A0A087Y2K8_POEFO Loading...

Annexin

AlphaFold DB , UniProt , Accession A0A087Y2K8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 342 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	31.6	Very low	59.2	Low	239 Å²	239	73.5 Å²	73.5	100%	1.177	41%	0.41	S	S	*	.				0	117.9	0	-72.3	-82.5	-91.9	0	0	105.6	S3	M1-S3 PolarHBondContact O-N 3.38Å
2	A	43.6	Very low	59.2	Low	88 Å²	88	73.4 Å²	73.4	73%	0.727	41%	0.413	S	S	*	.			trans	-61.6	129.3	172.8	0	0	0	0	0	107.5	D6	A2-D6 HydrophobicContact CB-CB 4.24Å
3	S	61.9	Low	58.8	Low	45 Å²	45	79.1 Å²	79.1	32%	0.315	44%	0.441	S	S	.	.			trans	-64.6	154.2	174.5	71	0	0	0	0	108.8	M1 W5 D6	M1-S3 PolarHBondContact O-N 3.38Å; S3-W5 PolarHBondContact O-N 3.39Å; S3-D6 WeakPolarHBondContact CB-OD2 3.38Å; S3-D6 PolarHBondContact N-OD2 3.42Å; S3-D6 WeakPolarHBondContact O-CB 3.32Å; S3-D6 PolarHBondContact O-N 3.09Å; S3-D6 PolarHBondContact OG-N 3.32Å; S3-D6 PolarHBondContact OG-OD2 3.39Å
4	L	64.9	Low	58.7	Low	61 Å²	61	77.2 Å²	77.2	32%	0.319	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-47.6	-37	172.1	178.9	76.6	0	0	0	111	D6 D7 A271 L313	L4-D6 PolarHBondContact O-N 3.34Å; L4-D7 PolarHBondContact O-N 3.06Å; L4-A271 HydrophobicContact CD2-CB 3.95Å; L4-L313 HydrophobicContact CB-CD2 3.85Å; L4-L313 HydrophobicContact CD1-CD2 3.9Å; L4-L313 HydrophobicContact CD2-CD1 4Å; L4-L313 HydrophobicContact CD2-CD2 3.41Å; L4-L313 VanDerWaalsContact CD2-CD2 3.41Å; L4-L313 HydrophobicContact CD2-CG 4.23Å; L4-L313 HydrophobicContact CG-CD2 3.87Å
5	W	67.3	Low	58.4	Low	9 Å²	9	79.9 Å²	79.9	3%	0.034	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-78.3	-1.6	-178.8	-48.4	112.5	0	0	0	114.2	S3 V263 K264 K267 A271 E275	S3-W5 PolarHBondContact O-N 3.39Å; W5-V263 HydrophobicContact CB-CG1 4Å; W5-V263 HydrophobicContact CE3-CG1 4.46Å; W5-V263 HydrophobicContact CG-CG1 4.45Å; W5-K264 HydrophobicContact CD2-CG 4.18Å; W5-K264 HydrophobicContact CE3-CG 4.34Å; W5-K264 HydrophobicContact CH2-CB 3.76Å; W5-K264 HydrophobicContact CH2-CD 4.47Å; W5-K264 HydrophobicContact CH2-CG 3.96Å; W5-K264 HydrophobicContact CZ2-CB 4.09Å; W5-K264 HydrophobicContact CZ2-CD 3.94Å; W5-K264 HydrophobicContact CZ2-CG 3.81Å; W5-K264 HydrophobicContact CZ3-CB 4.06Å; W5-K264 HydrophobicContact CZ3-CG 4.24Å; W5-K267 VanDerWaalsContact C-NZ 3.32Å; W5-K267 HydrophobicContact CE3-CB 4.05Å; W5-K267 HydrophobicContact CE3-CD 3.73Å; W5-K267 HydrophobicContact CE3-CG 4.48Å; W5-K267 HydrophobicContact CZ3-CB 3.88Å; W5-K267 HydrophobicContact CZ3-CD 4.43Å; W5-K267 WeakPolarHBondContact O-CE 3.43Å; W5-K267 PolarHBondContact O-NZ 3.23Å; W5-A271 HydrophobicContact CH2-CB 3.68Å; W5-A271 HydrophobicContact CZ2-CB 4.3Å; W5-A271 HydrophobicContact CZ3-CB 4.36Å; W5-E275 HydrophobicContact CZ2-CG 4.25Å; W5-E275 VanDerWaalsContact NE1-CD 3.35Å; W5-E275 PolarHBondContact NE1-OE1 3.47Å; W5-E275 PolarHBondContact NE1-OE2 3.26Å
6	D	65.7	Low	58	Low	28 Å²	28	76.1 Å²	76.1	15%	0.15	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-91.3	-18.2	172.5	-66.9	-45.2	0	0	0	113.5	A2 S3 L4 L8 K235 T241	A2-D6 HydrophobicContact CB-CB 4.24Å; S3-D6 WeakPolarHBondContact CB-OD2 3.38Å; S3-D6 PolarHBondContact N-OD2 3.42Å; S3-D6 WeakPolarHBondContact O-CB 3.32Å; S3-D6 PolarHBondContact O-N 3.09Å; S3-D6 PolarHBondContact OG-N 3.32Å; S3-D6 PolarHBondContact OG-OD2 3.39Å; L4-D6 PolarHBondContact O-N 3.34Å; D6-L8 PolarHBondContact O-N 3.44Å; D6-K235 PolarHBondContact O-NZ 3.05Å; D6-T241 HydrophobicContact CB-CG2 4.3Å; D6-T241 WeakPolarHBondContact OD1-CG2 3.38Å; D6-T241 PolarHBondContact OD1-OG1 3.35Å
7	D	68	Low	57.5	Low	83 Å²	83	74 Å²	74	44%	0.444	43%	0.429	S	S	.	.			trans	-75.8	120.7	174	-170.2	6.8	0	0	0	110.1	L4 E9 K267	L4-D7 PolarHBondContact O-N 3.06Å; D7-E9 PolarHBondContact OD1-N 2.95Å; D7-E9 VanDerWaalsContact OD1-N 3.09Å; D7-K267 PolarHBondContact O-NZ 3.44Å
8	L	66.1	Low	56.7	Low	12 Å²	12	74.8 Å²	74.8	6%	0.063	44%	0.439	C	S	.	.			trans	-118.7	-7.4	-179.5	-87.3	133.1	0	0	0	112.6	D6 S10 L11 L231 V232 K235 T241	D6-L8 PolarHBondContact O-N 3.44Å; L8-S10 VanDerWaalsContact C-N 3.27Å; L8-S10 PolarHBondContact O-N 3.34Å; L8-L11 HydrophobicContact CB-CD1 4.16Å; L8-L11 HydrophobicContact CD2-CD1 3.4Å; L8-L11 HydrophobicContact CG-CD1 3.68Å; L8-L11 PolarHBondContact O-N 2.82Å; L8-L231 HydrophobicContact CD2-CB 3.6Å; L8-V232 HydrophobicContact CB-CG2 4.47Å; L8-V232 HydrophobicContact CD2-CG2 3.92Å; L8-K235 HydrophobicContact CB-CD 4.36Å; L8-K235 HydrophobicContact CD1-CB 4.15Å; L8-K235 HydrophobicContact CD1-CD 3.35Å; L8-K235 HydrophobicContact CD1-CG 4.36Å; L8-K235 HydrophobicContact CG-CD 4.44Å; L8-T241 HydrophobicContact CD1-CG2 4.06Å
9	E	57.4	Low	55.8	Low	177 Å²	177	74.5 Å²	74.5	83%	0.827	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-26	-174.4	-67	-177.4	177.8	0	0	111.5	D7	D7-E9 PolarHBondContact OD1-N 2.95Å; D7-E9 VanDerWaalsContact OD1-N 3.09Å
