG2-SD 4.13Å; A88-M131 HydrophobicContact CB-CE 4.12Å; A88-M131 HydrophobicContact CB-SD 3.92Å; F127-M131 HydrophobicContact CD2-CG 3.79Å; F127-M131 HydrophobicContact CD2-SD 4.43Å; F127-M131 HydrophobicContact CE2-CG 3.47Å; F127-M131 VanDerWaalsContact CE2-CG 3.47Å; F127-M131 HydrophobicContact CE2-SD 3.74Å; F127-M131 HydrophobicContact CG-CG 4.48Å; F127-M131 HydrophobicContact CZ-CG 3.96Å; F127-M131 HydrophobicContact CZ-SD 4.36Å; F127-M131 VanDerWaalsContact O-CG 3.3Å; F127-M131 WeakPolarHBondContact O-CG 3.47Å; F127-M131 PolarHBondContact O-N 3.3Å; V128-M131 PolarHBondContact O-N 3.1Å; M131-K133 PolarHBondContact O-N 3.37Å; M131-Y134 HydrophobicContact CE-CD1 4.29Å; M131-Y134 WeakPolarHBondContact O-CB 3.15Å; M131-Y134 PolarHBondContact O-N 3.04Å; M131-Y134 VanDerWaalsContact O-N 3.1Å; M131-N135 PolarHBondContact O-N 3.4Å; M131-L211 HydrophobicContact CE-CD1 4.28Å; M131-L211 HydrophobicContact CE-CD2 3.49Å; M131-L211 VanDerWaalsContact CE-CD2 3.49Å; M131-L211 HydrophobicContact CE-CG 4.38Å; M131-M214 HydrophobicContact CE-SD 4.39Å; M131-F215 HydrophobicContact CB-CD1 4.46Å; M131-F215 HydrophobicContact CB-CE1 3.47Å; M131-F215 VanDerWaalsContact CB-CE1 3.47Å; M131-F215 HydrophobicContact CB-CZ 3.68Å; M131-F215 WeakPolarHBondContact O-CZ 3.32Å
132	T	91.1	Very high	92.6	Very high	55 Å²	55	41.6 Å²	41.6	34%	0.337	21%	0.207	S	C	.	.	H	α-helix	trans	-59.6	-47.3	174.6	-55.4	0	0	0	0	110.6	V128 E129 Y134 N135 E136	V128-T132 WeakPolarHBondContact O-CB 3.25Å; V128-T132 PolarHBondContact O-N 3.1Å; V128-T132 PolarHBondContact O-OG1 3.35Å; E129-T132 PolarHBondContact O-N 3.44Å; T132-Y134 PolarHBondContact O-N 3.01Å; T132-N135 PolarHBondContact O-N 3.35Å; T132-N135 VanDerWaalsContact O-N 3.14Å; T132-E136 WeakPolarHBondContact O-CG 3.43Å; T132-E136 PolarHBondContact O-N 3.49Å
133	K	93.2	Very high	93	Very high	76 Å²	76	42.4 Å²	42.4	33%	0.33	21%	0.207	S	C	.	.	H	α-helix	trans	-59.2	-34.1	174.8	-72.2	175	-173.3	169.1	0	112.9	E129 V130 M131 A137	E129-K133 WeakPolarHBondContact O-CG 3.16Å; E129-K133 PolarHBondContact O-N 3.17Å; E129-K133 WeakPolarHBondContact OE1-CE 3.25Å; E129-K133 IonicContact OE1-NZ 3.81Å; E129-K133 PolarHBondContact OE1-NZ 3.38Å; V130-K133 PolarHBondContact O-N 3.02Å; M131-K133 PolarHBondContact O-N 3.37Å; K133-A137 PolarHBondContact O-N 3Å; K133-A137 VanDerWaalsContact O-N 3.15Å
134	Y	94.4	Very high	93.1	Very high	1 Å²	1	49 Å²	49	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-67.9	-48	174.8	-175	-142.3	0	0	0	111.4	V53 A56 I84 V130 M131 T132 E136 A137 Q138 L211	V53-Y134 HydrophobicContact CB-CD2 4.47Å; V53-Y134 HydrophobicContact CG1-CD2 4.23Å; V53-Y134 HydrophobicContact CG2-CD2 3.78Å; V53-Y134 HydrophobicContact CG2-CG 3.76Å; A56-Y134 HydrophobicContact CB-CE2 4.49Å; I84-Y134 HydrophobicContact CB-CE1 4.37Å; I84-Y134 HydrophobicContact CD1-CD2 4.27Å; I84-Y134 HydrophobicContact CD1-CE1 4.19Å; I84-Y134 HydrophobicContact CD1-CE2 3.81Å; I84-Y134 HydrophobicContact CG2-CD1 3.77Å; I84-Y134 HydrophobicContact CG2-CE1 3.54Å; V130-Y134 PolarHBondContact O-N 3.45Å; M131-Y134 HydrophobicContact CE-CD1 4.29Å; M131-Y134 WeakPolarHBondContact O-CB 3.15Å; M131-Y134 PolarHBondContact O-N 3.04Å; M131-Y134 VanDerWaalsContact O-N 3.1Å; T132-Y134 PolarHBondContact O-N 3.01Å; Y134-E136 VanDerWaalsContact C-N 3.34Å; Y134-E136 PolarHBondContact O-N 3.15Å; Y134-A137 WeakPolarHBondContact O-CB 3.43Å; Y134-A137 PolarHBondContact O-N 3.31Å; Y134-A137 VanDerWaalsContact O-N 3.14Å; Y134-Q138 HydrophobicContact CD2-CG 4.2Å; Y134-Q138 HydrophobicContact CE2-CG 3.91Å; Y134-Q138 WeakPolarHBondContact O-CG 3.35Å; Y134-Q138 PolarHBondContact O-N 3.34Å; Y134-Q138 PolarHBondContact OH-NE2 2.97Å; Y134-Q138 VanDerWaalsContact OH-NE2 3.11Å; Y134-L211 HydrophobicContact CD1-CD1 3.55Å; Y134-L211 HydrophobicContact CE1-CD1 3.47Å; Y134-L211 VanDerWaalsContact CE1-CD1 3.47Å
135	N	92.8	Very high	93.3	Very high	49 Å²	49	49 Å²	49	26%	0.262	23%	0.231	S	C	.	.	H	α-helix	trans	-59.9	-42.7	176.9	-178.6	74.8	0	0	0	112	M131 T132 A137 Q138 V139 F215	M131-N135 PolarHBondContact O-N 3.4Å; T132-N135 PolarHBondContact O-N 3.35Å; T132-N135 VanDerWaalsContact O-N 3.14Å; N135-A137 VanDerWaalsContact C-N 3.32Å; N135-A137 PolarHBondContact O-N 3.32Å; N135-Q138 WeakPolarHBondContact O-CB 3.31Å; N135-Q138 PolarHBondContact O-N 2.84Å; N135-V139 WeakPolarHBondContact O-CG2 3.4Å; N135-V139 PolarHBondContact O-N 2.87Å; N135-F215 HydrophobicContact CB-CE2 4.1Å; N135-F215 HydrophobicContact CB-CZ 3.92Å
136	E	93.8	Very high	93.6	Very high	118 Å²	118	44.4 Å²	44.4	55%	0.551	21%	0.214	S	C	*	.	H	α-helix	trans	-57.8	-43.6	173.9	-72.7	172.1	175.9	0	0	112	T132 Y134 Q138 V139 D140	T132-E136 WeakPolarHBondContact O-CG 3.43Å; T132-E136 PolarHBondContact O-N 3.49Å; Y134-E136 VanDerWaalsContact C-N 3.34Å; Y134-E136 PolarHBondContact O-N 3.15Å; E136-Q138 VanDerWaalsContact C-N 3.34Å; E136-Q138 PolarHBondContact O-N 3.42Å; E136-V139 PolarHBondContact O-N 3.13Å; E136-D140 PolarHBondContact O-N 3.49Å
137	A	94.8	Very high	93.8	Very high	10 Å²	10	43 Å²	43	8%	0.083	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-38.5	176.4	0	0	0	0	0	112.4	K57 Y60 K133 Y134 N135 F141	K57-A137 HydrophobicContact CD-CB 4.29Å; K57-A137 HydrophobicContact CG-CB 3.69Å; Y60-A137 HydrophobicContact CE2-CB 4.33Å; K133-A137 PolarHBondContact O-N 3Å; K133-A137 VanDerWaalsContact O-N 3.15Å; Y134-A137 WeakPolarHBondContact O-CB 3.43Å; Y134-A137 PolarHBondContact O-N 3.31Å; Y134-A137 VanDerWaalsContact O-N 3.14Å; N135-A137 VanDerWaalsContact C-N 3.32Å; N135-A137 PolarHBondContact O-N 3.32Å; A137-F141 WeakPolarHBondContact O-CB 3.38Å; A137-F141 PolarHBondContact O-N 3.04Å; A137-F141 VanDerWaalsContact O-N 3.08Å
138	Q	94.6	Very high	93.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.9	-50.2	175.4	-70.4	-174.9	-43.6	0	0	110.8	Y134 N135 E136 D140 F141 R142 L204 S207 I208	Y134-Q138 HydrophobicContact CD2-CG 4.2Å; Y134-Q138 HydrophobicContact CE2-CG 3.91Å; Y134-Q138 WeakPolarHBondContact O-CG 3.35Å; Y134-Q138 PolarHBondContact O-N 3.34Å; Y134-Q138 PolarHBondContact OH-NE2 2.97Å; Y134-Q138 VanDerWaalsContact OH-NE2 3.11Å; N135-Q138 WeakPolarHBondContact O-CB 3.31Å; N135-Q138 PolarHBondContact O-N 2.84Å; E136-Q138 VanDerWaalsContact C-N 3.34Å; E136-Q138 PolarHBondContact O-N 3.42Å; Q138-D140 PolarHBondContact O-N 3.38Å; Q138-F141 PolarHBondContact O-N 3.12Å; Q138-F141 VanDerWaalsContact O-N 3.17Å; Q138-R142 PolarHBondContact O-N 2.86Å; Q138-L204 HydrophobicContact CB-CD1 3.64Å; Q138-L204 HydrophobicContact CB-CD2 4.43Å; Q138-L204 HydrophobicContact CB-CG 4.22Å; Q138-L204 HydrophobicContact CG-CD1 3.66Å; Q138-L204 WeakPolarHBondContact O-CD2 3.44Å; Q138-S207 PolarHBondContact NE2-OG 3.19Å; Q138-I208 HydrophobicContact CB-CD1 4.07Å; Q138-I208 HydrophobicContact CB-CG1 4.09Å; Q138-I208 VanDerWaalsContact OE1-CG1 3.26Å
139	V	94.3	Very high	93.9	Very high	63 Å²	63	46.5 Å²	46.5	38%	0.382	23%	0.227	S	C	.	.	H	α-helix	trans	-59.9	-44.7	178.5	173.9	0	0	0	0	111.5	N135 E136 F141 R142 E143	N135-V139 WeakPolarHBondContact O-CG2 3.4Å; N135-V139 PolarHBondContact O-N 2.87Å; E136-V139 PolarHBondContact O-N 3.13Å; V139-F141 VanDerWaalsContact C-N 3.33Å; V139-F141 PolarHBondContact O-N 3.33Å; V139-R142 WeakPolarHBondContact O-CB 3.27Å; V139-R142 PolarHBondContact O-N 3.18Å; V139-R142 VanDerWaalsContact O-N 3.16Å; V139-E143 HydrophobicContact CG1-CG 4.42Å; V139-E143 WeakPolarHBondContact O-CG 3.35Å; V139-E143 PolarHBondContact O-N 3.25Å
140	D	95.8	Very high	94	Very high	75 Å²	75	44.1 Å²	44.1	40%	0.401	22%	0.216	S	C	.	.	H	α-helix	trans	-59.9	-41.8	175.4	177.6	67	0	0	0	111.9	E136 Q138 E143 R144	E136-D140 PolarHBondContact O-N 3.49Å; Q138-D140 PolarHBondContact O-N 3.38Å; D140-E143 PolarHBondContact O-N 3.24Å; D140-R144 VanDerWaalsContact CG-NE 3.29Å; D140-R144 WeakPolarHBondContact O-CB 3.49Å; D140-R144 VanDerWaalsContact O-CG 3.25Å; D140-R144 WeakPolarHBondContact O-CG 3.4Å; D140-R144 PolarHBondContact O-N 3.47Å; D140-R144 IonicContact OD1-CZ 3.59Å; D140-R144 IonicContact OD1-NE 2.61Å; D140-R144 PolarHBondContact OD1-NE 3.28Å; D140-R144 IonicContact OD1-NH2 3.71Å; D140-R144 PolarHBondContact OD1-NH2 2.99Å; D140-R144 IonicContact OD2-CZ 3.8Å; D140-R144 IonicContact OD2-NE 3.74Å; D140-R144 PolarHBondContact OD2-NE 3.33Å; D140-R144 IonicContact OD2-NH2 2.69Å; D140-R144 PolarHBondContact OD2-NH2 3.39Å
141	F	95.8	Very high	93.9	Very high	5 Å²	5	51.4 Å²	51.4	2%	0.022	24%	0.243	C	C	.	.	H	α-helix	trans	-64.8	-38.5	175.4	176.8	-105	0	0	0	112.6	Y60 I63 L64 A137 Q138 V139 S145 D200 L204	Y60-F141 HydrophobicContact CD1-CB 4.03Å; Y60-F141 AromaticContact CD1-CD1 3.76Å; Y60-F141 HydrophobicContact CD1-CD1 3.76Å; Y60-F141 AromaticContact CD1-CD2 3.54Å; Y60-F141 HydrophobicContact CD1-CD2 3.54Å; Y60-F141 HydrophobicContact CD1-CE1 4.09Å; Y60-F141 AromaticContact CD1-CE2 3.86Å; Y60-F141 HydrophobicContact CD1-CE2 3.86Å; Y60-F141 AromaticContact CD1-CG 3.48Å; Y60-F141 HydrophobicContact CD1-CG 3.48Å; Y60-F141 VanDerWaalsContact CD1-CG 3.48Å; Y60-F141 HydrophobicContact CD1-CZ 4.14Å; Y60-F141 HydrophobicContact CD2-CB 4Å; Y60-F141 HydrophobicContact CD2-CG 4.36Å; Y60-F141 HydrophobicContact CE1-CB 4.4Å; Y60-F141 AromaticContact CE1-CD1 3.86Å; Y60-F141 HydrophobicContact CE1-CD1 3.86Å; Y60-F141 HydrophobicContact CE1-CD2 4.44Å; Y60-F141 HydrophobicContact CE1-CE1 4.25Å; Y60-F141 AromaticContact CE1-CG 3.98Å; Y60-F141 HydrophobicContact CE1-CG 3.98Å; Y60-F141 HydrophobicContact CE2-CB 4.41Å; Y60-F141 HydrophobicContact CG-CB 3.84Å; Y60-F141 HydrophobicContact CG-CD1 4.43Å; Y60-F141 AromaticContact CG-CD2 3.69Å; Y60-F141 HydrophobicContact CG-CD2 3.69Å; Y60-F141 HydrophobicContact CG-CE2 4.36Å; Y60-F141 AromaticContact CG-CG 3.73Å; Y60-F141 HydrophobicContact CG-CG 3.73Å; I63-F141 HydrophobicContact CB-CE2 4.29Å; I63-F141 HydrophobicContact CG2-CE2 3.85Å; I63-F141 HydrophobicContact CG2-CZ 3.87Å; L64-F141 HydrophobicContact CD1-CD2 3.74Å; L64-F141 HydrophobicContact CD1-CE2 4.22Å; L64-F141 HydrophobicContact CD2-CD2 4.19Å; L64-F141 HydrophobicContact CD2-CE2 3.99Å; L64-F141 HydrophobicContact CG-CD2 3.81Å; L64-F141 HydrophobicContact CG-CE2 3.74Å; A137-F141 WeakPolarHBondContact O-CB 3.38Å; A137-F141 PolarHBondContact O-N 3.04Å; A137-F141 VanDerWaalsContact O-N 3.08Å; Q138-F141 PolarHBondContact O-N 3.12Å; Q138-F141 VanDerWaalsContact O-N 3.17Å; V139-F141 VanDerWaalsContact C-N 3.33Å; V139-F141 PolarHBondContact O-N 3.33Å; F141-S145 VanDerWaalsContact O-CB 3.31Å; F141-S145 WeakPolarHBondContact O-CB 3.42Å; F141-S145 PolarHBondContact O-N 3.21Å; F141-S145 PolarHBondContact O-OG 3.43Å; F141-D200 HydrophobicContact CE1-CB 4.15Å; F141-D200 HydrophobicContact CZ-CB 4.15Å; F141-L204 HydrophobicContact CD1-CD1 4.15Å; F141-L204 HydrophobicContact CD1-CD2 4.14Å
142	R	95.6	Very high	93.8	Very high	36 Å²	36	52.6 Å²	52.6	14%	0.136	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-54.1	174.6	-168	-171	179	-95.9	1.6	111.2	Q138 V139 R144 S145 K146 E166 I201 L204 E205	Q138-R142 PolarHBondContact O-N 2.86Å; V139-R142 WeakPolarHBondContact O-CB 3.27Å; V139-R142 PolarHBondContact O-N 3.18Å; V139-R142 VanDerWaalsContact O-N 3.16Å; R142-R144 VanDerWaalsContact C-N 3.33Å; R142-R144 PolarHBondContact O-N 3.41Å; R142-S145 WeakPolarHBondContact O-CB 3.47Å; R142-S145 PolarHBondContact O-N 3.03Å; R142-S145 VanDerWaalsContact O-N 3.08Å; R142-K146 PolarHBondContact O-N 2.92Å; R142-E166 IonicContact CZ-OE1 3.91Å; R142-E166 VanDerWaalsContact CZ-OE1 3.27Å; R142-E166 IonicContact NH1-OE1 2.77Å; R142-E166 PolarHBondContact NH1-OE1 2.77Å; R142-E166 IonicContact NH1-OE2 2.66Å; R142-E166 IonicContact NH2-OE1 2.74Å; R142-E166 PolarHBondContact NH2-OE1 3.24Å; R142-I201 HydrophobicContact CG-CG2 4.33Å; R142-L204 HydrophobicContact CB-CD2 3.52Å; R142-L204 HydrophobicContact CG-CD2 4.13Å; R142-E205 IonicContact CZ-OE1 3.82Å; R142-E205 IonicContact NE-OE1 2.89Å; R142-E205 PolarHBondContact NE-OE1 3.2Å; R142-E205 VanDerWaalsContact NE-OE1 3.1Å; R142-E205 IonicContact NH2-OE1 3.71Å; R142-E205 PolarHBondContact NH2-OE1 2.75Å