10	S	60.6	Low	55.1	Low	61 Å²	61	73.2 Å²	73.2	43%	0.427	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-6	177.9	57.4	0	0	0	0	114.8	L8 S14	L8-S10 VanDerWaalsContact C-N 3.27Å; L8-S10 PolarHBondContact O-N 3.34Å; S10-S14 WeakPolarHBondContact O-CB 3.5Å; S10-S14 PolarHBondContact O-N 3.26Å; S10-S14 PolarHBondContact O-OG 3.42Å
11	L	64.7	Low	54.6	Low	5 Å²	5	76.7 Å²	76.7	3%	0.026	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-36.8	-167.8	-91.1	158.6	0	0	0	115.5	L8 R228 K267	L8-L11 HydrophobicContact CB-CD1 4.16Å; L8-L11 HydrophobicContact CD2-CD1 3.4Å; L8-L11 HydrophobicContact CG-CD1 3.68Å; L8-L11 PolarHBondContact O-N 2.82Å; L11-R228 HydrophobicContact CD2-CG 3.97Å; L11-R228 WeakPolarHBondContact O-CD 3.34Å; L11-K267 HydrophobicContact CD1-CD 3.96Å; L11-K267 VanDerWaalsContact CD1-CE 3.42Å; L11-K267 HydrophobicContact CD1-CG 3.64Å; L11-K267 HydrophobicContact CD2-CB 3.87Å; L11-K267 HydrophobicContact CD2-CG 3.54Å; L11-K267 HydrophobicContact CG-CG 4.11Å
12	V	58.7	Low	55.3	Low	73 Å²	73	70.4 Å²	70.4	44%	0.442	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-32.3	-172	-162.8	0	0	0	0	110.9	V232	V12-V232 HydrophobicContact CG2-CG2 3.7Å
13	D	53.6	Low	55.8	Low	147 Å²	147	68 Å²	68	79%	0.786	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-12.9	-176.1	-62.6	-34.7	0	0	0	113.6
14	S	57.6	Low	56.1	Low	53 Å²	53	72.5 Å²	72.5	37%	0.371	44%	0.435	S	S	.	.	S	Bend	trans	-74.2	133.3	177.6	-69.6	0	0	0	0	110.8	S10 R228	S10-S14 WeakPolarHBondContact O-CB 3.5Å; S10-S14 PolarHBondContact O-N 3.26Å; S10-S14 PolarHBondContact O-OG 3.42Å; S14-R228 PolarHBondContact O-NH1 2.98Å
15	P	53.9	Low	57.3	Low	118 Å²	118	74.1 Å²	74.1	77%	0.766	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-56.5	143.8	172.2	20.9	-29.6	0	0	0	110.8	S17 R228	P15-S17 PolarHBondContact O-N 3.11Å; P15-R228 PolarHBondContact O-NH1 2.98Å
16	S	51.7	Low	58.5	Low	18 Å²	18	73.7 Å²	73.7	13%	0.126	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-71.3	121.9	173.4	57	0	0	0	0	108.7	S18 A19	S16-S18 PolarHBondContact O-N 2.84Å; S16-S18 PolarHBondContact OG-OG 3.01Å; S16-A19 PolarHBondContact O-N 3.09Å
17	S	50.3	Low	59.9	Low	41 Å²	41	73.8 Å²	73.8	29%	0.287	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-66.1	-10.4	-178.7	82.3	0	0	0	0	112.8	P15 A19 A20 L269	P15-S17 PolarHBondContact O-N 3.11Å; S17-A19 PolarHBondContact O-N 2.75Å; S17-A19 VanDerWaalsContact O-N 3.13Å; S17-A20 WeakPolarHBondContact O-CB 3.42Å; S17-A20 PolarHBondContact O-N 3.13Å; S17-A20 VanDerWaalsContact O-N 3.12Å; S17-L269 WeakPolarHBondContact OG-CB 3.25Å
18	S	43.4	Very low	61.2	Low	88 Å²	88	70.2 Å²	70.2	62%	0.615	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-61.7	-13	169.8	60.9	0	0	0	0	113.4	S16	S16-S18 PolarHBondContact O-N 2.84Å; S16-S18 PolarHBondContact OG-OG 3.01Å
19	A	39.9	Very low	62.5	Low	70 Å²	70	75 Å²	75	58%	0.579	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-100.2	4.5	176.7	0	0	0	0	0	114	S16 S17 E21	S16-A19 PolarHBondContact O-N 3.09Å; S17-A19 PolarHBondContact O-N 2.75Å; S17-A19 VanDerWaalsContact O-N 3.13Å; A19-E21 PolarHBondContact O-N 2.7Å
20	A	41.9	Very low	64.2	Low	47 Å²	47	71 Å²	71	39%	0.388	43%	0.426	S	S	.	.			trans	-64.9	108	174.7	0	0	0	0	0	109.5	S17 S22	S17-A20 WeakPolarHBondContact O-CB 3.42Å; S17-A20 PolarHBondContact O-N 3.13Å; S17-A20 VanDerWaalsContact O-N 3.12Å; A20-S22 PolarHBondContact O-N 3.47Å
21	E	43.4	Very low	65.9	Low	147 Å²	147	72.7 Å²	72.7	69%	0.687	43%	0.426	S	S	*	.			trans	-56.5	128.4	171.6	-68.7	-178.1	162.8	0	0	109.2	A19 G23	A19-E21 PolarHBondContact O-N 2.7Å; E21-G23 PolarHBondContact O-N 3.29Å
22	S	47.4	Very low	67.3	Low	108 Å²	108	76.1 Å²	76.1	76%	0.755	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	131	178.1	50.8	0	0	0	0	110.7	A20	A20-S22 PolarHBondContact O-N 3.47Å
23	G	53.1	Low	69	Low	37 Å²	37	80.6 Å²	80.6	38%	0.381	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	105	-11.6	170.3	0	0	0	0	0	117.9	E21 E300	E21-G23 PolarHBondContact O-N 3.29Å; G23-E300 PolarHBondContact N-O 3.03Å
24	Q	68.1	Low	71.1	Confident	140 Å²	140	76 Å²	76	65%	0.654	45%	0.45	S	S	*	.	S	Bend	trans	-86.6	-34.6	175.5	-69.4	-170.1	14.2	0	0	113.4
25	R	89.5	Confident	73	Confident	95 Å²	95	77.3 Å²	77.3	36%	0.358	45%	0.453	S	S	.	.	S	Bend	trans	-110	5.1	-174.3	-59.7	-70.4	-68	146.4	-2.9	114	I301 D302 L303 L304 D305	R25-I301 CarbonylContact C-O 3.58Å; R25-I301 VanDerWaalsContact C-O 3.32Å; R25-I301 WeakPolarHBondContact CB-O 3.38Å; R25-D302 CarbonylContact O-C 3.6Å; R25-L303 PolarHBondContact O-N 3.16Å; R25-L304 VanDerWaalsContact O-CB 3.24Å; R25-L304 WeakPolarHBondContact O-CB 3.22Å; R25-L304 WeakPolarHBondContact O-CG 3.39Å; R25-L304 PolarHBondContact O-N 2.8Å; R25-D305 VanDerWaalsContact CB-OD2 3.24Å; R25-D305 WeakPolarHBondContact CB-OD2 3.39Å; R25-D305 WeakPolarHBondContact CG-OD2 3.24Å; R25-D305 IonicContact CZ-OD1 2.77Å; R25-D305 IonicContact CZ-OD2 2.65Å; R25-D305 IonicContact NE-OD1 3.3Å; R25-D305 PolarHBondContact NE-OD1 2.93Å; R25-D305 IonicContact NE-OD2 3.31Å; R25-D305 PolarHBondContact NE-OD2 2.82Å; R25-D305 IonicContact NH2-OD1 2.82Å; R25-D305 PolarHBondContact NH2-OD1 3.2Å; R25-D305 IonicContact NH2-OD2 3.15Å
26	G	92.8	Very high	75.1	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	42%	0.424	C	S	.	.			trans	-75.4	150	168.4	0	0	0	0	0	112.5	S299 I301	G26-S299 CarbonylContact C-O 3.27Å; G26-S299 WeakPolarHBondContact CA-O 3.42Å; G26-I301 PolarHBondContact N-O 2.88Å
27	T	95.2	Very high	77.3	Confident	30 Å²	30	79 Å²	79	18%	0.184	45%	0.452	C	S	.	.	S	Bend	trans	-81.7	-33.5	173.2	52.8	0	0	0	0	111.5	S299 L303 L304 I337 C338	T27-S299 PolarHBondContact N-O 3.48Å; T27-S299 PolarHBondContact OG1-O 2.94Å; T27-L303 HydrophobicContact CG2-CB 3.91Å; T27-L303 HydrophobicContact CG2-CD2 4.13Å; T27-L303 HydrophobicContact CG2-CG 3.95Å; T27-L303 WeakPolarHBondContact OG1-CD2 3.27Å; T27-L304 HydrophobicContact CG2-CD2 3.73Å; T27-L304 HydrophobicContact CG2-CG 3.98Å; T27-I337 VanDerWaalsContact CB-O 3.28Å; T27-I337 WeakPolarHBondContact CB-O 3.28Å; T27-I337 PolarHBondContact OG1-O 3.25Å; T27-C338 VanDerWaalsContact CG2-O 3.29Å; T27-C338 WeakPolarHBondContact CG2-O 3.48Å
28	I	95.3	Very high	79.5	Confident	7 Å²	7	84.2 Å²	84.2	4%	0.036	47%	0.469	C	S	.	.			trans	-89.8	128.7	174.2	-59.8	-175.9	0	0	0	109	T63 R65 R70 S299 E300 I337	I28-T63 WeakPolarHBondContact CD1-O 3.33Å; I28-R65 WeakPolarHBondContact CG2-O 3.32Å; I28-R70 VanDerWaalsContact CD1-NH2 3.27Å; I28-S299 PolarHBondContact N-O 3.42Å; I28-S299 VanDerWaalsContact N-O 3.09Å; I28-E300 HydrophobicContact CB-CG 3.94Å; I28-E300 HydrophobicContact CG2-CG 4.16Å; I28-I337 HydrophobicContact CD1-CG1 4.24Å; I28-I337 HydrophobicContact CD1-CG2 4.27Å
29	K	93.5	Very high	82.1	Confident	114 Å²	114	80.8 Å²	80.8	50%	0.496	44%	0.444	S	S	.	.			trans	-126.7	153.6	-179.3	-63.9	-175.9	178.7	-179.1	0	110.5	K31	K29-K31 PolarHBondContact O-N 3.48Å
30	P	94.4	Very high	84.9	Confident	91 Å²	91	77.6 Å²	77.6	59%	0.591	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-56.2	127.1	172.7	-23.1	33.1	0	0	0	110.9
31	K	95.1	Very high	87.4	Confident	98 Å²	98	77.5 Å²	77.5	43%	0.426	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-69.8	132.5	176.1	179.1	172.5	178.1	177	0	110.7	K29 F34 R65 Q69	K29-K31 PolarHBondContact O-N 3.48Å; K31-F34 WeakPolarHBondContact O-CB 3.28Å; K31-R65 VanDerWaalsContact CD-NE 3.33Å; K31-Q69 PolarHBondContact O-NE2 3.42Å
32	A	94.7	Very high	89.9	Confident	77 Å²	77	72.2 Å²	72.2	64%	0.636	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	146.5	171.6	0	0	0	0	0	111.5	F34	A32-F34 PolarHBondContact O-N 3.35Å
33	N	94.2	Very high	92.2	Very high	166 Å²	166	67 Å²	67	89%	0.888	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	40.4	-177.1	-52.1	-39.2	0	0	0	112.8
34	F	97	Very high	94.1	Very high	51 Å²	51	68.2 Å²	68.2	22%	0.224	36%	0.357	C	S	.	.			trans	-68	136.4	179.2	165.6	-108.3	0	0	0	111.9	K31 A32 A36 D39 Q69 L72 I73	K31-F34 WeakPolarHBondContact O-CB 3.28Å; A32-F34 PolarHBondContact O-N 3.35Å; F34-A36 HydrophobicContact CE1-CB 3.84Å; F34-A36 HydrophobicContact CE2-CB 4.41Å; F34-A36 VanDerWaalsContact CZ-CA 3.48Å; F34-A36 HydrophobicContact CZ-CB 3.53Å; F34-D39 WeakPolarHBondContact CD2-OD2 3.39Å; F34-D39 VanDerWaalsContact CE2-OD2 3.3Å; F34-D39 WeakPolarHBondContact CE2-OD2 3.33Å; F34-Q69 VanDerWaalsContact CB-NE2 3.27Å; F34-Q69 HydrophobicContact CD1-CB 4.34Å; F34-Q69 HydrophobicContact CD1-CG 3.83Å; F34-Q69 HydrophobicContact CD2-CB 4.29Å; F34-Q69 HydrophobicContact CD2-CG 4.28Å; F34-Q69 HydrophobicContact CE1-CB 4.06Å; F34-Q69 HydrophobicContact CE1-CG 3.99Å; F34-Q69 HydrophobicContact CE2-CB 4.02Å; F34-Q69 HydrophobicContact CE2-CG 4.44Å; F34-Q69 HydrophobicContact CG-CB 4.44Å; F34-Q69 HydrophobicContact CG-CG 3.97Å; F34-Q69 HydrophobicContact CZ-CB 3.88Å; F34-Q69 HydrophobicContact CZ-CG 4.28Å; F34-L72 HydrophobicContact CE1-CB 4.01Å; F34-L72 HydrophobicContact CE1-CD1 3.78Å; F34-L72 HydrophobicContact CZ-CB 4.13Å; F34-I73 HydrophobicContact CE2-CD1 3.88Å; F34-I73 HydrophobicContact CE2-CG1 3.75Å; F34-I73 HydrophobicContact CZ-CD1 4.32Å; F34-I73 HydrophobicContact CZ-CG1 3.75Å
35	D	97.8	Very high	95.2	Very high	80 Å²	80	66.3 Å²	66.3	43%	0.428	35%	0.351	S	S	.	.			trans	-131.1	109.8	175.9	-178.1	-24	0	0	0	108.5	E37 K38 D39	D35-E37 PolarHBondContact OD1-N 3.08Å; D35-K38 HydrophobicContact CB-CB 3.95Å; D35-K38 PolarHBondContact OD1-N 3.07Å; D35-D39 PolarHBondContact O-N 3.03Å; D35-D39 VanDerWaalsContact O-N 3.15Å
36	A	97.9	Very high	95.3	Very high	20 Å²	20	62 Å²	62	17%	0.165	34%	0.336	C	S	.	.	H	α-helix	trans	-68.1	-35.3	-176.7	0	0	0	0	0	112.6	F34 A40 L72 A76	F34-A36 HydrophobicContact CE1-CB 3.84Å; F34-A36 HydrophobicContact CE2-CB 4.41Å; F34-A36 VanDerWaalsContact CZ-CA 3.48Å; F34-A36 HydrophobicContact CZ-CB 3.53Å; A36-A40 WeakPolarHBondContact O-CB 3.39Å; A36-A40 PolarHBondContact O-N 3.36Å; A36-L72 HydrophobicContact CB-CB 4.02Å; A36-A76 HydrophobicContact CB-CB 4.14Å