143	E	95.3	Very high	93.8	Very high	86 Å²	86	50 Å²	50	40%	0.402	23%	0.232	S	C	.	.	H	α-helix	trans	-62.6	-41.4	-176.4	-70.4	-55.2	115	0	0	111.5	V139 D140 S145 K146 G147	V139-E143 HydrophobicContact CG1-CG 4.42Å; V139-E143 WeakPolarHBondContact O-CG 3.35Å; V139-E143 PolarHBondContact O-N 3.25Å; D140-E143 PolarHBondContact O-N 3.24Å; E143-S145 VanDerWaalsContact C-N 3.34Å; E143-S145 PolarHBondContact O-N 2.79Å; E143-K146 WeakPolarHBondContact O-CB 3.21Å; E143-K146 PolarHBondContact O-N 3.44Å; E143-G147 PolarHBondContact O-N 2.92Å
144	R	95.3	Very high	93.6	Very high	139 Å²	139	50.7 Å²	50.7	53%	0.525	24%	0.237	S	C	.	.	H	α-helix	trans	-65.7	-37.6	174.3	-69.6	178.2	-170.2	-141.7	7.5	112.5	L64 D140 R142 G147 R148	L64-R144 HydrophobicContact CD1-CB 3.63Å; L64-R144 HydrophobicContact CD1-CG 4.27Å; L64-R144 HydrophobicContact CD2-CB 4.06Å; D140-R144 VanDerWaalsContact CG-NE 3.29Å; D140-R144 WeakPolarHBondContact O-CB 3.49Å; D140-R144 VanDerWaalsContact O-CG 3.25Å; D140-R144 WeakPolarHBondContact O-CG 3.4Å; D140-R144 PolarHBondContact O-N 3.47Å; D140-R144 IonicContact OD1-CZ 3.59Å; D140-R144 IonicContact OD1-NE 2.61Å; D140-R144 PolarHBondContact OD1-NE 3.28Å; D140-R144 IonicContact OD1-NH2 3.71Å; D140-R144 PolarHBondContact OD1-NH2 2.99Å; D140-R144 IonicContact OD2-CZ 3.8Å; D140-R144 IonicContact OD2-NE 3.74Å; D140-R144 PolarHBondContact OD2-NE 3.33Å; D140-R144 IonicContact OD2-NH2 2.69Å; D140-R144 PolarHBondContact OD2-NH2 3.39Å; R142-R144 VanDerWaalsContact C-N 3.33Å; R142-R144 PolarHBondContact O-N 3.41Å; R144-G147 PolarHBondContact O-N 3.23Å; R144-R148 VanDerWaalsContact O-CG 3.29Å; R144-R148 WeakPolarHBondContact O-CG 3.36Å; R144-R148 PolarHBondContact O-N 2.98Å
145	S	94.6	Very high	93.3	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66.1	-41.7	175.9	-63	0	0	0	0	111.3	F141 R142 E143 R148 I149	F141-S145 VanDerWaalsContact O-CB 3.31Å; F141-S145 WeakPolarHBondContact O-CB 3.42Å; F141-S145 PolarHBondContact O-N 3.21Å; F141-S145 PolarHBondContact O-OG 3.43Å; R142-S145 WeakPolarHBondContact O-CB 3.47Å; R142-S145 PolarHBondContact O-N 3.03Å; R142-S145 VanDerWaalsContact O-N 3.08Å; E143-S145 VanDerWaalsContact C-N 3.34Å; E143-S145 PolarHBondContact O-N 2.79Å; S145-R148 WeakPolarHBondContact O-CB 3.16Å; S145-R148 PolarHBondContact O-N 3.38Å; S145-I149 WeakPolarHBondContact O-CG1 3.3Å; S145-I149 PolarHBondContact O-N 2.84Å
146	K	94.4	Very high	93	Very high	6 Å²	6	53.4 Å²	53.4	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-57.8	-50.7	172.1	179.1	-178.3	178	-178.6	0	111.2	R142 E143 R148 I149 Q150 D162 L165 E166 L169	R142-K146 PolarHBondContact O-N 2.92Å; E143-K146 WeakPolarHBondContact O-CB 3.21Å; E143-K146 PolarHBondContact O-N 3.44Å; K146-R148 VanDerWaalsContact C-N 3.27Å; K146-R148 PolarHBondContact O-N 2.96Å; K146-I149 WeakPolarHBondContact O-CB 3.14Å; K146-I149 PolarHBondContact O-N 3.13Å; K146-Q150 PolarHBondContact O-N 3.45Å; K146-D162 WeakPolarHBondContact CE-OD1 3.47Å; K146-D162 PolarHBondContact NZ-O 3.05Å; K146-D162 IonicContact NZ-OD1 2.88Å; K146-D162 PolarHBondContact NZ-OD1 2.79Å; K146-D162 IonicContact NZ-OD2 3.97Å; K146-D162 PolarHBondContact NZ-OD2 2.87Å; K146-L165 HydrophobicContact CD-CD2 4.4Å; K146-L165 HydrophobicContact CG-CD2 3.54Å; K146-L165 HydrophobicContact CG-CG 4.08Å; K146-E166 WeakPolarHBondContact CD-OE2 3.36Å; K146-E166 WeakPolarHBondContact CE-OE2 3.49Å; K146-E166 IonicContact NZ-OE2 3.34Å; K146-E166 PolarHBondContact NZ-OE2 2.93Å; K146-L169 HydrophobicContact CB-CD1 4.39Å; K146-L169 HydrophobicContact CD-CD1 4.29Å; K146-L169 HydrophobicContact CG-CD1 4.04Å
147	G	93.9	Very high	92.5	Very high	35 Å²	35	51 Å²	51	36%	0.361	26%	0.257	S	S	.	.	H	α-helix	trans	-60.4	-33.1	177.7	0	0	0	0	0	113.7	E143 R144 R151	E143-G147 PolarHBondContact O-N 2.92Å; R144-G147 PolarHBondContact O-N 3.23Å; G147-R151 PolarHBondContact O-N 2.96Å; G147-R151 VanDerWaalsContact O-N 3.1Å
148	R	92.7	Very high	92	Very high	115 Å²	115	53 Å²	53	43%	0.434	26%	0.264	S	S	.	.	H	α-helix	trans	-65.9	-46	171.7	-70.6	-73.5	-170.9	175.7	5.9	111.8	L64 R144 S145 K146 Q150 R151 Q152	L64-R148 PolarHBondContact O-NH2 2.75Å; R144-R148 VanDerWaalsContact O-CG 3.29Å; R144-R148 WeakPolarHBondContact O-CG 3.36Å; R144-R148 PolarHBondContact O-N 2.98Å; S145-R148 WeakPolarHBondContact O-CB 3.16Å; S145-R148 PolarHBondContact O-N 3.38Å; K146-R148 VanDerWaalsContact C-N 3.27Å; K146-R148 PolarHBondContact O-N 2.96Å; R148-Q150 VanDerWaalsContact C-N 3.33Å; R148-Q150 PolarHBondContact O-N 3.37Å; R148-R151 PolarHBondContact O-N 3.34Å; R148-Q152 WeakPolarHBondContact O-CG 3.41Å; R148-Q152 PolarHBondContact O-N 3.19Å
149	I	92.4	Very high	91.6	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.4	-47.3	176	-67.4	168.3	0	0	0	110.3	S145 K146 R151 Q152 L153 L165 L169 F177 I194 R197 H198 I201	S145-I149 WeakPolarHBondContact O-CG1 3.3Å; S145-I149 PolarHBondContact O-N 2.84Å; K146-I149 WeakPolarHBondContact O-CB 3.14Å; K146-I149 PolarHBondContact O-N 3.13Å; I149-R151 VanDerWaalsContact C-N 3.29Å; I149-R151 PolarHBondContact O-N 3.34Å; I149-Q152 PolarHBondContact O-N 3.44Å; I149-Q152 VanDerWaalsContact O-N 3.12Å; I149-L153 HydrophobicContact CG2-CD1 4.01Å; I149-L153 HydrophobicContact CG2-CG 4.39Å; I149-L153 WeakPolarHBondContact O-CG 3.47Å; I149-L153 PolarHBondContact O-N 3.47Å; I149-L165 HydrophobicContact CG2-CD1 3.7Å; I149-L169 HydrophobicContact CD1-CD2 3.92Å; I149-F177 HydrophobicContact CG2-CD1 4.22Å; I149-F177 HydrophobicContact CG2-CE1 3.93Å; I149-I194 HydrophobicContact CG1-CG2 4.48Å; I149-I194 HydrophobicContact CG2-CG1 4.24Å; I149-I194 HydrophobicContact CG2-CG2 3.92Å; I149-R197 HydrophobicContact CD1-CB 3.79Å; I149-R197 HydrophobicContact CG1-CB 3.61Å; I149-R197 HydrophobicContact CG1-CG 4.34Å; I149-H198 HydrophobicContact CD1-CB 4.46Å; I149-I201 HydrophobicContact CD1-CD1 3.77Å
150	Q	93.4	Very high	91.3	Very high	50 Å²	50	59.6 Å²	59.6	23%	0.234	29%	0.289	C	S	.	.	H	α-helix	trans	-54.7	-47.8	177.4	-164.4	176.6	18.3	0	0	111.3	K146 R148 Q152 L153 E154 T160 L165	K146-Q150 PolarHBondContact O-N 3.45Å; R148-Q150 VanDerWaalsContact C-N 3.33Å; R148-Q150 PolarHBondContact O-N 3.37Å; Q150-Q152 VanDerWaalsContact C-N 3.34Å; Q150-Q152 PolarHBondContact O-N 3.05Å; Q150-L153 WeakPolarHBondContact O-CB 3.43Å; Q150-L153 PolarHBondContact O-N 3.37Å; Q150-E154 WeakPolarHBondContact O-CG 3.37Å; Q150-E154 PolarHBondContact O-N 3.34Å; Q150-T160 PolarHBondContact NE2-O 2.75Å; Q150-L165 HydrophobicContact CB-CD2 3.62Å; Q150-L165 HydrophobicContact CG-CD2 4.12Å
151	R	91.9	Very high	91.2	Very high	158 Å²	158	59.3 Å²	59.3	60%	0.596	29%	0.29	S	S	*	.	H	α-helix	trans	-65	-36.2	179.4	-171.8	151.5	-174.7	83.7	-1.6	113	G147 R148 I149 E154 I155	G147-R151 PolarHBondContact O-N 2.96Å; G147-R151 VanDerWaalsContact O-N 3.1Å; R148-R151 PolarHBondContact O-N 3.34Å; I149-R151 VanDerWaalsContact C-N 3.29Å; I149-R151 PolarHBondContact O-N 3.34Å; R151-E154 IonicContact NH1-OE2 2.82Å; R151-E154 PolarHBondContact O-N 2.86Å; R151-I155 WeakPolarHBondContact O-CG1 3.44Å; R151-I155 PolarHBondContact O-N 2.76Å; R151-I155 VanDerWaalsContact O-N 3.17Å
152	Q	90.8	Very high	90.9	Very high	28 Å²	28	62.5 Å²	62.5	13%	0.131	31%	0.307	C	S	.	.	H	α-helix	trans	-68.8	-35.6	175.1	-66.3	-57.1	-23.1	0	0	112.1	R148 I149 Q150 I155 T156 A190 E193 I194	R148-Q152 WeakPolarHBondContact O-CG 3.41Å; R148-Q152 PolarHBondContact O-N 3.19Å; I149-Q152 PolarHBondContact O-N 3.44Å; I149-Q152 VanDerWaalsContact O-N 3.12Å; Q150-Q152 VanDerWaalsContact C-N 3.34Å; Q150-Q152 PolarHBondContact O-N 3.05Å; Q152-I155 PolarHBondContact O-N 3.31Å; Q152-T156 WeakPolarHBondContact O-CG2 3.21Å; Q152-T156 PolarHBondContact O-N 3.22Å; Q152-A190 HydrophobicContact CB-CB 4.32Å; Q152-E193 HydrophobicContact CG-CB 4.41Å; Q152-E193 HydrophobicContact CG-CG 4.13Å; Q152-E193 PolarHBondContact NE2-OE1 2.98Å; Q152-E193 PolarHBondContact NE2-OE2 3.38Å; Q152-I194 HydrophobicContact CB-CD1 3.72Å; Q152-I194 HydrophobicContact CB-CG1 3.56Å; Q152-I194 HydrophobicContact CG-CG1 4.35Å
153	L	90	Very high	90.7	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-64.5	-40.3	172.5	-69.7	170.1	0	0	0	111.9	I149 Q150 I155 T156 G157 K158 L165 M168 F177 I181 I194	I149-L153 HydrophobicContact CG2-CD1 4.01Å; I149-L153 HydrophobicContact CG2-CG 4.39Å; I149-L153 WeakPolarHBondContact O-CG 3.47Å; I149-L153 PolarHBondContact O-N 3.47Å; Q150-L153 WeakPolarHBondContact O-CB 3.43Å; Q150-L153 PolarHBondContact O-N 3.37Å; L153-I155 VanDerWaalsContact C-N 3.31Å; L153-I155 PolarHBondContact O-N 3.13Å; L153-T156 PolarHBondContact O-N 3.14Å; L153-T156 PolarHBondContact O-OG1 3.32Å; L153-G157 PolarHBondContact O-N 3.12Å; L153-K158 CarbonylContact C-O 3.58Å; L153-K158 HydrophobicContact CD2-CD 4.29Å; L153-K158 CarbonylContact O-C 3.55Å; L153-K158 PolarHBondContact O-N 2.9Å; L153-L165 HydrophobicContact CD1-CD1 3.97Å; L153-M168 HydrophobicContact CD1-CE 4.32Å; L153-F177 HydrophobicContact CD1-CD1 4.34Å; L153-F177 HydrophobicContact CD2-CD1 4.4Å; L153-I181 HydrophobicContact CD2-CD1 4.41Å; L153-I194 HydrophobicContact CD2-CD1 3.77Å; L153-I194 HydrophobicContact CG-CD1 3.96Å
154	E	90.1	Very high	90.5	Very high	90 Å²	90	67.9 Å²	67.9	42%	0.421	33%	0.334	S	S	.	.	H	α-helix	trans	-61.5	-39.3	174.7	-70.7	-179.1	164.4	0	0	112.4	Q150 R151 T156 G157 K158	Q150-E154 WeakPolarHBondContact O-CG 3.37Å; Q150-E154 PolarHBondContact O-N 3.34Å; R151-E154 IonicContact NH1-OE2 2.82Å; R151-E154 PolarHBondContact O-N 2.86Å; E154-T156 VanDerWaalsContact C-N 3.28Å; E154-T156 PolarHBondContact O-N 2.91Å; E154-G157 PolarHBondContact O-N 3.41Å; E154-K158 PolarHBondContact N-O 3.38Å
155	I	87.5	Confident	90.3	Very high	89 Å²	89	61.3 Å²	61.3	46%	0.456	31%	0.309	S	S	.	.	H	α-helix	trans	-63.2	-35.8	177.4	-70.4	165.2	0	0	0	111.3	R151 Q152 L153 G157 I186	R151-I155 WeakPolarHBondContact O-CG1 3.44Å; R151-I155 PolarHBondContact O-N 2.76Å; R151-I155 VanDerWaalsContact O-N 3.17Å; Q152-I155 PolarHBondContact O-N 3.31Å; L153-I155 VanDerWaalsContact C-N 3.31Å; L153-I155 PolarHBondContact O-N 3.13Å; I155-G157 PolarHBondContact O-N 3.5Å; I155-I186 HydrophobicContact CG2-CG2 3.89Å
156	T	86	Confident	90.2	Very high	19 Å²	19	63 Å²	63	12%	0.117	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	1	176.2	64.6	0	0	0	0	113.5	Q152 L153 E154 I181 A190	Q152-T156 WeakPolarHBondContact O-CG2 3.21Å; Q152-T156 PolarHBondContact O-N 3.22Å; L153-T156 PolarHBondContact O-N 3.14Å; L153-T156 PolarHBondContact O-OG1 3.32Å; E154-T156 VanDerWaalsContact C-N 3.28Å; E154-T156 PolarHBondContact O-N 2.91Å; T156-I181 HydrophobicContact CG2-CD1 4.07Å; T156-I181 HydrophobicContact CG2-CG2 4.15Å; T156-I181 VanDerWaalsContact OG1-CD1 3.28Å; T156-I181 WeakPolarHBondContact OG1-CD1 2.92Å; T156-A190 HydrophobicContact CG2-CB 3.5Å
157	G	83.8	Confident	90	Very high	66 Å²	66	69.4 Å²	69.4	68%	0.68	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	6.7	177.3	0	0	0	0	0	114.3	L153 E154 I155	L153-G157 PolarHBondContact O-N 3.12Å; E154-G157 PolarHBondContact O-N 3.41Å; I155-G157 PolarHBondContact O-N 3.5Å
158	K	84.6	Confident	89.8	Confident	53 Å²	53	68.3 Å²	68.3	23%	0.23	33%	0.333	C	S	.	.			trans	-98.3	101.1	176.9	-173	170.7	175.7	176.5	0	109.4	L153 E154 I176 S179	L153-K158 CarbonylContact C-O 3.58Å; L153-K158 HydrophobicContact CD2-CD 4.29Å; L153-K158 CarbonylContact O-C 3.55Å; L153-K158 PolarHBondContact O-N 2.9Å; E154-K158 PolarHBondContact N-O 3.38Å; K158-I176 PolarHBondContact NZ-O 3.49Å; K158-I176 VanDerWaalsContact NZ-O 3.14Å; K158-S179 PolarHBondContact NZ-O 3.27Å
159	K	86	Confident	89.7	Confident	190 Å²	190	63.3 Å²	63.3	83%	0.826	31%	0.314	S	S	*	.			trans	-73.8	129.4	169.3	-70.5	-173.4	177.5	-175.4	0	108.7
160	T	88.3	Confident	89.5	Confident	11 Å²	11	70.4 Å²	70.4	7%	0.067	35%	0.348	C	S	.	.			trans	-133.9	128.6	-178.3	-53.1	0	0	0	0	108.3	Q150 E164 L165 M168	Q150-T160 PolarHBondContact NE2-O 2.75Å; T160-E164 HydrophobicContact CG2-CB 3.6Å; T160-L165 HydrophobicContact CG2-CB 3.9Å; T160-M168 HydrophobicContact CG2-SD 4Å
161	T	91.9	Very high	89	Confident	69 Å²	69	70.7 Å²	70.7	42%	0.423	36%	0.355	S	S	.	.			trans	-69	166.4	172.2	58.3	0	0	0	0	110.6	E163 E164 L165	T161-E163 VanDerWaalsContact C-N 3.3Å; T161-E163 PolarHBondContact O-N 3.33Å; T161-E164 PolarHBondContact N-OE2 2.93Å; T161-E164 WeakPolarHBondContact OG1-CB 3.5Å; T161-E164 WeakPolarHBondContact OG1-CG 3.39Å; T161-E164 PolarHBondContact OG1-N 3.19Å; T161-E164 PolarHBondContact OG1-OE2 3.14Å; T161-L165 WeakPolarHBondContact O-CB 3.42Å; T161-L165 PolarHBondContact O-N 2.99Å