37	E	97.9	Very high	95	Very high	153 Å²	153	62.1 Å²	62.1	72%	0.715	34%	0.337	S	S	*	.	H	α-helix	trans	-71.9	-41.5	-178	-65.3	-177.2	178.2	0	0	110.3	D35 A40 A41 A76	D35-E37 PolarHBondContact OD1-N 3.08Å; E37-A40 PolarHBondContact O-N 2.92Å; E37-A41 WeakPolarHBondContact O-CB 3.37Å; E37-A41 PolarHBondContact O-N 3.13Å; E37-A76 HydrophobicContact CG-CB 4.44Å
38	K	97.6	Very high	94.3	Very high	150 Å²	150	65.4 Å²	65.4	65%	0.652	35%	0.35	S	S	*	.	H	α-helix	trans	-63.2	-46.3	175.2	-175.3	178.6	178.5	178.3	0	112.2	D35 A41 A42	D35-K38 HydrophobicContact CB-CB 3.95Å; D35-K38 PolarHBondContact OD1-N 3.07Å; K38-A41 PolarHBondContact O-N 2.63Å; K38-A42 PolarHBondContact O-N 2.64Å
39	D	97.9	Very high	92.9	Very high	15 Å²	15	67.6 Å²	67.6	8%	0.08	37%	0.374	C	S	.	.	H	α-helix	trans	-65.9	-39.9	177.8	-77.3	-21.5	0	0	0	111	F34 D35 A42 L43 I61 R65 I73	F34-D39 WeakPolarHBondContact CD2-OD2 3.39Å; F34-D39 VanDerWaalsContact CE2-OD2 3.3Å; F34-D39 WeakPolarHBondContact CE2-OD2 3.33Å; D35-D39 PolarHBondContact O-N 3.03Å; D35-D39 VanDerWaalsContact O-N 3.15Å; D39-A42 PolarHBondContact O-N 2.61Å; D39-L43 WeakPolarHBondContact O-CG 3.35Å; D39-L43 PolarHBondContact O-N 3.28Å; D39-I61 HydrophobicContact CB-CG2 4.1Å; D39-R65 VanDerWaalsContact CG-NH2 3.26Å; D39-R65 IonicContact OD1-CZ 2.71Å; D39-R65 IonicContact OD1-NE 2.95Å; D39-R65 IonicContact OD1-NH2 3.09Å; D39-R65 PolarHBondContact OD1-NH2 2.92Å; D39-R65 IonicContact OD2-CZ 2.78Å; D39-R65 IonicContact OD2-NE 2.8Å; D39-R65 PolarHBondContact OD2-NE 2.88Å; D39-R65 IonicContact OD2-NH2 3.34Å; D39-R65 PolarHBondContact OD2-NH2 3Å; D39-I73 HydrophobicContact CB-CD1 3.77Å; D39-I73 HydrophobicContact CB-CG1 3.92Å
40	A	97.5	Very high	91.3	Very high	3 Å²	3	71.2 Å²	71.2	3%	0.025	40%	0.398	C	S	.	.	H	α-helix	trans	-63.4	-41.7	175.8	0	0	0	0	0	112.7	A36 E37 L43 K44 I73 A76	A36-A40 WeakPolarHBondContact O-CB 3.39Å; A36-A40 PolarHBondContact O-N 3.36Å; E37-A40 PolarHBondContact O-N 2.92Å; A40-L43 PolarHBondContact O-N 3.22Å; A40-K44 WeakPolarHBondContact O-CB 3.35Å; A40-K44 PolarHBondContact O-N 3.33Å; A40-I73 HydrophobicContact CB-CG2 4.25Å; A40-A76 HydrophobicContact CB-CB 3.85Å
41	A	95.7	Very high	89.6	Confident	46 Å²	46	68.2 Å²	68.2	38%	0.38	38%	0.384	S	S	.	.	H	α-helix	trans	-62.7	-43.6	174.7	0	0	0	0	0	111.6	E37 K38 L43 K44 D45	E37-A41 WeakPolarHBondContact O-CB 3.37Å; E37-A41 PolarHBondContact O-N 3.13Å; K38-A41 PolarHBondContact O-N 2.63Å; A41-L43 PolarHBondContact O-N 3.16Å; A41-K44 WeakPolarHBondContact O-CB 3.42Å; A41-K44 PolarHBondContact O-N 2.96Å; A41-D45 VanDerWaalsContact O-CG 3.29Å; A41-D45 PolarHBondContact O-N 2.81Å
42	A	95.7	Very high	88.1	Confident	35 Å²	35	64.4 Å²	64.4	29%	0.289	37%	0.369	S	S	.	.	H	α-helix	trans	-64.4	-39.5	177.1	0	0	0	0	0	112.7	K38 D39 A46 V57 I61	K38-A42 PolarHBondContact O-N 2.64Å; D39-A42 PolarHBondContact O-N 2.61Å; A42-A46 WeakPolarHBondContact O-CB 3.43Å; A42-A46 PolarHBondContact O-N 3.06Å; A42-V57 HydrophobicContact CB-CG1 4.31Å; A42-I61 HydrophobicContact CB-CD1 3.7Å
43	L	95.4	Very high	86.8	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-64.6	-41.8	173.3	-70.3	178.2	0	0	0	111.5	D39 A40 A41 A46 I47 L58 I61 L62 I73 Y77 L85	D39-L43 WeakPolarHBondContact O-CG 3.35Å; D39-L43 PolarHBondContact O-N 3.28Å; A40-L43 PolarHBondContact O-N 3.22Å; A41-L43 PolarHBondContact O-N 3.16Å; L43-A46 PolarHBondContact O-N 3.33Å; L43-I47 WeakPolarHBondContact O-CD1 3.05Å; L43-I47 WeakPolarHBondContact O-CG1 3.31Å; L43-I47 PolarHBondContact O-N 3.22Å; L43-L58 HydrophobicContact CD2-CD2 3.53Å; L43-I61 HydrophobicContact CD1-CG2 4.21Å; L43-I61 HydrophobicContact CD2-CB 4.01Å; L43-I61 HydrophobicContact CD2-CD1 3.91Å; L43-I61 HydrophobicContact CD2-CG2 4.11Å; L43-I61 HydrophobicContact CG-CD1 3.96Å; L43-I61 HydrophobicContact CG-CG2 4.18Å; L43-L62 HydrophobicContact CD1-CD2 4.22Å; L43-L62 HydrophobicContact CD2-CG 4.47Å; L43-I73 HydrophobicContact CD1-CG2 3.48Å; L43-I73 VanDerWaalsContact CD1-CG2 3.48Å; L43-Y77 HydrophobicContact CB-CD2 4.33Å; L43-Y77 HydrophobicContact CB-CE2 4.34Å; L43-L85 HydrophobicContact CD1-CD1 4.27Å; L43-L85 HydrophobicContact CD1-CD2 3.79Å
44	K	92.6	Very high	86.2	Confident	62 Å²	62	60.2 Å²	60.2	27%	0.27	34%	0.339	S	S	.	.	H	α-helix	trans	-58.8	-51.3	176.2	179.2	-167.2	170.1	-177.2	0	110.6	A40 A41 A46 I47 E48 Y77 T81	A40-K44 WeakPolarHBondContact O-CB 3.35Å; A40-K44 PolarHBondContact O-N 3.33Å; A41-K44 WeakPolarHBondContact O-CB 3.42Å; A41-K44 PolarHBondContact O-N 2.96Å; K44-A46 PolarHBondContact O-N 2.59Å; K44-I47 CarbonylContact O-C 3.53Å; K44-I47 PolarHBondContact O-N 3.26Å; K44-I47 VanDerWaalsContact O-N 3.08Å; K44-E48 WeakPolarHBondContact CE-OE1 3.35Å; K44-E48 HydrophobicContact CG-CG 4.16Å; K44-E48 IonicContact NZ-OE1 2.73Å; K44-E48 PolarHBondContact NZ-OE1 2.9Å; K44-E48 WeakPolarHBondContact O-CB 3.39Å; K44-E48 WeakPolarHBondContact O-CG 3.5Å; K44-E48 PolarHBondContact O-N 3.16Å; K44-Y77 HydrophobicContact CB-CD2 4.36Å; K44-Y77 HydrophobicContact CB-CE2 3.77Å; K44-T81 HydrophobicContact CB-CG2 4.42Å; K44-T81 HydrophobicContact CD-CG2 3.7Å; K44-T81 HydrophobicContact CG-CG2 3.89Å