162	D	91.3	Very high	88.2	Confident	73 Å²	73	65.7 Å²	65.7	39%	0.39	35%	0.353	S	S	.	.	H	α-helix	trans	-65.5	-38.2	-179.1	-167.3	67.6	0	0	0	111.7	K146 L165 E166	K146-D162 WeakPolarHBondContact CE-OD1 3.47Å; K146-D162 PolarHBondContact NZ-O 3.05Å; K146-D162 IonicContact NZ-OD1 2.88Å; K146-D162 PolarHBondContact NZ-OD1 2.79Å; K146-D162 IonicContact NZ-OD2 3.97Å; K146-D162 PolarHBondContact NZ-OD2 2.87Å; D162-L165 PolarHBondContact O-N 3.27Å; D162-E166 PolarHBondContact O-N 3.06Å
163	E	91.3	Very high	87.6	Confident	140 Å²	140	68.4 Å²	68.4	65%	0.654	37%	0.369	S	S	*	.	H	α-helix	trans	-68.3	-45.6	177.7	-65.2	79.2	-175.4	0	0	112.2	T161 L165 E166 E167	T161-E163 VanDerWaalsContact C-N 3.3Å; T161-E163 PolarHBondContact O-N 3.33Å; E163-L165 VanDerWaalsContact C-N 3.27Å; E163-L165 PolarHBondContact O-N 3.49Å; E163-E166 PolarHBondContact O-N 2.95Å; E163-E167 PolarHBondContact O-N 3.26Å
164	E	90.3	Very high	86.8	Confident	95 Å²	95	71.3 Å²	71.3	44%	0.444	39%	0.387	S	S	.	.	H	α-helix	trans	-62	-37.8	175.7	-73.6	166.6	149.8	0	0	111.3	T160 T161 E167 M168	T160-E164 HydrophobicContact CG2-CB 3.6Å; T161-E164 PolarHBondContact N-OE2 2.93Å; T161-E164 WeakPolarHBondContact OG1-CB 3.5Å; T161-E164 WeakPolarHBondContact OG1-CG 3.39Å; T161-E164 PolarHBondContact OG1-N 3.19Å; T161-E164 PolarHBondContact OG1-OE2 3.14Å; E164-E167 PolarHBondContact O-N 3.49Å; E164-M168 WeakPolarHBondContact O-CG 3.38Å; E164-M168 PolarHBondContact O-N 3.09Å
165	L	91.8	Very high	86.3	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-67.3	-39.3	177.4	178	57.7	0	0	0	111.3	K146 I149 Q150 L153 T160 T161 D162 E163 M168 L169 F177	K146-L165 HydrophobicContact CD-CD2 4.4Å; K146-L165 HydrophobicContact CG-CD2 3.54Å; K146-L165 HydrophobicContact CG-CG 4.08Å; I149-L165 HydrophobicContact CG2-CD1 3.7Å; Q150-L165 HydrophobicContact CB-CD2 3.62Å; Q150-L165 HydrophobicContact CG-CD2 4.12Å; L153-L165 HydrophobicContact CD1-CD1 3.97Å; T160-L165 HydrophobicContact CG2-CB 3.9Å; T161-L165 WeakPolarHBondContact O-CB 3.42Å; T161-L165 PolarHBondContact O-N 2.99Å; D162-L165 PolarHBondContact O-N 3.27Å; E163-L165 VanDerWaalsContact C-N 3.27Å; E163-L165 PolarHBondContact O-N 3.49Å; L165-M168 WeakPolarHBondContact O-CB 3.45Å; L165-M168 PolarHBondContact O-N 3.41Å; L165-L169 HydrophobicContact CD1-CG 4.49Å; L165-L169 HydrophobicContact CG-CD1 4.45Å; L165-L169 WeakPolarHBondContact O-CG 3.37Å; L165-L169 PolarHBondContact O-N 2.95Å; L165-F177 HydrophobicContact CD1-CE1 4.13Å
166	E	92.2	Very high	86.1	Confident	37 Å²	37	67.6 Å²	67.6	17%	0.173	38%	0.378	C	S	.	.	H	α-helix	trans	-61.9	-47.1	175.7	-159.4	67.6	-162.5	0	0	111.1	R142 K146 D162 E163 M168 L169 E170	R142-E166 IonicContact CZ-OE1 3.91Å; R142-E166 VanDerWaalsContact CZ-OE1 3.27Å; R142-E166 IonicContact NH1-OE1 2.77Å; R142-E166 PolarHBondContact NH1-OE1 2.77Å; R142-E166 IonicContact NH1-OE2 2.66Å; R142-E166 IonicContact NH2-OE1 2.74Å; R142-E166 PolarHBondContact NH2-OE1 3.24Å; K146-E166 WeakPolarHBondContact CD-OE2 3.36Å; K146-E166 WeakPolarHBondContact CE-OE2 3.49Å; K146-E166 IonicContact NZ-OE2 3.34Å; K146-E166 PolarHBondContact NZ-OE2 2.93Å; D162-E166 PolarHBondContact O-N 3.06Å; E163-E166 PolarHBondContact O-N 2.95Å; E166-M168 PolarHBondContact O-N 2.84Å; E166-L169 WeakPolarHBondContact O-CB 3.2Å; E166-L169 PolarHBondContact O-N 2.99Å; E166-E170 WeakPolarHBondContact O-CG 3.36Å; E166-E170 PolarHBondContact O-N 3.41Å
167	E	90.5	Very high	85.8	Confident	139 Å²	139	66.8 Å²	66.8	65%	0.65	37%	0.372	S	S	*	.	H	α-helix	trans	-58.9	-38.6	176	-172.1	-179.2	-177.4	0	0	111.5	E163 E164 E170 S171	E163-E167 PolarHBondContact O-N 3.26Å; E164-E167 PolarHBondContact O-N 3.49Å; E167-E170 PolarHBondContact O-N 2.89Å; E167-S171 WeakPolarHBondContact O-CB 3.32Å; E167-S171 PolarHBondContact O-N 3.37Å
168	M	89.6	Confident	85.5	Confident	13 Å²	13	66.2 Å²	66.2	6%	0.064	36%	0.356	C	S	.	.	H	α-helix	trans	-63.3	-41.1	175	-72.2	173.6	67.1	0	0	112.6	L153 T160 E164 L165 E166 S171 I176 F177	L153-M168 HydrophobicContact CD1-CE 4.32Å; T160-M168 HydrophobicContact CG2-SD 4Å; E164-M168 WeakPolarHBondContact O-CG 3.38Å; E164-M168 PolarHBondContact O-N 3.09Å; L165-M168 WeakPolarHBondContact O-CB 3.45Å; L165-M168 PolarHBondContact O-N 3.41Å; E166-M168 PolarHBondContact O-N 2.84Å; M168-S171 PolarHBondContact O-OG 3.34Å; M168-I176 HydrophobicContact CB-CD1 4.39Å; M168-I176 HydrophobicContact CB-CG2 3.89Å; M168-I176 HydrophobicContact CE-CG1 4.34Å; M168-I176 HydrophobicContact CE-CG2 3.94Å; M168-I176 WeakPolarHBondContact CE-O 3.33Å; M168-I176 HydrophobicContact CG-CD1 3.88Å; M168-I176 HydrophobicContact CG-CG1 4.02Å; M168-I176 HydrophobicContact CG-CG2 4.11Å; M168-F177 HydrophobicContact CB-CE1 4Å; M168-F177 HydrophobicContact CB-CZ 4.11Å; M168-F177 HydrophobicContact CE-CD1 3.44Å; M168-F177 VanDerWaalsContact CE-CD1 3.44Å; M168-F177 HydrophobicContact CE-CE1 3.7Å; M168-F177 HydrophobicContact CE-CG 4.17Å
169	L	90.1	Very high	85.1	Confident	9 Å²	9	67.5 Å²	67.5	5%	0.047	37%	0.371	C	S	.	.	H	α-helix	trans	-67	-43.8	176.1	-66.9	170.3	0	0	0	111.3	K146 I149 L165 E166 S171 G172 F177 I201	K146-L169 HydrophobicContact CB-CD1 4.39Å; K146-L169 HydrophobicContact CD-CD1 4.29Å; K146-L169 HydrophobicContact CG-CD1 4.04Å; I149-L169 HydrophobicContact CD1-CD2 3.92Å; L165-L169 HydrophobicContact CD1-CG 4.49Å; L165-L169 HydrophobicContact CG-CD1 4.45Å; L165-L169 WeakPolarHBondContact O-CG 3.37Å; L165-L169 PolarHBondContact O-N 2.95Å; E166-L169 WeakPolarHBondContact O-CB 3.2Å; E166-L169 PolarHBondContact O-N 2.99Å; L169-S171 VanDerWaalsContact C-N 3.31Å; L169-S171 PolarHBondContact O-N 2.84Å; L169-G172 PolarHBondContact O-N 2.95Å; L169-F177 HydrophobicContact CD2-CZ 3.98Å; L169-I201 HydrophobicContact CD1-CD1 4.22Å; L169-I201 HydrophobicContact CD2-CD1 3.89Å
170	E	87.6	Confident	84.4	Confident	149 Å²	149	62 Å²	62	70%	0.696	37%	0.369	S	S	*	.	H	α-helix	trans	-67.1	-30.3	179.7	-71.5	-176.6	174.9	0	0	113.2	E166 E167 G172	E166-E170 WeakPolarHBondContact O-CG 3.36Å; E166-E170 PolarHBondContact O-N 3.41Å; E167-E170 PolarHBondContact O-N 2.89Å; E170-G172 PolarHBondContact O-N 2.92Å
171	S	84.3	Confident	83.9	Confident	57 Å²	57	62.8 Å²	62.8	40%	0.399	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-22.8	-179.9	77.8	0	0	0	0	113.7	E167 M168 L169 N173	E167-S171 WeakPolarHBondContact O-CB 3.32Å; E167-S171 PolarHBondContact O-N 3.37Å; M168-S171 PolarHBondContact O-OG 3.34Å; L169-S171 VanDerWaalsContact C-N 3.31Å; L169-S171 PolarHBondContact O-N 2.84Å; S171-N173 PolarHBondContact O-N 3.27Å; S171-N173 PolarHBondContact OG-N 3.25Å
172	G	74.3	Confident	83.1	Confident	53 Å²	53	66 Å²	66	55%	0.546	39%	0.386	S	S	.	.			trans	63.3	9.7	-178.3	0	0	0	0	0	114.5	L169 E170 P174	L169-G172 PolarHBondContact O-N 2.95Å; E170-G172 PolarHBondContact O-N 2.92Å; G172-P174 WeakPolarHBondContact O-CD 3.37Å
173	N	79.2	Confident	82.3	Confident	85 Å²	85	68.6 Å²	68.6	46%	0.455	40%	0.4	S	S	.	.			trans	-104.4	103.6	-178.4	-179	3	0	0	0	111	S171 A175 I176	S171-N173 PolarHBondContact O-N 3.27Å; S171-N173 PolarHBondContact OG-N 3.25Å; N173-A175 PolarHBondContact O-N 3.29Å; N173-A175 WeakPolarHBondContact OD1-CB 3.24Å; N173-A175 PolarHBondContact OD1-N 3.36Å; N173-A175 VanDerWaalsContact OD1-N 3.07Å; N173-I176 WeakPolarHBondContact O-CB 3.27Å; N173-I176 WeakPolarHBondContact O-CG2 3.48Å; N173-I176 PolarHBondContact O-N 3.02Å
174	P	72.8	Confident	81.9	Confident	61 Å²	61	64 Å²	64	40%	0.396	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.8	-179.2	-24	34.5	0	0	0	114.1	G172 I176 F177	G172-P174 WeakPolarHBondContact O-CD 3.37Å; P174-I176 PolarHBondContact O-N 3Å; P174-F177 WeakPolarHBondContact O-CD2 3.49Å; P174-F177 PolarHBondContact O-N 3.34Å
175	A	78.6	Confident	81.5	Confident	50 Å²	50	68 Å²	68	41%	0.413	40%	0.402	S	S	.	.	H	α-helix	trans	-68.5	-15.5	178.8	0	0	0	0	0	113.2	N173 F177 T178 S179	N173-A175 PolarHBondContact O-N 3.29Å; N173-A175 WeakPolarHBondContact OD1-CB 3.24Å; N173-A175 PolarHBondContact OD1-N 3.36Å; N173-A175 VanDerWaalsContact OD1-N 3.07Å; A175-F177 PolarHBondContact O-N 3.49Å; A175-T178 PolarHBondContact O-N 2.92Å; A175-T178 VanDerWaalsContact O-N 3.17Å; A175-T178 PolarHBondContact O-OG1 3.12Å; A175-S179 PolarHBondContact O-N 3.34Å
176	I	83.4	Confident	81.1	Confident	51 Å²	51	73.4 Å²	73.4	26%	0.262	43%	0.429	S	S	.	.	H	α-helix	trans	-64.3	-28.6	176.7	-154.7	164.3	0	0	0	111.9	K158 M168 N173 P174	K158-I176 PolarHBondContact NZ-O 3.49Å; K158-I176 VanDerWaalsContact NZ-O 3.14Å; M168-I176 HydrophobicContact CB-CD1 4.39Å; M168-I176 HydrophobicContact CB-CG2 3.89Å; M168-I176 HydrophobicContact CE-CG1 4.34Å; M168-I176 HydrophobicContact CE-CG2 3.94Å; M168-I176 WeakPolarHBondContact CE-O 3.33Å; M168-I176 HydrophobicContact CG-CD1 3.88Å; M168-I176 HydrophobicContact CG-CG1 4.02Å; M168-I176 HydrophobicContact CG-CG2 4.11Å; N173-I176 WeakPolarHBondContact O-CB 3.27Å; N173-I176 WeakPolarHBondContact O-CG2 3.48Å; N173-I176 PolarHBondContact O-N 3.02Å; P174-I176 PolarHBondContact O-N 3Å
177	F	80.5	Confident	80.7	Confident	1 Å²	1	72 Å²	72	0%	0.004	42%	0.423	C	S	.	.	H	α-helix	trans	-75.3	-29	176.8	-61	-72	0	0	0	112.5	I149 L153 L165 M168 L169 P174 A175 I181 I194 H198	I149-F177 HydrophobicContact CG2-CD1 4.22Å; I149-F177 HydrophobicContact CG2-CE1 3.93Å; L153-F177 HydrophobicContact CD1-CD1 4.34Å; L153-F177 HydrophobicContact CD2-CD1 4.4Å; L165-F177 HydrophobicContact CD1-CE1 4.13Å; M168-F177 HydrophobicContact CB-CE1 4Å; M168-F177 HydrophobicContact CB-CZ 4.11Å; M168-F177 HydrophobicContact CE-CD1 3.44Å; M168-F177 VanDerWaalsContact CE-CD1 3.44Å; M168-F177 HydrophobicContact CE-CE1 3.7Å; M168-F177 HydrophobicContact CE-CG 4.17Å; L169-F177 HydrophobicContact CD2-CZ 3.98Å; P174-F177 WeakPolarHBondContact O-CD2 3.49Å; P174-F177 PolarHBondContact O-N 3.34Å; A175-F177 PolarHBondContact O-N 3.49Å; F177-I181 WeakPolarHBondContact O-CD1 3.45Å; F177-I194 HydrophobicContact CB-CG2 3.73Å; F177-I194 HydrophobicContact CD1-CG2 3.59Å; F177-I194 HydrophobicContact CD2-CG2 4.06Å; F177-I194 HydrophobicContact CE1-CG2 4.26Å; F177-I194 HydrophobicContact CG-CG2 3.5Å; F177-I194 VanDerWaalsContact CG-CG2 3.5Å; F177-H198 HydrophobicContact CE2-CB 4.39Å; F177-H198 AromaticContact CE2-CD2 3.93Å; F177-H198 AromaticContact CE2-CG 3.99Å
178	T	77.3	Confident	80.5	Confident	54 Å²	54	71.1 Å²	71.1	33%	0.331	42%	0.418	S	S	.	.	H	α-helix	trans	-87	-18.8	-179.3	62.7	0	0	0	0	113.3	A175 G180 I181 L191	A175-T178 PolarHBondContact O-N 2.92Å; A175-T178 VanDerWaalsContact O-N 3.17Å; A175-T178 PolarHBondContact O-OG1 3.12Å; T178-G180 PolarHBondContact O-N 2.95Å; T178-I181 PolarHBondContact O-N 3.48Å; T178-L191 HydrophobicContact CG2-CD1 3.96Å; T178-L191 HydrophobicContact CG2-CD2 3.67Å; T178-L191 HydrophobicContact CG2-CG 4.35Å
179	S	75.9	Confident	80.3	Confident	80 Å²	80	76.4 Å²	76.4	56%	0.559	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	120.1	179.5	-170.6	0	0	0	0	112.1	K158 A175	K158-S179 PolarHBondContact NZ-O 3.27Å; A175-S179 PolarHBondContact O-N 3.34Å
180	G	71.3	Confident	80.2	Confident	76 Å²	76	76 Å²	76	78%	0.784	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	3.3	176.9	0	0	0	0	0	115.4	T178	T178-G180 PolarHBondContact O-N 2.95Å
181	I	77.1	Confident	80.2	Confident	27 Å²	27	70.2 Å²	70.2	14%	0.138	41%	0.414	C	S	.	.			trans	-91.5	132.5	179.7	-67.5	175.7	0	0	0	110.7	L153 T156 F177 T178 L191	L153-I181 HydrophobicContact CD2-CD1 4.41Å; T156-I181 HydrophobicContact CG2-CD1 4.07Å; T156-I181 HydrophobicContact CG2-CG2 4.15Å; T156-I181 VanDerWaalsContact OG1-CD1 3.28Å; T156-I181 WeakPolarHBondContact OG1-CD1 2.92Å; F177-I181 WeakPolarHBondContact O-CD1 3.45Å; T178-I181 PolarHBondContact O-N 3.48Å; I181-L191 HydrophobicContact CD1-CD2 3.67Å; I181-L191 HydrophobicContact CD1-CG 4.22Å; I181-L191 HydrophobicContact CG2-CD1 4.35Å
182	I	76.3	Confident	80.4	Confident	137 Å²	137	70.3 Å²	70.3	70%	0.703	42%	0.415	S	S	*	.			trans	-70.5	134.6	177.1	-62.1	171.2	0	0	0	109.7	S184 S187	I182-S184 PolarHBondContact O-N 3.18Å; I182-S187 WeakPolarHBondContact O-CB 3.41Å; I182-S187 PolarHBondContact O-OG 3.47Å