45	D	91.6	Very high	85.7	Confident	99 Å²	99	60.5 Å²	60.5	53%	0.529	34%	0.341	S	S	.	.	H	α-helix	trans	-61.5	-33.4	179.3	-65.8	-10.5	0	0	0	111.9	A41 I47	A41-D45 VanDerWaalsContact O-CG 3.29Å; A41-D45 PolarHBondContact O-N 2.81Å; D45-I47 VanDerWaalsContact C-N 3.35Å
46	A	90.8	Very high	85.4	Confident	5 Å²	5	63.7 Å²	63.7	4%	0.041	35%	0.351	C	S	.	.	H	α-helix	trans	-72.6	-26.4	176.8	0	0	0	0	0	113.6	A42 L43 K44 T53 N54 V57 L58	A42-A46 WeakPolarHBondContact O-CB 3.43Å; A42-A46 PolarHBondContact O-N 3.06Å; L43-A46 PolarHBondContact O-N 3.33Å; K44-A46 PolarHBondContact O-N 2.59Å; A46-T53 PolarHBondContact O-N 3.07Å; A46-T53 PolarHBondContact O-OG1 3.33Å; A46-N54 HydrophobicContact CB-CB 4.24Å; A46-N54 PolarHBondContact O-N 3.38Å; A46-V57 HydrophobicContact CB-CB 3.88Å; A46-V57 HydrophobicContact CB-CG1 3.86Å; A46-L58 HydrophobicContact CB-CD2 4.36Å
47	I	88.4	Confident	85.3	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.015	35%	0.352	C	S	.	.	H	α-helix	trans	-95.1	-24.6	179.5	-61.4	164.9	0	0	0	111.5	L43 K44 D45 G49 L58 Y77 L85 D88 L89 D92	L43-I47 WeakPolarHBondContact O-CD1 3.05Å; L43-I47 WeakPolarHBondContact O-CG1 3.31Å; L43-I47 PolarHBondContact O-N 3.22Å; K44-I47 CarbonylContact O-C 3.53Å; K44-I47 PolarHBondContact O-N 3.26Å; K44-I47 VanDerWaalsContact O-N 3.08Å; D45-I47 VanDerWaalsContact C-N 3.35Å; I47-G49 PolarHBondContact O-N 2.98Å; I47-G49 VanDerWaalsContact O-N 3.13Å; I47-L58 HydrophobicContact CD1-CD2 4.08Å; I47-L58 HydrophobicContact CG1-CD2 3.93Å; I47-Y77 HydrophobicContact CD1-CE2 4.41Å; I47-L85 HydrophobicContact CD1-CD1 3.67Å; I47-D88 HydrophobicContact CD1-CB 4.5Å; I47-D88 HydrophobicContact CG2-CB 4.1Å; I47-L89 HydrophobicContact CD1-CD2 4.12Å; I47-D92 HydrophobicContact CG2-CB 3.94Å; I47-D92 VanDerWaalsContact CG2-OD2 3.23Å; I47-D92 WeakPolarHBondContact CG2-OD2 3.48Å
48	E	79.1	Confident	85.1	Confident	98 Å²	98	57 Å²	57	46%	0.458	32%	0.318	S	S	.	.			trans	-64	113.5	-179.7	-85.2	-169.1	164.3	0	0	112.1	K44 T53	K44-E48 WeakPolarHBondContact CE-OE1 3.35Å; K44-E48 HydrophobicContact CG-CG 4.16Å; K44-E48 IonicContact NZ-OE1 2.73Å; K44-E48 PolarHBondContact NZ-OE1 2.9Å; K44-E48 WeakPolarHBondContact O-CB 3.39Å; K44-E48 WeakPolarHBondContact O-CG 3.5Å; K44-E48 PolarHBondContact O-N 3.16Å; E48-T53 WeakPolarHBondContact O-CG2 3.4Å
49	G	66.8	Low	85.1	Confident	53 Å²	53	50.7 Å²	50.7	55%	0.546	29%	0.291	S	S	.	.	S	Bend	trans	154.1	-168.4	178.2	0	0	0	0	0	113	I47	I47-G49 PolarHBondContact O-N 2.98Å; I47-G49 VanDerWaalsContact O-N 3.13Å
50	L	58.9	Low	84.9	Confident	191 Å²	191	56 Å²	56	100%	1	32%	0.316	S	S	*	.	S	Bend	trans	-88.5	93.8	162.1	-73	174.8	0	0	0	107.5
51	G	58.3	Low	84.9	Confident	28 Å²	28	56.4 Å²	56.4	29%	0.289	32%	0.317	S	S	.	.	S	Bend	trans	87.9	166.6	-172.7	0	0	0	0	0	113.1	T53 D92	G51-T53 PolarHBondContact O-N 2.8Å; G51-D92 WeakPolarHBondContact CA-OD1 3.41Å; G51-D92 PolarHBondContact N-OD1 3.39Å
52	T	63.4	Low	84.9	Confident	18 Å²	18	54.2 Å²	54.2	11%	0.11	30%	0.299	C	S	.	.			trans	-59.9	124.9	174.3	-59.3	0	0	0	0	109.3	E55 L58 D92 T93	T52-E55 HydrophobicContact CG2-CB 4.42Å; T52-E55 HydrophobicContact CG2-CG 3.78Å; T52-L58 HydrophobicContact CG2-CD1 3.66Å; T52-L58 HydrophobicContact CG2-CG 4.31Å; T52-D92 PolarHBondContact N-O 3.3Å; T52-D92 PolarHBondContact OG1-O 2.95Å; T52-T93 WeakPolarHBondContact OG1-CG2 3.17Å
53	T	67.9	Low	85	Confident	88 Å²	88	52.6 Å²	52.6	54%	0.54	29%	0.286	S	S	.	.	S	Bend	trans	-92	-14.8	-179.4	61.3	0	0	0	0	112.1	A46 E48 G51	A46-T53 PolarHBondContact O-N 3.07Å; A46-T53 PolarHBondContact O-OG1 3.33Å; E48-T53 WeakPolarHBondContact O-CG2 3.4Å; G51-T53 PolarHBondContact O-N 2.8Å
54	N	81.5	Confident	84.9	Confident	67 Å²	67	57.2 Å²	57.2	36%	0.358	31%	0.308	S	S	.	.			trans	-155.8	83.4	179.6	-163.2	-18.4	0	0	0	113.5	A46 K56 V57	A46-N54 HydrophobicContact CB-CB 4.24Å; A46-N54 PolarHBondContact O-N 3.38Å; N54-K56 PolarHBondContact O-N 2.85Å; N54-K56 WeakPolarHBondContact OD1-CB 3.28Å; N54-K56 PolarHBondContact OD1-N 2.61Å; N54-V57 HydrophobicContact CB-CB 4.46Å; N54-V57 HydrophobicContact CB-CG2 4.21Å; N54-V57 VanDerWaalsContact ND2-CG2 3.33Å; N54-V57 WeakPolarHBondContact ND2-CG2 3.35Å; N54-V57 PolarHBondContact O-N 3.38Å; N54-V57 VanDerWaalsContact O-N 3.15Å; N54-V57 PolarHBondContact OD1-N 3.5Å
55	E	88	Confident	85.2	Confident	56 Å²	56	54.7 Å²	54.7	26%	0.262	30%	0.296	S	S	.	.	H	α-helix	trans	-60.6	-28.3	177.5	-61.8	78	-168.4	0	0	112	T52 V57 L58 I59 F97 E329	T52-E55 HydrophobicContact CG2-CB 4.42Å; T52-E55 HydrophobicContact CG2-CG 3.78Å; E55-V57 VanDerWaalsContact C-N 3.3Å; E55-V57 PolarHBondContact O-N 2.85Å; E55-L58 WeakPolarHBondContact O-CB 3.43Å; E55-L58 PolarHBondContact O-N 3.46Å; E55-I59 WeakPolarHBondContact O-CG1 3Å; E55-I59 PolarHBondContact O-N 2.86Å; E55-F97 HydrophobicContact CB-CE1 4.12Å; E55-F97 HydrophobicContact CB-CZ 4.06Å; E55-F97 HydrophobicContact CG-CE1 3.91Å; E55-F97 HydrophobicContact CG-CZ 4.38Å; E55-E329 HydrophobicContact CB-CG 4.28Å; E55-E329 HydrophobicContact CG-CG 4.19Å
56	K	91.3	Very high	85.5	Confident	148 Å²	148	50.5 Å²	50.5	64%	0.643	28%	0.275	S	S	*	.	H	α-helix	trans	-62.5	-38.3	177.7	-61	-177	178.6	179.5	0	111.8	N54 L58 I59 E60	N54-K56 PolarHBondContact O-N 2.85Å; N54-K56 WeakPolarHBondContact OD1-CB 3.28Å; N54-K56 PolarHBondContact OD1-N 2.61Å; K56-L58 VanDerWaalsContact C-N 3.35Å; K56-I59 PolarHBondContact O-N 2.85Å; K56-E60 WeakPolarHBondContact O-CB 3.37Å; K56-E60 VanDerWaalsContact O-CG 3.27Å; K56-E60 WeakPolarHBondContact O-CG 3.5Å; K56-E60 PolarHBondContact O-N 2.65Å
57	V	94.6	Very high	85.8	Confident	31 Å²	31	51 Å²	51	19%	0.188	28%	0.277	C	S	.	.	H	α-helix	trans	-66	-40.4	176.6	171.1	0	0	0	0	110.7	A42 A46 N54 E55 I61	A42-V57 HydrophobicContact CB-CG1 4.31Å; A46-V57 HydrophobicContact CB-CB 3.88Å; A46-V57 HydrophobicContact CB-CG1 3.86Å; N54-V57 HydrophobicContact CB-CB 4.46Å; N54-V57 HydrophobicContact CB-CG2 4.21Å; N54-V57 VanDerWaalsContact ND2-CG2 3.33Å; N54-V57 WeakPolarHBondContact ND2-CG2 3.35Å; N54-V57 PolarHBondContact O-N 3.38Å; N54-V57 VanDerWaalsContact O-N 3.15Å; N54-V57 PolarHBondContact OD1-N 3.5Å; E55-V57 VanDerWaalsContact C-N 3.3Å; E55-V57 PolarHBondContact O-N 2.85Å; V57-I61 HydrophobicContact CG1-CD1 3.71Å; V57-I61 HydrophobicContact CG1-CG1 4.42Å; V57-I61 WeakPolarHBondContact O-CB 3.24Å; V57-I61 WeakPolarHBondContact O-CG1 3.18Å; V57-I61 PolarHBondContact O-N 2.74Å
58	L	94.9	Very high	86.2	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.8	-49.9	174.1	-58.8	-177.2	0	0	0	110.5	L43 A46 I47 T52 E55 K56 L62 L89 T93 L101	L43-L58 HydrophobicContact CD2-CD2 3.53Å; A46-L58 HydrophobicContact CB-CD2 4.36Å; I47-L58 HydrophobicContact CD1-CD2 4.08Å; I47-L58 HydrophobicContact CG1-CD2 3.93Å; T52-L58 HydrophobicContact CG2-CD1 3.66Å; T52-L58 HydrophobicContact CG2-CG 4.31Å; E55-L58 WeakPolarHBondContact O-CB 3.43Å; E55-L58 PolarHBondContact O-N 3.46Å; K56-L58 VanDerWaalsContact C-N 3.35Å; L58-L62 VanDerWaalsContact O-CB 3.23Å; L58-L62 WeakPolarHBondContact O-CB 3.32Å; L58-L62 WeakPolarHBondContact O-CG 3.24Å; L58-L62 PolarHBondContact O-N 3.16Å; L58-L89 HydrophobicContact CD1-CD2 4.06Å; L58-L89 HydrophobicContact CD2-CD2 4.27Å; L58-T93 HydrophobicContact CD1-CG2 4.09Å; L58-L101 HydrophobicContact CB-CD1 4.25Å; L58-L101 HydrophobicContact CD1-CD1 3.86Å
59	I	95.9	Very high	87.1	Confident	18 Å²	18	49.3 Å²	49.3	9%	0.092	28%	0.281	C	S	.	.	H	α-helix	trans	-61.4	-51.9	179.8	-67.3	167	0	0	0	110.7	E55 K56 I61 T63 F97 D332 C333 P336	E55-I59 WeakPolarHBondContact O-CG1 3Å; E55-I59 PolarHBondContact O-N 2.86Å; K56-I59 PolarHBondContact O-N 2.85Å; I59-I61 VanDerWaalsContact C-N 3.34Å; I59-I61 PolarHBondContact O-N 3.43Å; I59-T63 HydrophobicContact CG2-CG2 4.17Å; I59-T63 VanDerWaalsContact O-CB 3.28Å; I59-T63 WeakPolarHBondContact O-CB 3.36Å; I59-T63 VanDerWaalsContact O-CG2 3.28Å; I59-T63 WeakPolarHBondContact O-CG2 3.45Å; I59-T63 PolarHBondContact O-N 3.21Å; I59-T63 PolarHBondContact O-OG1 3.5Å; I59-F97 HydrophobicContact CD1-CE2 3.94Å; I59-F97 HydrophobicContact CD1-CZ 4.19Å; I59-F97 HydrophobicContact CG1-CE2 3.74Å; I59-F97 HydrophobicContact CG1-CZ 3.99Å; I59-D332 HydrophobicContact CD1-CB 4.05Å; I59-C333 HydrophobicContact CD1-CB 4.27Å; I59-C333 HydrophobicContact CG1-CB 3.96Å; I59-C333 HydrophobicContact CG2-CB 4.48Å; I59-P336 HydrophobicContact CG2-CG 3.97Å
60	E	94.8	Very high	88.7	Confident	127 Å²	127	46.9 Å²	46.9	59%	0.593	26%	0.255	S	S	*	.	H	α-helix	trans	-61.2	-40	-177.4	-77	177.9	-171.7	0	0	112.7	K56 Q64	K56-E60 WeakPolarHBondContact O-CB 3.37Å; K56-E60 VanDerWaalsContact O-CG 3.27Å; K56-E60 WeakPolarHBondContact O-CG 3.5Å; K56-E60 PolarHBondContact O-N 2.65Å; E60-Q64 WeakPolarHBondContact O-CB 3.34Å; E60-Q64 WeakPolarHBondContact O-CG 3.49Å
61	I	96.8	Very high	90.6	Very high	11 Å²	11	40 Å²	40	6%	0.056	22%	0.218	C	C	.	.	H	α-helix	trans	-75.4	-54.1	178.5	-66.7	175.1	0	0	0	109.7	D39 A42 L43 V57 I59 T63 Q64 R65 I73	D39-I61 HydrophobicContact CB-CG2 4.1Å; A42-I61 HydrophobicContact CB-CD1 3.7Å; L43-I61 HydrophobicContact CD1-CG2 4.21Å; L43-I61 HydrophobicContact CD2-CB 4.01Å; L43-I61 HydrophobicContact CD2-CD1 3.91Å; L43-I61 HydrophobicContact CD2-CG2 4.11Å; L43-I61 HydrophobicContact CG-CD1 3.96Å; L43-I61 HydrophobicContact CG-CG2 4.18Å; V57-I61 HydrophobicContact CG1-CD1 3.71Å; V57-I61 HydrophobicContact CG1-CG1 4.42Å; V57-I61 WeakPolarHBondContact O-CB 3.24Å; V57-I61 WeakPolarHBondContact O-CG1 3.18Å; V57-I61 PolarHBondContact O-N 2.74Å; I59-I61 VanDerWaalsContact C-N 3.34Å; I59-I61 PolarHBondContact O-N 3.43Å; I61-T63 PolarHBondContact O-N 2.68Å; I61-Q64 PolarHBondContact O-N 3.23Å; I61-R65 HydrophobicContact CG2-CG 4.43Å; I61-R65 WeakPolarHBondContact O-CG 3.22Å; I61-R65 PolarHBondContact O-N 3.2Å; I61-I73 HydrophobicContact CG2-CD1 3.9Å