183	D	74.6	Confident	81.1	Confident	126 Å²	126	68.5 Å²	68.5	67%	0.674	39%	0.392	S	S	*	.			trans	-68.3	97.1	178	-168.5	27.1	0	0	0	111	K188	D183-K188 WeakPolarHBondContact OD1-CE 3.41Å; D183-K188 IonicContact OD1-NZ 2.88Å; D183-K188 PolarHBondContact OD1-NZ 2.98Å; D183-K188 IonicContact OD2-NZ 2.69Å
184	S	83	Confident	81.7	Confident	44 Å²	44	64.5 Å²	64.5	31%	0.308	37%	0.371	S	S	.	.			trans	-135.1	158	175.9	85.2	0	0	0	0	110	I182 I186 S187 K188	I182-S184 PolarHBondContact O-N 3.18Å; S184-I186 PolarHBondContact O-N 3.37Å; S184-I186 PolarHBondContact OG-N 2.9Å; S184-S187 WeakPolarHBondContact O-CB 3.42Å; S184-S187 PolarHBondContact O-N 3.01Å; S184-S187 VanDerWaalsContact O-N 3.13Å; S184-S187 WeakPolarHBondContact OG-CB 3.34Å; S184-S187 PolarHBondContact OG-N 3.26Å; S184-S187 PolarHBondContact OG-OG 3.45Å; S184-K188 WeakPolarHBondContact O-CG 3.35Å; S184-K188 PolarHBondContact O-N 3.39Å
185	Q	82.3	Confident	82.4	Confident	180 Å²	180	66.1 Å²	66.1	84%	0.841	37%	0.373	S	S	*	.	H	α-helix	trans	-58.4	-37.3	175.6	-84.4	-168.2	-21.4	0	0	112.3	K188 Q189	Q185-K188 PolarHBondContact O-N 2.96Å; Q185-Q189 PolarHBondContact O-N 3.44Å
186	I	82.5	Confident	83	Confident	112 Å²	112	64.9 Å²	64.9	57%	0.574	37%	0.365	S	S	*	.	H	α-helix	trans	-64.6	-44.3	176.7	-62.2	171.5	0	0	0	109.9	I155 S184 K188 Q189 A190	I155-I186 HydrophobicContact CG2-CG2 3.89Å; S184-I186 PolarHBondContact O-N 3.37Å; S184-I186 PolarHBondContact OG-N 2.9Å; I186-K188 VanDerWaalsContact C-N 3.35Å; I186-K188 PolarHBondContact O-N 3.23Å; I186-Q189 PolarHBondContact O-N 3.09Å; I186-A190 PolarHBondContact O-N 2.93Å
187	S	83.9	Confident	83.3	Confident	7 Å²	7	62.6 Å²	62.6	5%	0.049	35%	0.353	C	S	.	.	H	α-helix	trans	-61.4	-40.7	177.1	-55.3	0	0	0	0	112.4	I182 S184 Q189 A190 L191	I182-S187 WeakPolarHBondContact O-CB 3.41Å; I182-S187 PolarHBondContact O-OG 3.47Å; S184-S187 WeakPolarHBondContact O-CB 3.42Å; S184-S187 PolarHBondContact O-N 3.01Å; S184-S187 VanDerWaalsContact O-N 3.13Å; S184-S187 WeakPolarHBondContact OG-CB 3.34Å; S184-S187 PolarHBondContact OG-N 3.26Å; S184-S187 PolarHBondContact OG-OG 3.45Å; S187-Q189 PolarHBondContact O-N 3.49Å; S187-A190 PolarHBondContact O-N 3.43Å; S187-L191 VanDerWaalsContact O-CB 3.29Å; S187-L191 WeakPolarHBondContact O-CB 3.47Å; S187-L191 WeakPolarHBondContact O-CG 3.46Å; S187-L191 PolarHBondContact O-N 3.44Å
188	K	85.2	Confident	83.8	Confident	121 Å²	121	63.2 Å²	63.2	53%	0.526	36%	0.356	S	S	.	.	H	α-helix	trans	-63	-41.3	177.8	-71.2	-177.8	-172.2	-177.6	0	112.3	D183 S184 Q185 I186 S192	D183-K188 WeakPolarHBondContact OD1-CE 3.41Å; D183-K188 IonicContact OD1-NZ 2.88Å; D183-K188 PolarHBondContact OD1-NZ 2.98Å; D183-K188 IonicContact OD2-NZ 2.69Å; S184-K188 WeakPolarHBondContact O-CG 3.35Å; S184-K188 PolarHBondContact O-N 3.39Å; Q185-K188 PolarHBondContact O-N 2.96Å; I186-K188 VanDerWaalsContact C-N 3.35Å; I186-K188 PolarHBondContact O-N 3.23Å; K188-S192 PolarHBondContact O-N 2.89Å
189	Q	86.8	Confident	84.4	Confident	124 Å²	124	66.1 Å²	66.1	58%	0.579	36%	0.364	S	S	*	.	H	α-helix	trans	-67.6	-46.4	177.6	-175.4	175.2	-13.9	0	0	111.6	Q185 I186 S187 L191 S192 E193	Q185-Q189 PolarHBondContact O-N 3.44Å; I186-Q189 PolarHBondContact O-N 3.09Å; S187-Q189 PolarHBondContact O-N 3.49Å; Q189-L191 VanDerWaalsContact C-N 3.3Å; Q189-L191 PolarHBondContact O-N 3.41Å; Q189-S192 PolarHBondContact O-N 3.47Å; Q189-E193 PolarHBondContact O-N 3.02Å; Q189-E193 VanDerWaalsContact O-N 3.1Å
190	A	87.4	Confident	85.2	Confident	2 Å²	2	62.9 Å²	62.9	2%	0.017	34%	0.34	C	S	.	.	H	α-helix	trans	-59.5	-41.9	176.8	0	0	0	0	0	111.7	Q152 T156 I186 S187 E193 I194	Q152-A190 HydrophobicContact CB-CB 4.32Å; T156-A190 HydrophobicContact CG2-CB 3.5Å; I186-A190 PolarHBondContact O-N 2.93Å; S187-A190 PolarHBondContact O-N 3.43Å; A190-E193 PolarHBondContact O-N 3.17Å; A190-I194 WeakPolarHBondContact O-CD1 3.34Å; A190-I194 VanDerWaalsContact O-CG1 3.23Å; A190-I194 WeakPolarHBondContact O-CG1 3.49Å; A190-I194 PolarHBondContact O-N 3.08Å
191	L	87.4	Confident	86.2	Confident	27 Å²	27	59.3 Å²	59.3	14%	0.141	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-43.6	176.2	-77.6	174	0	0	0	113	T178 I181 S187 Q189 E193 I194 E195	T178-L191 HydrophobicContact CG2-CD1 3.96Å; T178-L191 HydrophobicContact CG2-CD2 3.67Å; T178-L191 HydrophobicContact CG2-CG 4.35Å; I181-L191 HydrophobicContact CD1-CD2 3.67Å; I181-L191 HydrophobicContact CD1-CG 4.22Å; I181-L191 HydrophobicContact CG2-CD1 4.35Å; S187-L191 VanDerWaalsContact O-CB 3.29Å; S187-L191 WeakPolarHBondContact O-CB 3.47Å; S187-L191 WeakPolarHBondContact O-CG 3.46Å; S187-L191 PolarHBondContact O-N 3.44Å; Q189-L191 VanDerWaalsContact C-N 3.3Å; Q189-L191 PolarHBondContact O-N 3.41Å; L191-E193 VanDerWaalsContact C-N 3.29Å; L191-E193 PolarHBondContact O-N 2.95Å; L191-I194 HydrophobicContact CD2-CD1 4.41Å; L191-I194 PolarHBondContact O-N 3.47Å; L191-E195 WeakPolarHBondContact O-CG 3.49Å; L191-E195 PolarHBondContact O-N 3.38Å
192	S	88.4	Confident	86.9	Confident	59 Å²	59	61.4 Å²	61.4	41%	0.413	32%	0.317	S	S	.	.	H	α-helix	trans	-61.8	-38.3	176.8	-177.8	0	0	0	0	112.2	K188 Q189 G196	K188-S192 PolarHBondContact O-N 2.89Å; Q189-S192 PolarHBondContact O-N 3.47Å; S192-G196 PolarHBondContact O-N 2.88Å; S192-G196 VanDerWaalsContact O-N 3.07Å
193	E	89.7	Confident	87.5	Confident	15 Å²	15	59.1 Å²	59.1	7%	0.07	30%	0.299	C	S	.	.	H	α-helix	trans	-66.7	-45	174.1	-177.8	173.9	153.4	0	0	111.4	P67 Q152 Q189 A190 L191 E195 G196 R197	P67-E193 WeakPolarHBondContact CB-OE2 3.44Å; P67-E193 WeakPolarHBondContact O-CG 3.47Å; Q152-E193 HydrophobicContact CG-CB 4.41Å; Q152-E193 HydrophobicContact CG-CG 4.13Å; Q152-E193 PolarHBondContact NE2-OE1 2.98Å; Q152-E193 PolarHBondContact NE2-OE2 3.38Å; Q189-E193 PolarHBondContact O-N 3.02Å; Q189-E193 VanDerWaalsContact O-N 3.1Å; A190-E193 PolarHBondContact O-N 3.17Å; L191-E193 VanDerWaalsContact C-N 3.29Å; L191-E193 PolarHBondContact O-N 2.95Å; E193-E195 PolarHBondContact O-N 2.98Å; E193-G196 PolarHBondContact O-N 2.82Å; E193-R197 HydrophobicContact CG-CG 4.39Å; E193-R197 VanDerWaalsContact O-CG 3.31Å; E193-R197 WeakPolarHBondContact O-CG 3.4Å; E193-R197 PolarHBondContact O-N 3.25Å
194	I	90.4	Very high	88.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.8	-49.6	177	-70.2	162.9	0	0	0	110.9	I149 Q152 L153 F177 A190 L191 G196 R197 H198	I149-I194 HydrophobicContact CG1-CG2 4.48Å; I149-I194 HydrophobicContact CG2-CG1 4.24Å; I149-I194 HydrophobicContact CG2-CG2 3.92Å; Q152-I194 HydrophobicContact CB-CD1 3.72Å; Q152-I194 HydrophobicContact CB-CG1 3.56Å; Q152-I194 HydrophobicContact CG-CG1 4.35Å; L153-I194 HydrophobicContact CD2-CD1 3.77Å; L153-I194 HydrophobicContact CG-CD1 3.96Å; F177-I194 HydrophobicContact CB-CG2 3.73Å; F177-I194 HydrophobicContact CD1-CG2 3.59Å; F177-I194 HydrophobicContact CD2-CG2 4.06Å; F177-I194 HydrophobicContact CE1-CG2 4.26Å; F177-I194 HydrophobicContact CG-CG2 3.5Å; F177-I194 VanDerWaalsContact CG-CG2 3.5Å; A190-I194 WeakPolarHBondContact O-CD1 3.34Å; A190-I194 VanDerWaalsContact O-CG1 3.23Å; A190-I194 WeakPolarHBondContact O-CG1 3.49Å; A190-I194 PolarHBondContact O-N 3.08Å; L191-I194 HydrophobicContact CD2-CD1 4.41Å; L191-I194 PolarHBondContact O-N 3.47Å; I194-G196 VanDerWaalsContact C-N 3.31Å; I194-G196 PolarHBondContact O-N 2.93Å; I194-R197 PolarHBondContact O-N 3.33Å; I194-H198 WeakPolarHBondContact O-CB 3.4Å; I194-H198 PolarHBondContact O-N 3.41Å
195	E	88.8	Confident	88.7	Confident	96 Å²	96	54 Å²	54	45%	0.449	27%	0.267	S	S	.	.	H	α-helix	trans	-59.4	-43	177.8	-74	178.8	173.9	0	0	111.7	L191 E193 H198 K199	L191-E195 WeakPolarHBondContact O-CG 3.49Å; L191-E195 PolarHBondContact O-N 3.38Å; E193-E195 PolarHBondContact O-N 2.98Å; E195-H198 PolarHBondContact O-N 2.87Å; E195-K199 WeakPolarHBondContact O-CB 3.46Å; E195-K199 PolarHBondContact O-N 2.92Å
196	G	89.8	Confident	89	Confident	23 Å²	23	48.3 Å²	48.3	24%	0.237	25%	0.247	C	C	.	.	H	α-helix	trans	-61	-44.3	177	0	0	0	0	0	112.8	S192 E193 I194 D200	S192-G196 PolarHBondContact O-N 2.88Å; S192-G196 VanDerWaalsContact O-N 3.07Å; E193-G196 PolarHBondContact O-N 2.82Å; I194-G196 VanDerWaalsContact C-N 3.31Å; I194-G196 PolarHBondContact O-N 2.93Å; G196-D200 PolarHBondContact O-N 3.42Å
197	R	91.3	Very high	89.2	Confident	3 Å²	3	43.5 Å²	43.5	1%	0.011	22%	0.224	C	C	.	.	H	α-helix	trans	-69.3	-42.7	177.3	-68.7	-67.7	87.6	128	-4.3	112.6	I63 I149 E193 I194 K199 D200 I201	I63-R197 PolarHBondContact O-NH1 2.92Å; I63-R197 PolarHBondContact O-NH2 3.32Å; I149-R197 HydrophobicContact CD1-CB 3.79Å; I149-R197 HydrophobicContact CG1-CB 3.61Å; I149-R197 HydrophobicContact CG1-CG 4.34Å; E193-R197 HydrophobicContact CG-CG 4.39Å; E193-R197 VanDerWaalsContact O-CG 3.31Å; E193-R197 WeakPolarHBondContact O-CG 3.4Å; E193-R197 PolarHBondContact O-N 3.25Å; I194-R197 PolarHBondContact O-N 3.33Å; R197-K199 VanDerWaalsContact C-N 3.29Å; R197-K199 PolarHBondContact O-N 2.84Å; R197-D200 IonicContact CZ-OD2 2.65Å; R197-D200 IonicContact NE-OD2 3.02Å; R197-D200 PolarHBondContact NE-OD2 2.94Å; R197-D200 IonicContact NH2-OD2 3.27Å; R197-D200 PolarHBondContact NH2-OD2 3.34Å; R197-D200 WeakPolarHBondContact O-CA 3.12Å; R197-D200 WeakPolarHBondContact O-CB 3.35Å; R197-D200 PolarHBondContact O-N 2.61Å; R197-I201 PolarHBondContact O-N 3.19Å
198	H	91.3	Very high	89.5	Confident	15 Å²	15	45 Å²	45	7%	0.069	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-43.6	175.7	175.5	-111.7	0	0	0	110.8	I149 F177 I194 E195 D200 I201 V202	I149-H198 HydrophobicContact CD1-CB 4.46Å; F177-H198 HydrophobicContact CE2-CB 4.39Å; F177-H198 AromaticContact CE2-CD2 3.93Å; F177-H198 AromaticContact CE2-CG 3.99Å; I194-H198 WeakPolarHBondContact O-CB 3.4Å; I194-H198 PolarHBondContact O-N 3.41Å; E195-H198 PolarHBondContact O-N 2.87Å; H198-D200 VanDerWaalsContact C-N 3.3Å; H198-D200 PolarHBondContact O-N 3.28Å; H198-I201 PolarHBondContact O-N 3.01Å; H198-V202 WeakPolarHBondContact O-CG2 3.47Å; H198-V202 PolarHBondContact O-N 3.38Å
199	K	90	Very high	89.6	Confident	115 Å²	115	46.3 Å²	46.3	50%	0.5	24%	0.236	S	C	.	.	H	α-helix	trans	-60.8	-38.5	174.1	-169.7	180	-175	-174.6	0	112.7	E195 R197 R203	E195-K199 WeakPolarHBondContact O-CB 3.46Å; E195-K199 PolarHBondContact O-N 2.92Å; R197-K199 VanDerWaalsContact C-N 3.29Å; R197-K199 PolarHBondContact O-N 2.84Å; K199-R203 WeakPolarHBondContact O-CG 3.42Å; K199-R203 PolarHBondContact O-N 3.03Å; K199-R203 VanDerWaalsContact O-N 3.14Å
200	D	90.7	Very high	89.2	Confident	12 Å²	12	44.5 Å²	44.5	6%	0.064	23%	0.228	C	C	.	.	H	α-helix	trans	-64.7	-42.2	176.2	-61.8	-25	0	0	0	110.9	K74 F141 G196 R197 H198 R203 L204	K74-D200 WeakPolarHBondContact CE-OD1 3.49Å; K74-D200 VanDerWaalsContact NZ-CG 3.3Å; K74-D200 IonicContact NZ-OD1 2.96Å; K74-D200 PolarHBondContact NZ-OD1 3.5Å; K74-D200 IonicContact NZ-OD2 3.66Å; K74-D200 PolarHBondContact NZ-OD2 3.14Å; K74-D200 VanDerWaalsContact NZ-OD2 3.08Å; F141-D200 HydrophobicContact CE1-CB 4.15Å; F141-D200 HydrophobicContact CZ-CB 4.15Å; G196-D200 PolarHBondContact O-N 3.42Å; R197-D200 IonicContact CZ-OD2 2.65Å; R197-D200 IonicContact NE-OD2 3.02Å; R197-D200 PolarHBondContact NE-OD2 2.94Å; R197-D200 IonicContact NH2-OD2 3.27Å; R197-D200 PolarHBondContact NH2-OD2 3.34Å; R197-D200 WeakPolarHBondContact O-CA 3.12Å; R197-D200 WeakPolarHBondContact O-CB 3.35Å; R197-D200 PolarHBondContact O-N 2.61Å; H198-D200 VanDerWaalsContact C-N 3.3Å; H198-D200 PolarHBondContact O-N 3.28Å; D200-R203 PolarHBondContact O-N 3.26Å; D200-L204 WeakPolarHBondContact O-CB 3.33Å; D200-L204 PolarHBondContact O-N 2.94Å
201	I	93.1	Very high	88.9	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-48.9	174.6	-69.1	172	0	0	0	111.2	R142 I149 L169 R197 H198 R203 L204 E205	R142-I201 HydrophobicContact CG-CG2 4.33Å; I149-I201 HydrophobicContact CD1-CD1 3.77Å; L169-I201 HydrophobicContact CD1-CD1 4.22Å; L169-I201 HydrophobicContact CD2-CD1 3.89Å; R197-I201 PolarHBondContact O-N 3.19Å; H198-I201 PolarHBondContact O-N 3.01Å; I201-R203 VanDerWaalsContact C-N 3.3Å; I201-R203 PolarHBondContact O-N 3.36Å; I201-L204 WeakPolarHBondContact O-CB 3.32Å; I201-L204 PolarHBondContact O-N 2.71Å; I201-L204 VanDerWaalsContact O-N 3.12Å; I201-E205 HydrophobicContact CG2-CG 4.24Å; I201-E205 WeakPolarHBondContact O-CG 3.3Å; I201-E205 PolarHBondContact O-N 2.91Å