62	L	96.9	Very high	92.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-71.4	-31.4	-170.3	-62.3	-179.9	0	0	0	112.2	L43 L58 R70 L89 L101 L104 I105	L43-L62 HydrophobicContact CD1-CD2 4.22Å; L43-L62 HydrophobicContact CD2-CG 4.47Å; L58-L62 VanDerWaalsContact O-CB 3.23Å; L58-L62 WeakPolarHBondContact O-CB 3.32Å; L58-L62 WeakPolarHBondContact O-CG 3.24Å; L58-L62 PolarHBondContact O-N 3.16Å; L62-R70 HydrophobicContact CD2-CG 4.38Å; L62-R70 PolarHBondContact O-NE 3.08Å; L62-R70 PolarHBondContact O-NH2 3.33Å; L62-L89 HydrophobicContact CD1-CD1 4.44Å; L62-L101 HydrophobicContact CD1-CB 4.39Å; L62-L101 HydrophobicContact CD1-CD2 3.99Å; L62-L104 HydrophobicContact CB-CD1 4.19Å; L62-I105 HydrophobicContact CD1-CG2 4.05Å; L62-I105 HydrophobicContact CD2-CG2 3.69Å; L62-I105 HydrophobicContact CG-CG2 4.48Å
63	T	96.6	Very high	94.1	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-84.7	-12.5	178.6	68.5	0	0	0	0	113.9	I28 I59 I61 L104 C333 P336 I337	I28-T63 WeakPolarHBondContact CD1-O 3.33Å; I59-T63 HydrophobicContact CG2-CG2 4.17Å; I59-T63 VanDerWaalsContact O-CB 3.28Å; I59-T63 WeakPolarHBondContact O-CB 3.36Å; I59-T63 VanDerWaalsContact O-CG2 3.28Å; I59-T63 WeakPolarHBondContact O-CG2 3.45Å; I59-T63 PolarHBondContact O-N 3.21Å; I59-T63 PolarHBondContact O-OG1 3.5Å; I61-T63 PolarHBondContact O-N 2.68Å; T63-L104 HydrophobicContact CG2-CD1 4.07Å; T63-C333 VanDerWaalsContact CG2-SG 3.58Å; T63-P336 HydrophobicContact CG2-CG 3.89Å; T63-P336 WeakPolarHBondContact OG1-CB 3.49Å; T63-P336 WeakPolarHBondContact OG1-CG 3.34Å; T63-I337 HydrophobicContact CG2-CD1 4.21Å; T63-I337 HydrophobicContact CG2-CG1 3.81Å
64	Q	94.9	Very high	95.6	Very high	97 Å²	97	38.9 Å²	38.9	45%	0.453	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.3	20.9	-177.7	-55	-64.2	-46.8	0	0	113.5	E60 I61	E60-Q64 WeakPolarHBondContact O-CB 3.34Å; E60-Q64 WeakPolarHBondContact O-CG 3.49Å; I61-Q64 PolarHBondContact O-N 3.23Å
65	R	97.3	Very high	96.4	Very high	8 Å²	8	42.6 Å²	42.6	3%	0.03	22%	0.216	C	C	.	.	S	Bend	trans	-127	140.1	171.5	-62.4	-61.5	178.2	-64.8	-17.8	108.4	I28 K31 D39 I61 Q69 R70 I73	I28-R65 WeakPolarHBondContact CG2-O 3.32Å; K31-R65 VanDerWaalsContact CD-NE 3.33Å; D39-R65 VanDerWaalsContact CG-NH2 3.26Å; D39-R65 IonicContact OD1-CZ 2.71Å; D39-R65 IonicContact OD1-NE 2.95Å; D39-R65 IonicContact OD1-NH2 3.09Å; D39-R65 PolarHBondContact OD1-NH2 2.92Å; D39-R65 IonicContact OD2-CZ 2.78Å; D39-R65 IonicContact OD2-NE 2.8Å; D39-R65 PolarHBondContact OD2-NE 2.88Å; D39-R65 IonicContact OD2-NH2 3.34Å; D39-R65 PolarHBondContact OD2-NH2 3Å; I61-R65 HydrophobicContact CG2-CG 4.43Å; I61-R65 WeakPolarHBondContact O-CG 3.22Å; I61-R65 PolarHBondContact O-N 3.2Å; R65-Q69 HydrophobicContact CB-CB 3.98Å; R65-R70 HydrophobicContact CB-CG 4.09Å; R65-R70 VanDerWaalsContact O-CZ 3.22Å; R65-R70 PolarHBondContact O-NE 3.14Å; R65-R70 VanDerWaalsContact O-NE 3.11Å; R65-R70 PolarHBondContact O-NH2 3.4Å; R65-I73 HydrophobicContact CB-CD1 4.44Å; R65-I73 HydrophobicContact CG-CD1 3.96Å
66	S	97.5	Very high	96.9	Very high	11 Å²	11	41 Å²	41	8%	0.077	21%	0.212	C	C	.	.			trans	-64	157.5	171	63.1	0	0	0	0	110.5	G68 Q69 R70 E300	S66-G68 PolarHBondContact O-N 3.19Å; S66-Q69 CarbonylContact O-C 3.51Å; S66-Q69 WeakPolarHBondContact O-CA 3.3Å; S66-Q69 WeakPolarHBondContact O-CB 3.42Å; S66-Q69 PolarHBondContact O-N 2.7Å; S66-Q69 WeakPolarHBondContact OG-CG 3.36Å; S66-Q69 PolarHBondContact OG-N 2.86Å; S66-R70 PolarHBondContact O-N 2.74Å; S66-E300 WeakPolarHBondContact CA-OE1 3.39Å; S66-E300 WeakPolarHBondContact CB-OE2 3.36Å
67	N	97.9	Very high	97.2	Very high	16 Å²	16	34 Å²	34	9%	0.086	18%	0.182	C	C	.	.	H	α-helix	trans	-56.9	-39.8	179	-174.6	-82.3	0	0	0	111	Q69 R70 Q71 L104 T106 P108 E300	N67-Q69 VanDerWaalsContact C-N 3.3Å; N67-Q69 PolarHBondContact O-N 3.06Å; N67-R70 CarbonylContact O-C 3.59Å; N67-R70 WeakPolarHBondContact O-CA 3.49Å; N67-R70 WeakPolarHBondContact O-CB 3.48Å; N67-R70 PolarHBondContact O-N 2.89Å; N67-R70 VanDerWaalsContact O-N 3.08Å; N67-Q71 WeakPolarHBondContact O-CG 3.4Å; N67-Q71 PolarHBondContact O-N 3.21Å; N67-Q71 PolarHBondContact OD1-NE2 3.3Å; N67-L104 PolarHBondContact ND2-O 3.29Å; N67-T106 PolarHBondContact ND2-O 2.68Å; N67-P108 WeakPolarHBondContact OD1-CD 3.44Å; N67-E300 WeakPolarHBondContact CB-OE1 3.48Å; N67-E300 PolarHBondContact N-OE1 2.91Å; N67-E300 PolarHBondContact N-OE2 3.25Å
68	G	97.5	Very high	97.3	Very high	46 Å²	46	37.3 Å²	37.3	47%	0.474	20%	0.195	S	C	.	.	H	α-helix	trans	-57.4	-39.8	173.6	0	0	0	0	0	113.3	S66 L72	S66-G68 PolarHBondContact O-N 3.19Å; G68-L72 PolarHBondContact O-N 3.28Å