202	V	91.2	Very high	88.5	Confident	70 Å²	70	47.7 Å²	47.7	42%	0.424	24%	0.241	S	C	.	.	H	α-helix	trans	-59.6	-41.6	-179.1	171	0	0	0	0	111.7	H198 E205 S206	H198-V202 WeakPolarHBondContact O-CG2 3.47Å; H198-V202 PolarHBondContact O-N 3.38Å; V202-E205 PolarHBondContact O-N 3.26Å; V202-S206 PolarHBondContact O-N 2.96Å; V202-S206 VanDerWaalsContact O-N 3.1Å
203	R	89.3	Confident	87.9	Confident	89 Å²	89	50 Å²	50	34%	0.336	25%	0.249	S	C	.	.	H	α-helix	trans	-64.5	-43.3	176	-73.4	168.7	174.5	-172.8	-16.2	111.8	E78 K199 D200 I201 S206 S207	E78-R203 IonicContact OE1-CZ 2.92Å; E78-R203 IonicContact OE1-NE 3.26Å; E78-R203 PolarHBondContact OE1-NE 3.01Å; E78-R203 IonicContact OE1-NH1 3.1Å; E78-R203 PolarHBondContact OE1-NH1 3.42Å; E78-R203 IonicContact OE1-NH2 3.5Å; E78-R203 PolarHBondContact OE1-NH2 2.93Å; K199-R203 WeakPolarHBondContact O-CG 3.42Å; K199-R203 PolarHBondContact O-N 3.03Å; K199-R203 VanDerWaalsContact O-N 3.14Å; D200-R203 PolarHBondContact O-N 3.26Å; I201-R203 VanDerWaalsContact C-N 3.3Å; I201-R203 PolarHBondContact O-N 3.36Å; R203-S206 WeakPolarHBondContact O-CB 3.3Å; R203-S206 PolarHBondContact O-N 3.24Å; R203-S207 PolarHBondContact O-N 3.07Å
204	L	92.1	Very high	87.4	Confident	9 Å²	9	49.5 Å²	49.5	5%	0.047	25%	0.247	C	C	.	.	H	α-helix	trans	-61.4	-46.8	177.5	-174.6	81.8	0	0	0	111.4	Y60 Q138 F141 R142 D200 I201 S206 S207 I208	Y60-L204 HydrophobicContact CE1-CD1 4.46Å; Q138-L204 HydrophobicContact CB-CD1 3.64Å; Q138-L204 HydrophobicContact CB-CD2 4.43Å; Q138-L204 HydrophobicContact CB-CG 4.22Å; Q138-L204 HydrophobicContact CG-CD1 3.66Å; Q138-L204 WeakPolarHBondContact O-CD2 3.44Å; F141-L204 HydrophobicContact CD1-CD1 4.15Å; F141-L204 HydrophobicContact CD1-CD2 4.14Å; R142-L204 HydrophobicContact CB-CD2 3.52Å; R142-L204 HydrophobicContact CG-CD2 4.13Å; D200-L204 WeakPolarHBondContact O-CB 3.33Å; D200-L204 PolarHBondContact O-N 2.94Å; I201-L204 WeakPolarHBondContact O-CB 3.32Å; I201-L204 PolarHBondContact O-N 2.71Å; I201-L204 VanDerWaalsContact O-N 3.12Å; L204-S206 VanDerWaalsContact C-N 3.29Å; L204-S206 PolarHBondContact O-N 2.91Å; L204-S207 CarbonylContact O-C 3.6Å; L204-S207 WeakPolarHBondContact O-CA 3.44Å; L204-S207 WeakPolarHBondContact O-CB 3.4Å; L204-S207 PolarHBondContact O-N 3.39Å; L204-I208 HydrophobicContact CD2-CD1 4.17Å; L204-I208 HydrophobicContact CG-CD1 4.02Å; L204-I208 WeakPolarHBondContact O-CG1 3.44Å; L204-I208 PolarHBondContact O-N 2.94Å
205	E	90.5	Very high	86.8	Confident	53 Å²	53	51.5 Å²	51.5	25%	0.248	26%	0.256	C	S	.	.	H	α-helix	trans	-61.8	-37.6	178.5	-73.2	179.9	173	0	0	112	R142 I201 V202 I208 K209	R142-E205 IonicContact CZ-OE1 3.82Å; R142-E205 IonicContact NE-OE1 2.89Å; R142-E205 PolarHBondContact NE-OE1 3.2Å; R142-E205 VanDerWaalsContact NE-OE1 3.1Å; R142-E205 IonicContact NH2-OE1 3.71Å; R142-E205 PolarHBondContact NH2-OE1 2.75Å; I201-E205 HydrophobicContact CG2-CG 4.24Å; I201-E205 WeakPolarHBondContact O-CG 3.3Å; I201-E205 PolarHBondContact O-N 2.91Å; V202-E205 PolarHBondContact O-N 3.26Å; E205-I208 PolarHBondContact O-N 3.06Å; E205-K209 WeakPolarHBondContact O-CB 3.3Å; E205-K209 WeakPolarHBondContact O-CG 3.47Å; E205-K209 PolarHBondContact O-N 3.31Å
206	S	89	Confident	86.3	Confident	62 Å²	62	51.8 Å²	51.8	43%	0.434	26%	0.258	S	S	.	.	H	α-helix	trans	-61.3	-44.2	170.5	-169.2	0	0	0	0	111.5	V202 R203 L204 K209 E210	V202-S206 PolarHBondContact O-N 2.96Å; V202-S206 VanDerWaalsContact O-N 3.1Å; R203-S206 WeakPolarHBondContact O-CB 3.3Å; R203-S206 PolarHBondContact O-N 3.24Å; L204-S206 VanDerWaalsContact C-N 3.29Å; L204-S206 PolarHBondContact O-N 2.91Å; S206-K209 PolarHBondContact O-N 3.46Å; S206-E210 WeakPolarHBondContact O-CG 3.36Å; S206-E210 PolarHBondContact O-N 2.94Å; S206-E210 VanDerWaalsContact O-N 3.09Å
207	S	87.8	Confident	85.5	Confident	11 Å²	11	52.3 Å²	52.3	8%	0.077	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-42.8	176.8	-179.7	0	0	0	0	112.1	T81 Q138 R203 L204 E210 L211	T81-S207 WeakPolarHBondContact CG2-OG 3.32Å; Q138-S207 PolarHBondContact NE2-OG 3.19Å; R203-S207 PolarHBondContact O-N 3.07Å; L204-S207 CarbonylContact O-C 3.6Å; L204-S207 WeakPolarHBondContact O-CA 3.44Å; L204-S207 WeakPolarHBondContact O-CB 3.4Å; L204-S207 PolarHBondContact O-N 3.39Å; S207-E210 PolarHBondContact O-N 3.34Å; S207-L211 VanDerWaalsContact O-CG 3.31Å; S207-L211 WeakPolarHBondContact O-CG 3.39Å; S207-L211 PolarHBondContact O-N 2.95Å; S207-L211 VanDerWaalsContact O-N 3.11Å
208	I	88.5	Confident	84.6	Confident	38 Å²	38	52.2 Å²	52.2	20%	0.195	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-45	177.7	-67.9	166.7	0	0	0	110.3	Q138 L204 E205 E210 L211 H212	Q138-I208 HydrophobicContact CB-CD1 4.07Å; Q138-I208 HydrophobicContact CB-CG1 4.09Å; Q138-I208 VanDerWaalsContact OE1-CG1 3.26Å; L204-I208 HydrophobicContact CD2-CD1 4.17Å; L204-I208 HydrophobicContact CG-CD1 4.02Å; L204-I208 WeakPolarHBondContact O-CG1 3.44Å; L204-I208 PolarHBondContact O-N 2.94Å; E205-I208 PolarHBondContact O-N 3.06Å; I208-E210 VanDerWaalsContact C-N 3.31Å; I208-E210 PolarHBondContact O-N 3.16Å; I208-L211 CarbonylContact O-C 3.14Å; I208-L211 PolarHBondContact O-N 3.42Å; I208-L211 VanDerWaalsContact O-N 3.1Å; I208-H212 PolarHBondContact O-N 2.91Å
209	K	87.4	Confident	83.6	Confident	148 Å²	148	54 Å²	54	64%	0.643	27%	0.273	S	S	*	.	H	α-helix	trans	-58.8	-41.6	177	-78.1	175.3	-179.3	171.7	0	112.2	E205 S206 L211 H212	E205-K209 WeakPolarHBondContact O-CB 3.3Å; E205-K209 WeakPolarHBondContact O-CG 3.47Å; E205-K209 PolarHBondContact O-N 3.31Å; S206-K209 PolarHBondContact O-N 3.46Å; K209-L211 VanDerWaalsContact C-N 3.3Å; K209-L211 PolarHBondContact O-N 3.34Å; K209-H212 WeakPolarHBondContact O-CB 3.43Å; K209-H212 PolarHBondContact O-N 3.06Å
210	E	79.2	Confident	82.8	Confident	86 Å²	86	53.7 Å²	53.7	40%	0.402	28%	0.275	S	S	.	.	H	α-helix	trans	-67.9	-30	176.9	-69.9	-179.2	155	0	0	113.3	K85 S206 S207 I208	K85-E210 WeakPolarHBondContact CD-OE2 3.43Å; K85-E210 VanDerWaalsContact CE-OE2 3.27Å; K85-E210 WeakPolarHBondContact CE-OE2 3.39Å; K85-E210 IonicContact NZ-OE1 2.62Å; K85-E210 PolarHBondContact NZ-OE1 3.22Å; K85-E210 IonicContact NZ-OE2 2.76Å; K85-E210 PolarHBondContact NZ-OE2 3.07Å; S206-E210 WeakPolarHBondContact O-CG 3.36Å; S206-E210 PolarHBondContact O-N 2.94Å; S206-E210 VanDerWaalsContact O-N 3.09Å; S207-E210 PolarHBondContact O-N 3.34Å; I208-E210 VanDerWaalsContact C-N 3.31Å; I208-E210 PolarHBondContact O-N 3.16Å
211	L	80.9	Confident	81.8	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.016	27%	0.274	C	S	.	.	H	α-helix	trans	-78.2	-29.1	174.3	-66.1	175.8	0	0	0	112.5	M131 Y134 S207 I208 K209 D213 M214 F215	M131-L211 HydrophobicContact CE-CD1 4.28Å; M131-L211 HydrophobicContact CE-CD2 3.49Å; M131-L211 VanDerWaalsContact CE-CD2 3.49Å; M131-L211 HydrophobicContact CE-CG 4.38Å; Y134-L211 HydrophobicContact CD1-CD1 3.55Å; Y134-L211 HydrophobicContact CE1-CD1 3.47Å; Y134-L211 VanDerWaalsContact CE1-CD1 3.47Å; S207-L211 VanDerWaalsContact O-CG 3.31Å; S207-L211 WeakPolarHBondContact O-CG 3.39Å; S207-L211 PolarHBondContact O-N 2.95Å; S207-L211 VanDerWaalsContact O-N 3.11Å; I208-L211 CarbonylContact O-C 3.14Å; I208-L211 PolarHBondContact O-N 3.42Å; I208-L211 VanDerWaalsContact O-N 3.1Å; K209-L211 VanDerWaalsContact C-N 3.3Å; K209-L211 PolarHBondContact O-N 3.34Å; L211-D213 VanDerWaalsContact C-N 3.3Å; L211-D213 PolarHBondContact O-N 3.02Å; L211-M214 HydrophobicContact CD2-CE 4.29Å; L211-M214 CarbonylContact O-C 3.59Å; L211-M214 WeakPolarHBondContact O-CA 3.38Å; L211-M214 WeakPolarHBondContact O-CB 3.27Å; L211-M214 PolarHBondContact O-N 3.2Å; L211-F215 HydrophobicContact CB-CD2 4.13Å; L211-F215 HydrophobicContact CB-CE2 3.91Å; L211-F215 VanDerWaalsContact O-CD2 3.25Å; L211-F215 WeakPolarHBondContact O-CD2 3.37Å; L211-F215 PolarHBondContact O-N 3.11Å
212	H	80.3	Confident	80.7	Confident	93 Å²	93	55.6 Å²	55.6	43%	0.431	29%	0.286	S	S	.	.	H	α-helix	trans	-54.9	-45	-179.3	177.3	-83.2	0	0	0	112.1	I208 K209 M214 F215 M216	I208-H212 PolarHBondContact O-N 2.91Å; K209-H212 WeakPolarHBondContact O-CB 3.43Å; K209-H212 PolarHBondContact O-N 3.06Å; H212-M214 PolarHBondContact O-N 3.01Å; H212-F215 PolarHBondContact O-N 3.39Å; H212-F215 VanDerWaalsContact O-N 3.09Å; H212-M216 VanDerWaalsContact NE2-CE 3.28Å; H212-M216 WeakPolarHBondContact NE2-CE 3.29Å; H212-M216 WeakPolarHBondContact O-CG 3.42Å; H212-M216 PolarHBondContact O-N 3.2Å
213	D	75.4	Confident	79.5	Confident	108 Å²	108	59.8 Å²	59.8	58%	0.578	30%	0.301	S	S	*	.	H	α-helix	trans	-59.6	-35.2	176.1	-68.6	-10.9	0	0	0	111.8	L211 D217	L211-D213 VanDerWaalsContact C-N 3.3Å; L211-D213 PolarHBondContact O-N 3.02Å; D213-D217 PolarHBondContact O-N 2.88Å
214	M	79.3	Confident	78.2	Confident	5 Å²	5	61 Å²	61	3%	0.025	32%	0.315	C	S	.	.	H	α-helix	trans	-70.8	-41	175.6	-152.6	-172.6	-65.3	0	0	111.8	A88 R92 F127 M131 L211 H212 M216 D217 I218	A88-M214 HydrophobicContact CB-CE 3.69Å; A88-M214 HydrophobicContact CB-SD 3.5Å; A88-M214 VanDerWaalsContact CB-SD 3.5Å; R92-M214 HydrophobicContact CB-CG 4.48Å; F127-M214 HydrophobicContact CE1-SD 4.38Å; F127-M214 HydrophobicContact CZ-SD 3.73Å; M131-M214 HydrophobicContact CE-SD 4.39Å; L211-M214 HydrophobicContact CD2-CE 4.29Å; L211-M214 CarbonylContact O-C 3.59Å; L211-M214 WeakPolarHBondContact O-CA 3.38Å; L211-M214 WeakPolarHBondContact O-CB 3.27Å; L211-M214 PolarHBondContact O-N 3.2Å; H212-M214 PolarHBondContact O-N 3.01Å; M214-M216 VanDerWaalsContact C-N 3.35Å; M214-M216 PolarHBondContact O-N 2.73Å; M214-D217 WeakPolarHBondContact O-CB 3.36Å; M214-D217 PolarHBondContact O-N 3.05Å; M214-I218 HydrophobicContact CG-CD1 3.96Å; M214-I218 VanDerWaalsContact O-CD1 3.25Å; M214-I218 WeakPolarHBondContact O-CD1 3.4Å; M214-I218 WeakPolarHBondContact O-CG1 3.49Å; M214-I218 PolarHBondContact O-N 3.1Å
215	F	76.4	Confident	76.6	Confident	41 Å²	41	61 Å²	61	18%	0.18	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-39.9	177.4	-79	-64.7	0	0	0	112.5	M131 N135 L211 H212 I218 A219	M131-F215 HydrophobicContact CB-CD1 4.46Å; M131-F215 HydrophobicContact CB-CE1 3.47Å; M131-F215 VanDerWaalsContact CB-CE1 3.47Å; M131-F215 HydrophobicContact CB-CZ 3.68Å; M131-F215 WeakPolarHBondContact O-CZ 3.32Å; N135-F215 HydrophobicContact CB-CE2 4.1Å; N135-F215 HydrophobicContact CB-CZ 3.92Å; L211-F215 HydrophobicContact CB-CD2 4.13Å; L211-F215 HydrophobicContact CB-CE2 3.91Å; L211-F215 VanDerWaalsContact O-CD2 3.25Å; L211-F215 WeakPolarHBondContact O-CD2 3.37Å; L211-F215 PolarHBondContact O-N 3.11Å; H212-F215 PolarHBondContact O-N 3.39Å; H212-F215 VanDerWaalsContact O-N 3.09Å; F215-I218 PolarHBondContact O-N 3.5Å; F215-A219 VanDerWaalsContact O-CB 3.24Å; F215-A219 WeakPolarHBondContact O-CB 3.42Å; F215-A219 PolarHBondContact O-N 3.4Å
216	M	79.1	Confident	74.9	Confident	102 Å²	102	61.3 Å²	61.3	50%	0.502	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-44.1	176.9	-68.5	-60.9	150.7	0	0	111.6	H212 M214 I218 M220	H212-M216 VanDerWaalsContact NE2-CE 3.28Å; H212-M216 WeakPolarHBondContact NE2-CE 3.29Å; H212-M216 WeakPolarHBondContact O-CG 3.42Å; H212-M216 PolarHBondContact O-N 3.2Å; M214-M216 VanDerWaalsContact C-N 3.35Å; M214-M216 PolarHBondContact O-N 2.73Å; M216-I218 PolarHBondContact O-N 3.29Å; M216-M220 PolarHBondContact O-N 3.26Å
217	D	73.5	Confident	73.2	Confident	34 Å²	34	66.3 Å²	66.3	18%	0.182	35%	0.348	C	S	.	.	H	α-helix	trans	-57	-48.5	173.4	-87.9	-32	0	0	0	111.7	R92 K96 D213 M214 L221	R92-D217 WeakPolarHBondContact CD-OD2 3.35Å; R92-D217 IonicContact CZ-OD2 3.69Å; R92-D217 IonicContact NE-OD2 3.69Å; R92-D217 IonicContact NH1-OD2 2.73Å; R92-D217 PolarHBondContact NH1-OD2 3.49Å; K96-D217 IonicContact NZ-OD1 3.74Å; K96-D217 PolarHBondContact NZ-OD1 3.47Å; K96-D217 IonicContact NZ-OD2 3.6Å; K96-D217 PolarHBondContact NZ-OD2 3.38Å; D213-D217 PolarHBondContact O-N 2.88Å; M214-D217 WeakPolarHBondContact O-CB 3.36Å; M214-D217 PolarHBondContact O-N 3.05Å; D217-L221 WeakPolarHBondContact O-CG 3.49Å; D217-L221 PolarHBondContact O-N 3.41Å
218	I	71.7	Confident	71.6	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-77.8	-30.6	-173.5	-50.9	151.9	0	0	0	112.1	F127 V128 M214 F215 M216 M220 L221 V222	F127-I218 HydrophobicContact CD1-CD1 3.58Å; F127-I218 HydrophobicContact CD1-CG1 4.05Å; F127-I218 HydrophobicContact CD1-CG2 4.33Å; F127-I218 HydrophobicContact CE1-CD1 3.15Å; F127-I218 HydrophobicContact CE1-CG1 3.79Å; F127-I218 HydrophobicContact CZ-CD1 3.91Å; V128-I218 HydrophobicContact CG2-CB 4.15Å; V128-I218 HydrophobicContact CG2-CG2 3.16Å; M214-I218 HydrophobicContact CG-CD1 3.96Å; M214-I218 VanDerWaalsContact O-CD1 3.25Å; M214-I218 WeakPolarHBondContact O-CD1 3.4Å; M214-I218 WeakPolarHBondContact O-CG1 3.49Å; M214-I218 PolarHBondContact O-N 3.1Å; F215-I218 PolarHBondContact O-N 3.5Å; M216-I218 PolarHBondContact O-N 3.29Å; I218-M220 VanDerWaalsContact C-N 3.29Å; I218-M220 PolarHBondContact O-N 3.44Å; I218-L221 WeakPolarHBondContact O-CB 3.25Å; I218-L221 PolarHBondContact O-N 2.91Å; I218-L221 VanDerWaalsContact O-N 3.15Å; I218-V222 HydrophobicContact CG2-CG2 4.3Å; I218-V222 PolarHBondContact O-N 3.42Å
219	A	70.8	Confident	69.9	Low	54 Å²	54	70.2 Å²	70.2	45%	0.446	37%	0.367	S	S	.	.	H	α-helix	trans	-58.7	-44.2	173.6	0	0	0	0	0	110.8	F215 V222 E223	F215-A219 VanDerWaalsContact O-CB 3.24Å; F215-A219 WeakPolarHBondContact O-CB 3.42Å; F215-A219 PolarHBondContact O-N 3.4Å; A219-V222 PolarHBondContact O-N 2.76Å; A219-E223 WeakPolarHBondContact O-CB 3.48Å; A219-E223 PolarHBondContact O-N 2.93Å
220	M	72	Confident	68.1	Low	107 Å²	107	69 Å²	69	53%	0.527	37%	0.367	S	S	.	.	H	α-helix	trans	-63	-42.3	173	-67.7	-174.4	-67	0	0	112.2	M216 I218 V222 N224	M216-M220 PolarHBondContact O-N 3.26Å; I218-M220 VanDerWaalsContact C-N 3.29Å; I218-M220 PolarHBondContact O-N 3.44Å; M220-V222 VanDerWaalsContact C-N 3.31Å; M220-V222 PolarHBondContact O-N 2.95Å; M220-N224 PolarHBondContact O-N 3.33Å
221	L	69.8	Low	66.9	Low	8 Å²	8	68.7 Å²	68.7	4%	0.042	37%	0.369	C	S	.	.	H	α-helix	trans	-58	-43.1	176.3	-69.3	175.9	0	0	0	111.6	K96 E99 D217 I218 Q225	K96-L221 HydrophobicContact CG-CD1 4.5Å; E99-L221 WeakPolarHBondContact OE1-CD2 3.28Å; E99-L221 WeakPolarHBondContact OE2-CD2 3.3Å; D217-L221 WeakPolarHBondContact O-CG 3.49Å; D217-L221 PolarHBondContact O-N 3.41Å; I218-L221 WeakPolarHBondContact O-CB 3.25Å; I218-L221 PolarHBondContact O-N 2.91Å; I218-L221 VanDerWaalsContact O-N 3.15Å; L221-Q225 VanDerWaalsContact O-CD 3.23Å; L221-Q225 WeakPolarHBondContact O-CG 3.49Å; L221-Q225 PolarHBondContact O-NE2 2.96Å
222	V	69.9	Low	65.7	Low	45 Å²	45	70 Å²	70	27%	0.273	38%	0.375	S	S	.	.	H	α-helix	trans	-79	-35.3	-176.4	174.7	0	0	0	0	112.6	V128 I218 A219 M220 N224 Q225	V128-V222 HydrophobicContact CG2-CG2 3.76Å; I218-V222 HydrophobicContact CG2-CG2 4.3Å; I218-V222 PolarHBondContact O-N 3.42Å; A219-V222 PolarHBondContact O-N 2.76Å; M220-V222 VanDerWaalsContact C-N 3.31Å; M220-V222 PolarHBondContact O-N 2.95Å; V222-N224 PolarHBondContact O-N 3.17Å; V222-Q225 PolarHBondContact O-N 3.34Å; V222-Q225 VanDerWaalsContact O-N 3.13Å
223	E	67.6	Low	64.4	Low	158 Å²	158	72 Å²	72	74%	0.738	39%	0.385	S	S	*	.	H	α-helix	trans	-61.6	-42.7	177.8	-172.4	169.2	-163.6	0	0	111.7	A219 Q225 G226	A219-E223 WeakPolarHBondContact O-CB 3.48Å; A219-E223 PolarHBondContact O-N 2.93Å; E223-Q225 PolarHBondContact O-N 3.48Å; E223-Q225 VanDerWaalsContact O-N 3.15Å; E223-G226 PolarHBondContact O-N 2.92Å
224	N	61.3	Low	63.6	Low	116 Å²	116	70.9 Å²	70.9	62%	0.62	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-13.3	176.5	-72.5	-17.9	0	0	0	114.1	M220 V222	M220-N224 PolarHBondContact O-N 3.33Å; V222-N224 PolarHBondContact O-N 3.17Å
225	Q	57.5	Low	62.4	Low	8 Å²	8	73 Å²	73	4%	0.037	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-9.9	-176	-69.3	172	41.2	0	0	114.3	H120 S121 S124 L221 V222 E223 E227 M228	H120-Q225 PolarHBondContact CE1-NE2 2.93Å; S121-Q225 PolarHBondContact OG-OE1 2.76Å; S124-Q225 PolarHBondContact OG-NE2 3.41Å; L221-Q225 VanDerWaalsContact O-CD 3.23Å; L221-Q225 WeakPolarHBondContact O-CG 3.49Å; L221-Q225 PolarHBondContact O-NE2 2.96Å; V222-Q225 PolarHBondContact O-N 3.34Å; V222-Q225 VanDerWaalsContact O-N 3.13Å; E223-Q225 PolarHBondContact O-N 3.48Å; E223-Q225 VanDerWaalsContact O-N 3.15Å; Q225-E227 PolarHBondContact O-N 2.62Å; Q225-M228 PolarHBondContact O-N 2.82Å; Q225-M228 VanDerWaalsContact O-N 3.15Å
226	G	55.8	Low	61.6	Low	59 Å²	59	74.8 Å²	74.8	61%	0.608	40%	0.404	S	S	*	.	H	α-helix	trans	-59.8	-39.4	-179.3	0	0	0	0	0	113.8	E223	E223-G226 PolarHBondContact O-N 2.92Å
227	E	54	Low	60.7	Low	167 Å²	167	75.7 Å²	75.7	78%	0.78	41%	0.408	S	S	*	.	H	α-helix	trans	-76.2	-23.1	175.5	-83.6	-170.2	148.4	0	0	113.5	Q225 N231	Q225-E227 PolarHBondContact O-N 2.62Å; E227-N231 PolarHBondContact O-ND2 2.86Å
228	M	52.6	Low	59.7	Low	54 Å²	54	77.9 Å²	77.9	27%	0.266	42%	0.418	S	S	.	.	H	α-helix	trans	-79.6	-31.6	-170.5	-169.8	178.9	-74.7	0	0	113	K117 Q225 N231 I232	K117-M228 HydrophobicContact CB-CG 4.34Å; K117-M228 HydrophobicContact CB-SD 3.6Å; K117-M228 HydrophobicContact CD-CE 4.02Å; K117-M228 HydrophobicContact CD-CG 4.01Å; K117-M228 HydrophobicContact CD-SD 3.49Å; K117-M228 WeakPolarHBondContact CD-SD 3.37Å; K117-M228 HydrophobicContact CG-CE 4.29Å; K117-M228 HydrophobicContact CG-CG 4.41Å; K117-M228 HydrophobicContact CG-SD 3.41Å; K117-M228 WeakPolarHBondContact CG-SD 3.44Å; Q225-M228 PolarHBondContact O-N 2.82Å; Q225-M228 VanDerWaalsContact O-N 3.15Å; M228-N231 PolarHBondContact O-N 3.42Å; M228-I232 PolarHBondContact O-N 3.13Å
229	L	53	Low	59.2	Low	78 Å²	78	80.3 Å²	80.3	41%	0.408	43%	0.432	S	S	.	.	H	α-helix	trans	-73.5	-37.2	-177.5	-142.3	129.6	0	0	0	112.2	R125 N231 I232 E233	R125-L229 VanDerWaalsContact NH1-CD1 3.32Å; L229-N231 PolarHBondContact O-N 2.98Å; L229-I232 PolarHBondContact O-N 3.31Å; L229-E233 PolarHBondContact O-N 3.5Å
230	D	50.9	Low	58.7	Low	121 Å²	121	82 Å²	82	65%	0.647	44%	0.437	S	S	*	.	H	α-helix	trans	-60.8	-35.9	173.8	-129.1	17.6	0	0	0	111	I232 L234	D230-I232 VanDerWaalsContact C-N 3.34Å; D230-I232 PolarHBondContact O-N 3.33Å; D230-L234 WeakPolarHBondContact O-CB 3.47Å; D230-L234 PolarHBondContact O-N 3.47Å; D230-L234 VanDerWaalsContact O-N 3.13Å
231	N	53.9	Low	58.1	Low	80 Å²	80	80.3 Å²	80.3	43%	0.428	43%	0.43	S	S	.	.	H	α-helix	trans	-71.4	-22.5	175.2	-78.1	-52.2	0	0	0	113.9	E227 M228 L229 N235	E227-N231 PolarHBondContact O-ND2 2.86Å; M228-N231 PolarHBondContact O-N 3.42Å; L229-N231 PolarHBondContact O-N 2.98Å; N231-N235 WeakPolarHBondContact O-CB 3.44Å; N231-N235 PolarHBondContact O-N 2.9Å; N231-N235 PolarHBondContact O-ND2 2.89Å
232	I	54.1	Low	57.9	Low	31 Å²	31	85.8 Å²	85.8	16%	0.159	46%	0.455	C	S	.	.	H	α-helix	trans	-76.9	-43.9	176.3	-66.1	173.4	0	0	0	110.4	K117 M228 L229 D230 L234 N235 V236	K117-I232 HydrophobicContact CB-CD1 4.3Å; M228-I232 PolarHBondContact O-N 3.13Å; L229-I232 PolarHBondContact O-N 3.31Å; D230-I232 VanDerWaalsContact C-N 3.34Å; D230-I232 PolarHBondContact O-N 3.33Å; I232-L234 VanDerWaalsContact C-N 3.29Å; I232-L234 PolarHBondContact O-N 3.42Å; I232-N235 PolarHBondContact O-N 3.11Å; I232-V236 HydrophobicContact CG2-CG2 4.35Å; I232-V236 WeakPolarHBondContact O-CB 3.34Å; I232-V236 VanDerWaalsContact O-CG2 3.3Å; I232-V236 WeakPolarHBondContact O-CG2 3.42Å; I232-V236 PolarHBondContact O-N 2.82Å
233	E	54.2	Low	57.9	Low	134 Å²	134	88.1 Å²	88.1	63%	0.626	47%	0.469	S	S	*	.	H	α-helix	trans	-58	-46.8	172.8	-174.7	167.3	-173	0	0	110.2	L229 N235 V236 M237	L229-E233 PolarHBondContact O-N 3.5Å; E233-N235 PolarHBondContact O-N 2.87Å; E233-V236 PolarHBondContact O-N 3.47Å; E233-M237 WeakPolarHBondContact O-CG 3Å; E233-M237 PolarHBondContact O-N 3.16Å
234	L	58.2	Low	57.7	Low	85 Å²	85	84.8 Å²	84.8	45%	0.445	45%	0.454	S	S	.	.	H	α-helix	trans	-60	-42.3	175.6	-162.3	115.2	0	0	0	112.8	D230 I232 M237 H238	D230-L234 WeakPolarHBondContact O-CB 3.47Å; D230-L234 PolarHBondContact O-N 3.47Å; D230-L234 VanDerWaalsContact O-N 3.13Å; I232-L234 VanDerWaalsContact C-N 3.29Å; I232-L234 PolarHBondContact O-N 3.42Å; L234-M237 WeakPolarHBondContact O-CB 3.42Å; L234-M237 PolarHBondContact O-N 3.04Å; L234-H238 PolarHBondContact O-CD2 2.99Å; L234-H238 PolarHBondContact O-N 3.23Å
235	N	54.1	Low	58.1	Low	50 Å²	50	85.3 Å²	85.3	27%	0.267	45%	0.451	S	S	.	.	H	α-helix	trans	-77	-27.5	179.7	-77.7	-40.5	0	0	0	114.1	N231 I232 E233 H238 T239	N231-N235 WeakPolarHBondContact O-CB 3.44Å; N231-N235 PolarHBondContact O-N 2.9Å; N231-N235 PolarHBondContact O-ND2 2.89Å; I232-N235 PolarHBondContact O-N 3.11Å; E233-N235 PolarHBondContact O-N 2.87Å; N235-H238 PolarHBondContact O-N 3.08Å; N235-T239 WeakPolarHBondContact O-CB 3.45Å; N235-T239 PolarHBondContact O-N 3.22Å; N235-T239 PolarHBondContact O-OG1 3.42Å
236	V	59.8	Low	58.6	Low	78 Å²	78	87.3 Å²	87.3	47%	0.473	47%	0.468	S	S	.	.	H	α-helix	trans	-66.9	-42.3	168.7	170.3	0	0	0	0	109.5	I232 E233 H238 T239 V240	I232-V236 HydrophobicContact CG2-CG2 4.35Å; I232-V236 WeakPolarHBondContact O-CB 3.34Å; I232-V236 VanDerWaalsContact O-CG2 3.3Å; I232-V236 WeakPolarHBondContact O-CG2 3.42Å; I232-V236 PolarHBondContact O-N 2.82Å; E233-V236 PolarHBondContact O-N 3.47Å; V236-H238 PolarHBondContact O-N 2.85Å; V236-T239 PolarHBondContact O-N 3.47Å; V236-V240 WeakPolarHBondContact O-CG2 3.46Å; V236-V240 PolarHBondContact O-N 3.47Å
237	M	59.1	Low	59.6	Low	121 Å²	121	90.8 Å²	90.8	60%	0.596	46%	0.463	S	S	*	.	H	α-helix	trans	-57.3	-46.9	170.8	-69.7	178.3	64.7	0	0	111.4	E233 L234 T239 V240 D241	E233-M237 WeakPolarHBondContact O-CG 3Å; E233-M237 PolarHBondContact O-N 3.16Å; L234-M237 WeakPolarHBondContact O-CB 3.42Å; L234-M237 PolarHBondContact O-N 3.04Å; M237-T239 VanDerWaalsContact C-N 3.34Å; M237-T239 PolarHBondContact O-N 2.8Å; M237-V240 WeakPolarHBondContact O-CB 3.33Å; M237-V240 PolarHBondContact O-N 2.85Å; M237-D241 PolarHBondContact O-N 3.46Å; M237-D241 VanDerWaalsContact O-N 3.07Å
238	H	53.5	Low	60.8	Low	81 Å²	81	86 Å²	86	38%	0.375	44%	0.442	S	S	.	.	H	α-helix	trans	-65	-33.1	176.2	-72.8	-53.1	0	0	0	114	L234 N235 V236 V240 D241 H242	L234-H238 PolarHBondContact O-CD2 2.99Å; L234-H238 PolarHBondContact O-N 3.23Å; N235-H238 PolarHBondContact O-N 3.08Å; V236-H238 PolarHBondContact O-N 2.85Å; H238-V240 VanDerWaalsContact C-N 3.33Å; H238-D241 IonicContact ND1-OD2 2.82Å; H238-D241 WeakPolarHBondContact O-CB 3.37Å; H238-D241 PolarHBondContact O-N 3.29Å; H238-H242 PolarHBondContact O-CD2 3.11Å; H238-H242 PolarHBondContact O-N 2.91Å
239	T	60.8	Low	61.9	Low	52 Å²	52	89.7 Å²	89.7	32%	0.319	46%	0.459	S	S	.	.	H	α-helix	trans	-65.5	-39	175.1	-57.9	0	0	0	0	110.9	N235 V236 M237 D241 H242 V243	N235-T239 WeakPolarHBondContact O-CB 3.45Å; N235-T239 PolarHBondContact O-N 3.22Å; N235-T239 PolarHBondContact O-OG1 3.42Å; V236-T239 PolarHBondContact O-N 3.47Å; M237-T239 VanDerWaalsContact C-N 3.34Å; M237-T239 PolarHBondContact O-N 2.8Å; T239-D241 VanDerWaalsContact C-N 3.32Å; T239-H242 PolarHBondContact O-N 3Å; T239-V243 WeakPolarHBondContact O-CG2 3.25Å; T239-V243 PolarHBondContact O-N 3.38Å
240	V	60.7	Low	63	Low	89 Å²	89	90 Å²	90	54%	0.539	47%	0.465	S	S	.	.	H	α-helix	trans	-60.4	-44	171.9	175.3	0	0	0	0	110.4	V236 M237 H238 H242 V243 E244	V236-V240 WeakPolarHBondContact O-CG2 3.46Å; V236-V240 PolarHBondContact O-N 3.47Å; M237-V240 WeakPolarHBondContact O-CB 3.33Å; M237-V240 PolarHBondContact O-N 2.85Å; H238-V240 VanDerWaalsContact C-N 3.33Å; V240-H242 PolarHBondContact O-N 3.34Å; V240-V243 PolarHBondContact O-N 2.9Å; V240-E244 WeakPolarHBondContact O-CB 3.36Å; V240-E244 PolarHBondContact O-N 3.39Å
241	D	58.6	Low	64.4	Low	71 Å²	71	90.5 Å²	90.5	38%	0.38	46%	0.461	S	S	.	.	H	α-helix	trans	-61.8	-39.8	176.6	-67.4	-18.6	0	0	0	112.7	M237 H238 T239 E244 K245	M237-D241 PolarHBondContact O-N 3.46Å; M237-D241 VanDerWaalsContact O-N 3.07Å; H238-D241 IonicContact ND1-OD2 2.82Å; H238-D241 WeakPolarHBondContact O-CB 3.37Å; H238-D241 PolarHBondContact O-N 3.29Å; T239-D241 VanDerWaalsContact C-N 3.32Å; D241-E244 PolarHBondContact O-N 3.23Å; D241-K245 WeakPolarHBondContact O-CB 3.36Å; D241-K245 WeakPolarHBondContact O-CG 3.46Å; D241-K245 PolarHBondContact O-N 3.17Å
242	H	65.8	Low	65.7	Low	123 Å²	123	92.5 Å²	92.5	57%	0.569	47%	0.466	S	S	*	.	H	α-helix	trans	-68.5	-40.3	178.1	-76.5	-62.8	0	0	0	112.4	H238 T239 V240 E244 K245 A246	H238-H242 PolarHBondContact O-CD2 3.11Å; H238-H242 PolarHBondContact O-N 2.91Å; T239-H242 PolarHBondContact O-N 3Å; V240-H242 PolarHBondContact O-N 3.34Å; H242-E244 VanDerWaalsContact C-N 3.34Å; H242-K245 PolarHBondContact O-N 2.86Å; H242-A246 WeakPolarHBondContact O-CB 3.38Å; H242-A246 PolarHBondContact O-N 3.15Å
243	V	70.3	Confident	66.6	Low	95 Å²	95	93.7 Å²	93.7	58%	0.576	48%	0.48	S	S	*	.	H	α-helix	trans	-65.9	-39.1	174.8	172.9	0	0	0	0	110.8	T239 V240 A246 R247	T239-V243 WeakPolarHBondContact O-CG2 3.25Å; T239-V243 PolarHBondContact O-N 3.38Å; V240-V243 PolarHBondContact O-N 2.9Å; V243-A246 PolarHBondContact O-N 3.42Å; V243-R247 WeakPolarHBondContact O-CB 3.48Å; V243-R247 PolarHBondContact O-N 3.38Å
244	E	64.2	Low	67.6	Low	87 Å²	87	93.5 Å²	93.5	41%	0.407	48%	0.481	S	S	.	.	H	α-helix	trans	-64.4	-44.8	175.2	178.1	146.3	-129.2	0	0	112.1	V240 D241 H242 A246 R247 D248	V240-E244 WeakPolarHBondContact O-CB 3.36Å; V240-E244 PolarHBondContact O-N 3.39Å; D241-E244 PolarHBondContact O-N 3.23Å; H242-E244 VanDerWaalsContact C-N 3.34Å; E244-A246 PolarHBondContact O-N 3.14Å; E244-R247 WeakPolarHBondContact O-CB 3.47Å; E244-R247 PolarHBondContact O-N 3.47Å; E244-R247 IonicContact OE1-CZ 2.95Å; E244-R247 IonicContact OE1-NH1 3.77Å; E244-R247 PolarHBondContact OE1-NH1 3.34Å; E244-R247 IonicContact OE1-NH2 3.45Å; E244-R247 PolarHBondContact OE1-NH2 3.34Å; E244-D248 PolarHBondContact O-N 2.95Å
245	K	68.2	Low	68.6	Low	128 Å²	128	96.1 Å²	96.1	56%	0.557	49%	0.489	S	S	*	.	H	α-helix	trans	-62	-43.3	174.2	-75.2	173.2	-176.5	169.7	0	112.1	D241 H242 R247 D248 E249	D241-K245 WeakPolarHBondContact O-CB 3.36Å; D241-K245 WeakPolarHBondContact O-CG 3.46Å; D241-K245 PolarHBondContact O-N 3.17Å; H242-K245 PolarHBondContact O-N 2.86Å; K245-R247 VanDerWaalsContact C-N 3.35Å; K245-R247 PolarHBondContact O-N 3.28Å; K245-D248 PolarHBondContact O-N 2.86Å; K245-D248 VanDerWaalsContact O-N 3.13Å; K245-E249 WeakPolarHBondContact O-CG 3.49Å; K245-E249 PolarHBondContact O-N 2.96Å
246	A	69.7	Low	69.8	Low	49 Å²	49	101 Å²	101	41%	0.405	51%	0.505	S	S	.	.	H	α-helix	trans	-63.3	-39.3	176.7	0	0	0	0	0	112.2	H242 V243 E244 D248 E249 T250	H242-A246 WeakPolarHBondContact O-CB 3.38Å; H242-A246 PolarHBondContact O-N 3.15Å; V243-A246 PolarHBondContact O-N 3.42Å; E244-A246 PolarHBondContact O-N 3.14Å; A246-D248 VanDerWaalsContact C-N 3.3Å; A246-D248 PolarHBondContact O-N 3.03Å; A246-E249 PolarHBondContact O-N 3.39Å; A246-T250 WeakPolarHBondContact O-CB 3.31Å; A246-T250 WeakPolarHBondContact O-CG2 3.37Å; A246-T250 PolarHBondContact O-N 3.26Å; A246-T250 PolarHBondContact O-OG1 3.49Å
247	R	76	Confident	70.4	Confident	133 Å²	133	103 Å²	103	50%	0.502	51%	0.509	S	S	.	.	H	α-helix	trans	-60.5	-40.4	171.8	-173.8	-160.8	71	-155.6	-5.1	111.6	V243 E244 K245 T250 K251	V243-R247 WeakPolarHBondContact O-CB 3.48Å; V243-R247 PolarHBondContact O-N 3.38Å; E244-R247 WeakPolarHBondContact O-CB 3.47Å; E244-R247 PolarHBondContact O-N 3.47Å; E244-R247 IonicContact OE1-CZ 2.95Å; E244-R247 IonicContact OE1-NH1 3.77Å; E244-R247 PolarHBondContact OE1-NH1 3.34Å; E244-R247 IonicContact OE1-NH2 3.45Å; E244-R247 PolarHBondContact OE1-NH2 3.34Å; K245-R247 VanDerWaalsContact C-N 3.35Å; K245-R247 PolarHBondContact O-N 3.28Å; R247-T250 VanDerWaalsContact C-OG1 3.31Å; R247-T250 VanDerWaalsContact CA-OG1 3.31Å; R247-T250 WeakPolarHBondContact CA-OG1 3.5Å; R247-T250 PolarHBondContact O-OG1 3.3Å; R247-K251 WeakPolarHBondContact O-CB 3.43Å; R247-K251 PolarHBondContact O-N 3.14Å; R247-K251 VanDerWaalsContact O-N 3.08Å
248	D	78.9	Confident	71.3	Confident	65 Å²	65	98.3 Å²	98.3	35%	0.348	49%	0.491	S	S	.	.	H	α-helix	trans	-73.6	-35.4	179.8	-74.7	-0.1	0	0	0	112.2	E244 K245 A246 K251 K252	E244-D248 PolarHBondContact O-N 2.95Å; K245-D248 PolarHBondContact O-N 2.86Å; K245-D248 VanDerWaalsContact O-N 3.13Å; A246-D248 VanDerWaalsContact C-N 3.3Å; A246-D248 PolarHBondContact O-N 3.03Å; D248-K251 PolarHBondContact O-N 2.93Å; D248-K252 WeakPolarHBondContact O-CG 3.31Å; D248-K252 PolarHBondContact O-N 3.38Å
249	E	76.3	Confident	72.6	Confident	133 Å²	133	99.4 Å²	99.4	62%	0.621	50%	0.496	S	S	*	.	H	α-helix	trans	-67.6	-45.1	173.5	-74.7	-173.6	179.6	0	0	112.4	K245 A246 K251 K252 A253	K245-E249 WeakPolarHBondContact O-CG 3.49Å; K245-E249 PolarHBondContact O-N 2.96Å; A246-E249 PolarHBondContact O-N 3.39Å; E249-K251 VanDerWaalsContact C-N 3.29Å; E249-K251 PolarHBondContact O-N 2.81Å; E249-K252 CarbonylContact O-C 3.56Å; E249-K252 WeakPolarHBondContact O-CB 3.44Å; E249-K252 PolarHBondContact O-N 3.43Å; E249-K252 VanDerWaalsContact O-N 3.11Å; E249-A253 WeakPolarHBondContact O-CB 3.35Å; E249-A253 PolarHBondContact O-N 2.98Å
250	T	76.6	Confident	73.4	Confident	85 Å²	85	99.6 Å²	99.6	52%	0.521	50%	0.503	S	S	.	.	H	α-helix	trans	-59.2	-40.5	173.1	46.5	0	0	0	0	111.5	A246 R247 K252 A253 M254	A246-T250 WeakPolarHBondContact O-CB 3.31Å; A246-T250 WeakPolarHBondContact O-CG2 3.37Å; A246-T250 PolarHBondContact O-N 3.26Å; A246-T250 PolarHBondContact O-OG1 3.49Å; R247-T250 VanDerWaalsContact C-OG1 3.31Å; R247-T250 VanDerWaalsContact CA-OG1 3.31Å; R247-T250 WeakPolarHBondContact CA-OG1 3.5Å; R247-T250 PolarHBondContact O-OG1 3.3Å; T250-K252 PolarHBondContact O-N 3.02Å; T250-A253 PolarHBondContact O-N 3.07Å; T250-M254 WeakPolarHBondContact O-CG 3.5Å; T250-M254 PolarHBondContact O-N 2.8Å
251	K	79.1	Confident	74.4	Confident	130 Å²	130	101.6 Å²	101.6	57%	0.565	50%	0.501	S	S	*	.	H	α-helix	trans	-63.9	-38.6	174.1	-168.4	175.8	-174.4	176.6	0	112.8	R247 D248 E249 K255	R247-K251 WeakPolarHBondContact O-CB 3.43Å; R247-K251 PolarHBondContact O-N 3.14Å; R247-K251 VanDerWaalsContact O-N 3.08Å; D248-K251 PolarHBondContact O-N 2.93Å; E249-K251 VanDerWaalsContact C-N 3.29Å; E249-K251 PolarHBondContact O-N 2.81Å; K251-K255 WeakPolarHBondContact O-CG 3.16Å; K251-K255 PolarHBondContact O-N 3.21Å
252	K	80.8	Confident	75.4	Confident	122 Å²	122	105.4 Å²	105.4	53%	0.53	51%	0.514	S	S	.	.	H	α-helix	trans	-67.1	-42.7	173.5	-74.3	171.6	-175	171.1	0	111.1	D248 E249 T250 M254 K255 Y256	D248-K252 WeakPolarHBondContact O-CG 3.31Å; D248-K252 PolarHBondContact O-N 3.38Å; E249-K252 CarbonylContact O-C 3.56Å; E249-K252 WeakPolarHBondContact O-CB 3.44Å; E249-K252 PolarHBondContact O-N 3.43Å; E249-K252 VanDerWaalsContact O-N 3.11Å; T250-K252 PolarHBondContact O-N 3.02Å; K252-M254 PolarHBondContact O-N 2.91Å; K252-K255 WeakPolarHBondContact O-CB 3.46Å; K252-K255 PolarHBondContact O-N 2.78Å; K252-K255 VanDerWaalsContact O-N 3.14Å; K252-Y256 HydrophobicContact CB-CE2 4.34Å; K252-Y256 VanDerWaalsContact O-CD2 3.31Å; K252-Y256 WeakPolarHBondContact O-CD2 3.45Å; K252-Y256 PolarHBondContact O-N 3.1Å
253	A	74.3	Confident	76.3	Confident	56 Å²	56	106 Å²	106	46%	0.463	52%	0.515	S	S	.	.	H	α-helix	trans	-59.3	-45.6	177.2	0	0	0	0	0	111.6	E249 T250 K255 Y256 Q257	E249-A253 WeakPolarHBondContact O-CB 3.35Å; E249-A253 PolarHBondContact O-N 2.98Å; T250-A253 PolarHBondContact O-N 3.07Å; A253-K255 VanDerWaalsContact C-N 3.33Å; A253-K255 PolarHBondContact O-N 2.92Å; A253-Y256 PolarHBondContact O-N 3.34Å; A253-Y256 VanDerWaalsContact O-N 3.17Å; A253-Q257 WeakPolarHBondContact O-CB 3.39Å; A253-Q257 PolarHBondContact O-N 3.47Å
254	M	73.9	Confident	76.9	Confident	130 Å²	130	106.6 Å²	106.6	64%	0.64	52%	0.515	S	S	*	.	H	α-helix	trans	-59.2	-41	173.9	-70	-178.8	77.3	0	0	112.6	T250 K252 Q257 G258	T250-M254 WeakPolarHBondContact O-CG 3.5Å; T250-M254 PolarHBondContact O-N 2.8Å; K252-M254 PolarHBondContact O-N 2.91Å; M254-Q257 PolarHBondContact O-N 3.22Å; M254-G258 PolarHBondContact O-N 2.94Å
255	K	79.9	Confident	78	Confident	140 Å²	140	107.5 Å²	107.5	61%	0.609	52%	0.521	S	S	*	.	H	α-helix	trans	-63.5	-43.6	175.1	-75.9	-177.8	177.6	-176.1	0	111.8	K251 K252 A253 G258 Q259	K251-K255 WeakPolarHBondContact O-CG 3.16Å; K251-K255 PolarHBondContact O-N 3.21Å; K252-K255 WeakPolarHBondContact O-CB 3.46Å; K252-K255 PolarHBondContact O-N 2.78Å; K252-K255 VanDerWaalsContact O-N 3.14Å; A253-K255 VanDerWaalsContact C-N 3.33Å; A253-K255 PolarHBondContact O-N 2.92Å; K255-G258 PolarHBondContact O-N 3.37Å; K255-Q259 WeakPolarHBondContact O-CG 3.33Å; K255-Q259 PolarHBondContact O-N 3.33Å
256	Y	78.8	Confident	79	Confident	154 Å²	154	106.6 Å²	106.6	60%	0.604	52%	0.521	S	S	*	.	H	α-helix	trans	-65.5	-41.1	177.6	-69.9	-44	0	0	0	112.2	K252 A253 G258 Q259 A260	K252-Y256 HydrophobicContact CB-CE2 4.34Å; K252-Y256 VanDerWaalsContact O-CD2 3.31Å; K252-Y256 WeakPolarHBondContact O-CD2 3.45Å; K252-Y256 PolarHBondContact O-N 3.1Å; A253-Y256 PolarHBondContact O-N 3.34Å; A253-Y256 VanDerWaalsContact O-N 3.17Å; Y256-G258 VanDerWaalsContact C-N 3.33Å; Y256-G258 PolarHBondContact O-N 3.25Å; Y256-Q259 PolarHBondContact O-N 3.02Å; Y256-A260 WeakPolarHBondContact O-CB 3.41Å; Y256-A260 PolarHBondContact O-N 3.43Å
257	Q	73.8	Confident	79.9	Confident	119 Å²	119	109.1 Å²	109.1	56%	0.556	53%	0.527	S	S	*	.	H	α-helix	trans	-59.6	-43.4	173.8	-168	-171.4	18.1	0	0	111.4	A253 M254 Q259 A260 R261	A253-Q257 WeakPolarHBondContact O-CB 3.39Å; A253-Q257 PolarHBondContact O-N 3.47Å; M254-Q257 PolarHBondContact O-N 3.22Å; Q257-Q259 PolarHBondContact O-N 3.32Å; Q257-A260 PolarHBondContact O-N 3.29Å; Q257-R261 WeakPolarHBondContact O-CG 3.33Å; Q257-R261 PolarHBondContact O-N 3.48Å
258	G	77.3	Confident	80.6	Confident	22 Å²	22	107.2 Å²	107.2	23%	0.227	53%	0.526	C	S	.	.	H	α-helix	trans	-62.1	-40.7	174.7	0	0	0	0	0	113.6	M254 K255 Y256 K262	M254-G258 PolarHBondContact O-N 2.94Å; K255-G258 PolarHBondContact O-N 3.37Å; Y256-G258 VanDerWaalsContact C-N 3.33Å; Y256-G258 PolarHBondContact O-N 3.25Å; G258-K262 PolarHBondContact O-N 3.42Å
259	Q	81.2	Confident	81.3	Confident	104 Å²	104	108.1 Å²	108.1	49%	0.486	53%	0.533	S	S	.	.	H	α-helix	trans	-71.1	-37.6	176.1	-70.9	-178.5	-2.8	0	0	112.6	K255 Y256 Q257 K262 K263	K255-Q259 WeakPolarHBondContact O-CG 3.33Å; K255-Q259 PolarHBondContact O-N 3.33Å; Y256-Q259 PolarHBondContact O-N 3.02Å; Q257-Q259 PolarHBondContact O-N 3.32Å; Q259-K262 PolarHBondContact O-N 3.5Å; Q259-K263 WeakPolarHBondContact O-CG 3.35Å; Q259-K263 PolarHBondContact O-N 3.12Å
260	A	78.3	Confident	82.1	Confident	56 Å²	56	105.5 Å²	105.5	46%	0.463	53%	0.527	S	S	.	.	H	α-helix	trans	-61.5	-43.2	176.4	0	0	0	0	0	111.2	Y256 Q257 K262 K263 L264	Y256-A260 WeakPolarHBondContact O-CB 3.41Å; Y256-A260 PolarHBondContact O-N 3.43Å; Q257-A260 PolarHBondContact O-N 3.29Å; A260-K262 VanDerWaalsContact C-N 3.35Å; A260-K262 PolarHBondContact O-N 3.13Å; A260-K263 PolarHBondContact O-N 3.21Å; A260-L264 WeakPolarHBondContact O-CB 3.4Å; A260-L264 PolarHBondContact O-N 3.33Å
261	R	80.2	Confident	82.8	Confident	131 Å²	131	105 Å²	105	49%	0.494	52%	0.523	S	S	.	.	H	α-helix	trans	-56.9	-45.2	173.5	-73.8	-172	-79.9	-174.4	-5.3	112.2	D17 Q257 K263 L264 I265	D17-R261 IonicContact OD2-NH1 2.86Å; Q257-R261 WeakPolarHBondContact O-CG 3.33Å; Q257-R261 PolarHBondContact O-N 3.48Å; R261-K263 PolarHBondContact O-N 3.41Å; R261-L264 WeakPolarHBondContact O-CB 3.48Å; R261-L264 PolarHBondContact O-N 3.4Å; R261-I265 WeakPolarHBondContact O-CG1 3.37Å; R261-I265 PolarHBondContact O-N 3.21Å; R261-I265 VanDerWaalsContact O-N 3.13Å
262	K	80.8	Confident	83.5	Confident	152 Å²	152	103.2 Å²	103.2	66%	0.661	52%	0.523	S	S	*	.	H	α-helix	trans	-64	-41.7	177	-67.3	-178.7	-177.2	-173.8	0	112.4	G258 Q259 A260 I265 I266	G258-K262 PolarHBondContact O-N 3.42Å; Q259-K262 PolarHBondContact O-N 3.5Å; A260-K262 VanDerWaalsContact C-N 3.35Å; A260-K262 PolarHBondContact O-N 3.13Å; K262-I265 PolarHBondContact O-N 3.5Å; K262-I266 WeakPolarHBondContact O-CG1 3.33Å; K262-I266 PolarHBondContact O-N 2.74Å; K262-I266 VanDerWaalsContact O-N 3.12Å
263	K	84.4	Confident	84.2	Confident	134 Å²	134	101.4 Å²	101.4	58%	0.583	52%	0.522	S	S	*	.	H	α-helix	trans	-65.5	-38.3	176.7	-71	179.6	-179.4	-176.1	0	111.9	Q259 A260 R261 I266 I267	Q259-K263 WeakPolarHBondContact O-CG 3.35Å; Q259-K263 PolarHBondContact O-N 3.12Å; A260-K263 PolarHBondContact O-N 3.21Å; R261-K263 PolarHBondContact O-N 3.41Å; K263-I266 PolarHBondContact O-N 2.95Å; K263-I267 WeakPolarHBondContact O-CG1 3.35Å; K263-I267 PolarHBondContact O-N 3.28Å
264	L	83.3	Confident	85	Confident	108 Å²	108	103.4 Å²	103.4	57%	0.565	52%	0.524	S	S	*	.	H	α-helix	trans	-60.2	-46.3	175.3	-171.3	77.1	0	0	0	111.2	A260 R261 I266 I267 I268	A260-L264 WeakPolarHBondContact O-CB 3.4Å; A260-L264 PolarHBondContact O-N 3.33Å; R261-L264 WeakPolarHBondContact O-CB 3.48Å; R261-L264 PolarHBondContact O-N 3.4Å; L264-I266 VanDerWaalsContact C-N 3.33Å; L264-I266 PolarHBondContact O-N 2.81Å; L264-I267 PolarHBondContact O-N 3.46Å; L264-I268 HydrophobicContact CG-CD1 4.17Å; L264-I268 WeakPolarHBondContact O-CG1 3.48Å; L264-I268 PolarHBondContact O-N 2.75Å
265	I	87.1	Confident	85.9	Confident	107 Å²	107	102.4 Å²	102.4	55%	0.549	52%	0.521	S	S	.	.	H	α-helix	trans	-60.5	-43.7	176.9	-64.2	170.9	0	0	0	110.8	R261 K262 I267 I268 V269	R261-I265 WeakPolarHBondContact O-CG1 3.37Å; R261-I265 PolarHBondContact O-N 3.21Å; R261-I265 VanDerWaalsContact O-N 3.13Å; K262-I265 PolarHBondContact O-N 3.5Å; I265-I267 VanDerWaalsContact C-N 3.34Å; I265-I267 PolarHBondContact O-N 2.94Å; I265-I268 PolarHBondContact O-N 2.92Å; I265-V269 WeakPolarHBondContact O-CG2 3.34Å; I265-V269 PolarHBondContact O-N 2.86Å
266	I	87.6	Confident	86.5	Confident	108 Å²	108	97.4 Å²	97.4	55%	0.554	51%	0.509	S	S	*	.	H	α-helix	trans	-61.2	-43.9	177.1	-67.1	166.2	0	0	0	110.9	K262 K263 L264 I268 V269 V270	K262-I266 WeakPolarHBondContact O-CG1 3.33Å; K262-I266 PolarHBondContact O-N 2.74Å; K262-I266 VanDerWaalsContact O-N 3.12Å; K263-I266 PolarHBondContact O-N 2.95Å; L264-I266 VanDerWaalsContact C-N 3.33Å; L264-I266 PolarHBondContact O-N 2.81Å; I266-I268 PolarHBondContact O-N 3.39Å; I266-V269 PolarHBondContact O-N 3.03Å; I266-V270 WeakPolarHBondContact O-CG2 3.34Å; I266-V270 PolarHBondContact O-N 2.96Å
267	I	89.8	Confident	87.1	Confident	102 Å²	102	94 Å²	94	52%	0.523	50%	0.5	S	S	.	.	H	α-helix	trans	-61.3	-44.8	176.8	-70.7	162	0	0	0	110.7	K263 L264 I265 V269 V270 V271	K263-I267 WeakPolarHBondContact O-CG1 3.35Å; K263-I267 PolarHBondContact O-N 3.28Å; L264-I267 PolarHBondContact O-N 3.46Å; I265-I267 VanDerWaalsContact C-N 3.34Å; I265-I267 PolarHBondContact O-N 2.94Å; I267-V269 VanDerWaalsContact C-N 3.35Å; I267-V269 PolarHBondContact O-N 3.47Å; I267-V270 PolarHBondContact O-N 3.5Å; I267-V271 HydrophobicContact CG2-CG2 4.44Å; I267-V271 WeakPolarHBondContact O-CG2 3.47Å; I267-V271 PolarHBondContact O-N 3.33Å
268	I	91	Very high	87.8	Confident	93 Å²	93	93 Å²	93	48%	0.477	50%	0.498	S	S	.	.	H	α-helix	trans	-58.8	-46.6	177.1	-68.9	166.8	0	0	0	110.7	L264 I265 I266 V270 V271 V272	L264-I268 HydrophobicContact CG-CD1 4.17Å; L264-I268 WeakPolarHBondContact O-CG1 3.48Å; L264-I268 PolarHBondContact O-N 2.75Å; I265-I268 PolarHBondContact O-N 2.92Å; I266-I268 PolarHBondContact O-N 3.39Å; I268-V270 VanDerWaalsContact C-N 3.35Å; I268-V270 PolarHBondContact O-N 3.02Å; I268-V271 PolarHBondContact O-N 2.98Å; I268-V272 HydrophobicContact CG2-CG2 4.44Å; I268-V272 WeakPolarHBondContact O-CG2 3.38Å; I268-V272 PolarHBondContact O-N 3.26Å
269	V	92.2	Very high	88.3	Confident	84 Å²	84	94.9 Å²	94.9	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-59.8	-44.7	178.2	171.6	0	0	0	0	111.2	I265 I266 I267 V271 V272 V273	I265-V269 WeakPolarHBondContact O-CG2 3.34Å; I265-V269 PolarHBondContact O-N 2.86Å; I266-V269 PolarHBondContact O-N 3.03Å; I267-V269 VanDerWaalsContact C-N 3.35Å; I267-V269 PolarHBondContact O-N 3.47Å; V269-V271 PolarHBondContact O-N 3.44Å; V269-V272 PolarHBondContact O-N 2.98Å; V269-V273 WeakPolarHBondContact O-CG2 3.34Å; V269-V273 PolarHBondContact O-N 3.35Å
270	V	93.2	Very high	88.6	Confident	79 Å²	79	95.4 Å²	95.4	48%	0.479	52%	0.518	S	S	.	.	H	α-helix	trans	-61.6	-44	177.9	171.4	0	0	0	0	111.4	I266 I267 I268 V272 V273 L274	I266-V270 WeakPolarHBondContact O-CG2 3.34Å; I266-V270 PolarHBondContact O-N 2.96Å; I267-V270 PolarHBondContact O-N 3.5Å; I268-V270 VanDerWaalsContact C-N 3.35Å; I268-V270 PolarHBondContact O-N 3.02Å; V270-V272 PolarHBondContact O-N 3.43Å; V270-V273 PolarHBondContact O-N 3.26Å; V270-L274 HydrophobicContact CG1-CD1 4.12Å; V270-L274 WeakPolarHBondContact O-CG 3.4Å; V270-L274 PolarHBondContact O-N 3.04Å
271	V	93.1	Very high	89.1	Confident	74 Å²	74	97.6 Å²	97.6	45%	0.448	52%	0.52	S	S	.	.	H	α-helix	trans	-62.1	-43.9	177.8	171.8	0	0	0	0	111.2	I267 I268 V269 V273 L274 L275	I267-V271 HydrophobicContact CG2-CG2 4.44Å; I267-V271 WeakPolarHBondContact O-CG2 3.47Å; I267-V271 PolarHBondContact O-N 3.33Å; I268-V271 PolarHBondContact O-N 2.98Å; V269-V271 PolarHBondContact O-N 3.44Å; V271-V273 PolarHBondContact O-N 3.21Å; V271-L274 PolarHBondContact O-N 3.49Å; V271-L275 HydrophobicContact CG1-CD1 4.16Å; V271-L275 WeakPolarHBondContact O-CG 3.35Å; V271-L275 PolarHBondContact O-N 3.34Å
272	V	93.8	Very high	89.4	Confident	93 Å²	93	96.2 Å²	96.2	56%	0.564	52%	0.522	S	S	*	.	H	α-helix	trans	-61.5	-43.6	177.8	171.2	0	0	0	0	111.4	I268 V269 V270 L275 G276	I268-V272 HydrophobicContact CG2-CG2 4.44Å; I268-V272 WeakPolarHBondContact O-CG2 3.38Å; I268-V272 PolarHBondContact O-N 3.26Å; V269-V272 PolarHBondContact O-N 2.98Å; V270-V272 PolarHBondContact O-N 3.43Å; V272-L275 PolarHBondContact O-N 2.98Å; V272-G276 PolarHBondContact O-N 3.31Å
273	V	93.8	Very high	89.5	Confident	83 Å²	83	91.1 Å²	91.1	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-62.6	-44.2	177.4	172	0	0	0	0	111.3	V269 V270 V271 L275 G276 I277	V269-V273 WeakPolarHBondContact O-CG2 3.34Å; V269-V273 PolarHBondContact O-N 3.35Å; V270-V273 PolarHBondContact O-N 3.26Å; V271-V273 PolarHBondContact O-N 3.21Å; V273-L275 PolarHBondContact O-N 2.98Å; V273-G276 PolarHBondContact O-N 3.49Å; V273-I277 HydrophobicContact CG1-CD1 4.01Å; V273-I277 WeakPolarHBondContact O-CG1 3.39Å; V273-I277 PolarHBondContact O-N 3Å
274	L	92.4	Very high	89.3	Confident	99 Å²	99	89.8 Å²	89.8	52%	0.518	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-42.6	178	-73	173.8	0	0	0	112.3	V270 V271 G276 I277 L278	V270-L274 HydrophobicContact CG1-CD1 4.12Å; V270-L274 WeakPolarHBondContact O-CG 3.4Å; V270-L274 PolarHBondContact O-N 3.04Å; V271-L274 PolarHBondContact O-N 3.49Å; L274-G276 VanDerWaalsContact C-N 3.32Å; L274-G276 PolarHBondContact O-N 3.39Å; L274-I277 PolarHBondContact O-N 3.39Å; L274-L278 PolarHBondContact O-N 3.46Å
275	L	92.6	Very high	89	Confident	108 Å²	108	88.2 Å²	88.2	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-63	-39.1	174.8	-70.6	175.5	0	0	0	111.9	V271 V272 V273 L278 A279	V271-L275 HydrophobicContact CG1-CD1 4.16Å; V271-L275 WeakPolarHBondContact O-CG 3.35Å; V271-L275 PolarHBondContact O-N 3.34Å; V272-L275 PolarHBondContact O-N 2.98Å; V273-L275 PolarHBondContact O-N 2.98Å; L275-L278 PolarHBondContact O-N 2.97Å; L275-A279 WeakPolarHBondContact O-CB 3.35Å; L275-A279 PolarHBondContact O-N 3.45Å
276	G	91.8	Very high	88.5	Confident	35 Å²	35	88.1 Å²	88.1	36%	0.361	51%	0.513	S	S	.	.	H	α-helix	trans	-62.7	-42.5	174.7	0	0	0	0	0	113.2	V272 V273 L274 A279 L280	V272-G276 PolarHBondContact O-N 3.31Å; V273-G276 PolarHBondContact O-N 3.49Å; L274-G276 VanDerWaalsContact C-N 3.32Å; L274-G276 PolarHBondContact O-N 3.39Å; G276-A279 PolarHBondContact O-N 3.47Å; G276-L280 PolarHBondContact O-N 3.38Å
277	I	91.6	Very high	87.2	Confident	82 Å²	82	86.1 Å²	86.1	42%	0.421	52%	0.519	S	S	.	.	H	α-helix	trans	-63.8	-44.9	175.6	-66.9	167	0	0	0	110.7	V273 L274 A279 L280 I281	V273-I277 HydrophobicContact CG1-CD1 4.01Å; V273-I277 WeakPolarHBondContact O-CG1 3.39Å; V273-I277 PolarHBondContact O-N 3Å; L274-I277 PolarHBondContact O-N 3.39Å; I277-A279 VanDerWaalsContact C-N 3.34Å; I277-A279 PolarHBondContact O-N 2.99Å; I277-L280 PolarHBondContact O-N 2.96Å; I277-I281 HydrophobicContact CG2-CD1 3.85Å; I277-I281 HydrophobicContact CG2-CG1 4.46Å; I277-I281 WeakPolarHBondContact O-CG1 3.31Å; I277-I281 PolarHBondContact O-N 2.96Å
278	L	89.2	Confident	85.7	Confident	99 Å²	99	88.1 Å²	88.1	52%	0.518	53%	0.53	S	S	.	.	H	α-helix	trans	-59.2	-45.1	175.9	-81.5	162.1	0	0	0	111.7	L274 L275 L280 I281 I282	L274-L278 PolarHBondContact O-N 3.46Å; L275-L278 PolarHBondContact O-N 2.97Å; L278-L280 VanDerWaalsContact C-N 3.33Å; L278-L280 PolarHBondContact O-N 2.9Å; L278-I281 PolarHBondContact O-N 3Å; L278-I282 VanDerWaalsContact O-CG1 3.29Å; L278-I282 WeakPolarHBondContact O-CG1 3.33Å; L278-I282 PolarHBondContact O-N 2.93Å
279	A	88	Confident	83.6	Confident	62 Å²	62	95.6 Å²	95.6	51%	0.512	56%	0.559	S	S	.	*	H	α-helix	trans	-62.2	-39.2	176.6	0	0	0	0	0	112.4	L275 G276 I277 G283	L275-A279 WeakPolarHBondContact O-CB 3.35Å; L275-A279 PolarHBondContact O-N 3.45Å; G276-A279 PolarHBondContact O-N 3.47Å; I277-A279 VanDerWaalsContact C-N 3.34Å; I277-A279 PolarHBondContact O-N 2.99Å; A279-G283 PolarHBondContact O-N 3.23Å
280	L	87.5	Confident	83.1	Confident	115 Å²	115	96.2 Å²	96.2	60%	0.602	56%	0.562	S	S	*	*	H	α-helix	trans	-64.7	-43.6	175	-86.7	164.4	0	0	0	112.6	G276 I277 L278 G283 L284	G276-L280 PolarHBondContact O-N 3.38Å; I277-L280 PolarHBondContact O-N 2.96Å; L278-L280 VanDerWaalsContact C-N 3.33Å; L278-L280 PolarHBondContact O-N 2.9Å; L280-G283 PolarHBondContact O-N 2.85Å; L280-L284 WeakPolarHBondContact O-CB 3.42Å; L280-L284 WeakPolarHBondContact O-CG 3.49Å; L280-L284 PolarHBondContact O-N 3.35Å
281	I	87.9	Confident	82.6	Confident	102 Å²	102	97.1 Å²	97.1	52%	0.523	57%	0.566	S	S	.	*	H	α-helix	trans	-63	-44.7	177.6	-67.7	166.4	0	0	0	110.5	I277 L278 S285	I277-I281 HydrophobicContact CG2-CD1 3.85Å; I277-I281 HydrophobicContact CG2-CG1 4.46Å; I277-I281 WeakPolarHBondContact O-CG1 3.31Å; I277-I281 PolarHBondContact O-N 2.96Å; L278-I281 PolarHBondContact O-N 3Å; I281-S285 VanDerWaalsContact O-CB 3.31Å; I281-S285 WeakPolarHBondContact O-CB 3.37Å; I281-S285 PolarHBondContact O-N 3.32Å; I281-S285 PolarHBondContact O-OG 2.82Å
282	I	86.3	Confident	82	Confident	102 Å²	102	98.4 Å²	98.4	52%	0.523	57%	0.573	S	S	.	*	H	α-helix	trans	-65.2	-44.3	176.6	-64.3	167.1	0	0	0	110.2	L278 L284 S285 V286	L278-I282 VanDerWaalsContact O-CG1 3.29Å; L278-I282 WeakPolarHBondContact O-CG1 3.33Å; L278-I282 PolarHBondContact O-N 2.93Å; I282-L284 PolarHBondContact O-N 2.87Å; I282-S285 WeakPolarHBondContact CA-OG 3.41Å; I282-S285 PolarHBondContact O-N 3.01Å; I282-S285 PolarHBondContact O-OG 3.3Å; I282-V286 HydrophobicContact CG2-CG2 4.35Å; I282-V286 WeakPolarHBondContact O-CB 3.29Å; I282-V286 VanDerWaalsContact O-CG2 3.28Å; I282-V286 WeakPolarHBondContact O-CG2 3.42Å; I282-V286 PolarHBondContact O-N 3.33Å
283	G	82.8	Confident	81.3	Confident	45 Å²	45	98.7 Å²	98.7	46%	0.464	57%	0.573	S	S	.	*	H	α-helix	trans	-62.6	-43.9	178.7	0	0	0	0	0	113.3	A279 L280 G287	A279-G283 PolarHBondContact O-N 3.23Å; L280-G283 PolarHBondContact O-N 2.85Å; G283-G287 WeakPolarHBondContact O-CA 3.5Å; G283-G287 PolarHBondContact O-N 3.5Å
284	L	80.4	Confident	80.6	Confident	106 Å²	106	99.7 Å²	99.7	56%	0.555	58%	0.577	S	S	*	*	H	α-helix	trans	-68.5	-37.6	176.3	-72.6	169.2	0	0	0	111.9	L280 I282 L288	L280-L284 WeakPolarHBondContact O-CB 3.42Å; L280-L284 WeakPolarHBondContact O-CG 3.49Å; L280-L284 PolarHBondContact O-N 3.35Å; I282-L284 PolarHBondContact O-N 2.87Å; L284-L288 HydrophobicContact CD2-CD1 4.22Å; L284-L288 WeakPolarHBondContact O-CB 3.28Å; L284-L288 WeakPolarHBondContact O-CD1 3.49Å; L284-L288 PolarHBondContact O-N 2.95Å
285	S	76.3	Confident	79.8	Confident	75 Å²	75	99.7 Å²	99.7	52%	0.524	58%	0.581	S	S	.	*	H	α-helix	trans	-71.9	-27.2	178.6	60.4	0	0	0	0	114	I281 I282	I281-S285 VanDerWaalsContact O-CB 3.31Å; I281-S285 WeakPolarHBondContact O-CB 3.37Å; I281-S285 PolarHBondContact O-N 3.32Å; I281-S285 PolarHBondContact O-OG 2.82Å; I282-S285 WeakPolarHBondContact CA-OG 3.41Å; I282-S285 PolarHBondContact O-N 3.01Å; I282-S285 PolarHBondContact O-OG 3.3Å
286	V	76.4	Confident	78.9	Confident	105 Å²	105	99.1 Å²	99.1	64%	0.636	58%	0.583	S	S	*	*	H	α-helix	trans	-91.5	-31.9	177.3	-179.4	0	0	0	0	112	I282	I282-V286 HydrophobicContact CG2-CG2 4.35Å; I282-V286 WeakPolarHBondContact O-CB 3.29Å; I282-V286 VanDerWaalsContact O-CG2 3.28Å; I282-V286 WeakPolarHBondContact O-CG2 3.42Å; I282-V286 PolarHBondContact O-N 3.33Å
287	G	61.6	Low	77.9	Confident	65 Å²	65	104.1 Å²	104.1	67%	0.67	60%	0.6	S	S	*	*	H	α-helix	trans	-85.4	-8.7	-177.7	0	0	0	0	0	116.2	G283	G283-G287 WeakPolarHBondContact O-CA 3.5Å; G283-G287 PolarHBondContact O-N 3.5Å
288	L	57	Low	76.7	Confident	144 Å²	144	105.9 Å²	105.9	75%	0.754	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	20.3	174.7	-100.8	121.3	0	0	0	114	L284	L284-L288 HydrophobicContact CD2-CD1 4.22Å; L284-L288 WeakPolarHBondContact O-CB 3.28Å; L284-L288 WeakPolarHBondContact O-CD1 3.49Å; L284-L288 PolarHBondContact O-N 2.95Å
289	K	47.5	Very low	75.6	Confident	251 Å²	251	106.5 Å²	106.5	100%	1.091	62%	0.623	S	S	*	*			trans	-101.7	0	169.5	-80.4	-171.7	178.1	178.6	0	112

Retrieved 289 of 289 residues in 214.5 ms (Link to these results)

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