69	Q	98.4	Very high	97.4	Very high	19 Å²	19	40.7 Å²	40.7	9%	0.089	23%	0.23	C	C	.	.	H	α-helix	trans	-70.3	-40.3	173	-71.6	175.9	-29.3	0	0	111.8	K31 F34 R65 S66 N67 Q71 L72 I73	K31-Q69 PolarHBondContact O-NE2 3.42Å; F34-Q69 VanDerWaalsContact CB-NE2 3.27Å; F34-Q69 HydrophobicContact CD1-CB 4.34Å; F34-Q69 HydrophobicContact CD1-CG 3.83Å; F34-Q69 HydrophobicContact CD2-CB 4.29Å; F34-Q69 HydrophobicContact CD2-CG 4.28Å; F34-Q69 HydrophobicContact CE1-CB 4.06Å; F34-Q69 HydrophobicContact CE1-CG 3.99Å; F34-Q69 HydrophobicContact CE2-CB 4.02Å; F34-Q69 HydrophobicContact CE2-CG 4.44Å; F34-Q69 HydrophobicContact CG-CB 4.44Å; F34-Q69 HydrophobicContact CG-CG 3.97Å; F34-Q69 HydrophobicContact CZ-CB 3.88Å; F34-Q69 HydrophobicContact CZ-CG 4.28Å; R65-Q69 HydrophobicContact CB-CB 3.98Å; S66-Q69 CarbonylContact O-C 3.51Å; S66-Q69 WeakPolarHBondContact O-CA 3.3Å; S66-Q69 WeakPolarHBondContact O-CB 3.42Å; S66-Q69 PolarHBondContact O-N 2.7Å; S66-Q69 WeakPolarHBondContact OG-CG 3.36Å; S66-Q69 PolarHBondContact OG-N 2.86Å; N67-Q69 VanDerWaalsContact C-N 3.3Å; N67-Q69 PolarHBondContact O-N 3.06Å; Q69-Q71 VanDerWaalsContact C-N 3.26Å; Q69-Q71 PolarHBondContact O-N 3.03Å; Q69-L72 WeakPolarHBondContact O-CA 3.41Å; Q69-L72 WeakPolarHBondContact O-CB 3.45Å; Q69-L72 PolarHBondContact O-N 2.86Å; Q69-I73 WeakPolarHBondContact O-CG1 3.28Å; Q69-I73 PolarHBondContact O-N 2.62Å
70	R	98.6	Very high	97.4	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.008	25%	0.254	C	S	.	.	H	α-helix	trans	-58.6	-38	174.3	-63.5	175.8	-162.4	139.2	8.5	111.8	I28 L62 R65 S66 N67 L72 I73 C74 L104	I28-R70 VanDerWaalsContact CD1-NH2 3.27Å; L62-R70 HydrophobicContact CD2-CG 4.38Å; L62-R70 PolarHBondContact O-NE 3.08Å; L62-R70 PolarHBondContact O-NH2 3.33Å; R65-R70 HydrophobicContact CB-CG 4.09Å; R65-R70 VanDerWaalsContact O-CZ 3.22Å; R65-R70 PolarHBondContact O-NE 3.14Å; R65-R70 VanDerWaalsContact O-NE 3.11Å; R65-R70 PolarHBondContact O-NH2 3.4Å; S66-R70 PolarHBondContact O-N 2.74Å; N67-R70 CarbonylContact O-C 3.59Å; N67-R70 WeakPolarHBondContact O-CA 3.49Å; N67-R70 WeakPolarHBondContact O-CB 3.48Å; N67-R70 PolarHBondContact O-N 2.89Å; N67-R70 VanDerWaalsContact O-N 3.08Å; R70-L72 VanDerWaalsContact C-N 3.28Å; R70-L72 PolarHBondContact O-N 3.25Å; R70-I73 WeakPolarHBondContact O-CB 3.37Å; R70-I73 PolarHBondContact O-N 2.92Å; R70-C74 PolarHBondContact O-N 3.28Å; R70-C74 PolarHBondContact O-SG 3.28Å; R70-L104 WeakPolarHBondContact CD-O 3.25Å; R70-L104 PolarHBondContact NH1-O 3.14Å
71	Q	98.6	Very high	97.3	Very high	47 Å²	47	38.9 Å²	38.9	22%	0.22	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-35.3	174.1	-59.9	-40.4	-56.1	0	0	112.6	N67 Q69 K75 I105	N67-Q71 WeakPolarHBondContact O-CG 3.4Å; N67-Q71 PolarHBondContact O-N 3.21Å; N67-Q71 PolarHBondContact OD1-NE2 3.3Å; Q69-Q71 VanDerWaalsContact C-N 3.26Å; Q69-Q71 PolarHBondContact O-N 3.03Å; Q71-K75 WeakPolarHBondContact O-CG 3.36Å; Q71-K75 PolarHBondContact O-N 2.73Å; Q71-I105 PolarHBondContact NE2-O 3.47Å
72	L	98.6	Very high	97.2	Very high	86 Å²	86	41.6 Å²	41.6	45%	0.45	27%	0.266	S	S	.	.	H	α-helix	trans	-70.5	-39.7	174.4	-62.6	174.1	0	0	0	111.4	F34 A36 G68 Q69 R70 K75 A76	F34-L72 HydrophobicContact CE1-CB 4.01Å; F34-L72 HydrophobicContact CE1-CD1 3.78Å; F34-L72 HydrophobicContact CZ-CB 4.13Å; A36-L72 HydrophobicContact CB-CB 4.02Å; G68-L72 PolarHBondContact O-N 3.28Å; Q69-L72 WeakPolarHBondContact O-CA 3.41Å; Q69-L72 WeakPolarHBondContact O-CB 3.45Å; Q69-L72 PolarHBondContact O-N 2.86Å; R70-L72 VanDerWaalsContact C-N 3.28Å; R70-L72 PolarHBondContact O-N 3.25Å; L72-K75 PolarHBondContact O-N 3.21Å; L72-A76 WeakPolarHBondContact O-CB 3.47Å; L72-A76 PolarHBondContact O-N 3.43Å
73	I	98.6	Very high	97.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.3	-48.6	173.4	-63.4	169.9	0	0	0	110.4	F34 D39 A40 L43 I61 R65 Q69 R70 K75 A76 Y77	F34-I73 HydrophobicContact CE2-CD1 3.88Å; F34-I73 HydrophobicContact CE2-CG1 3.75Å; F34-I73 HydrophobicContact CZ-CD1 4.32Å; F34-I73 HydrophobicContact CZ-CG1 3.75Å; D39-I73 HydrophobicContact CB-CD1 3.77Å; D39-I73 HydrophobicContact CB-CG1 3.92Å; A40-I73 HydrophobicContact CB-CG2 4.25Å; L43-I73 HydrophobicContact CD1-CG2 3.48Å; L43-I73 VanDerWaalsContact CD1-CG2 3.48Å; I61-I73 HydrophobicContact CG2-CD1 3.9Å; R65-I73 HydrophobicContact CB-CD1 4.44Å; R65-I73 HydrophobicContact CG-CD1 3.96Å; Q69-I73 WeakPolarHBondContact O-CG1 3.28Å; Q69-I73 PolarHBondContact O-N 2.62Å; R70-I73 WeakPolarHBondContact O-CB 3.37Å; R70-I73 PolarHBondContact O-N 2.92Å; I73-K75 VanDerWaalsContact C-N 3.27Å; I73-K75 PolarHBondContact O-N 2.93Å; I73-A76 PolarHBondContact O-N 2.87Å; I73-A76 VanDerWaalsContact O-N 3.15Å; I73-Y77 VanDerWaalsContact O-CB 3.29Å; I73-Y77 WeakPolarHBondContact O-CB 3.25Å; I73-Y77 PolarHBondContact O-N 2.87Å
74	C	98.3	Very high	97.1	Very high	24 Å²	24	48.9 Å²	48.9	16%	0.162	30%	0.298	C	S	.	.	H	α-helix	trans	-55.4	-43.3	178.4	-69.8	0	0	0	0	111.7	R70 E78	R70-C74 PolarHBondContact O-N 3.28Å; R70-C74 PolarHBondContact O-SG 3.28Å; C74-E78 WeakPolarHBondContact O-CB 3.48Å; C74-E78 PolarHBondContact O-N 3.36Å
75	K	98.3	Very high	97.2	Very high	146 Å²	146	44.4 Å²	44.4	64%	0.635	28%	0.277	S	S	*	.	H	α-helix	trans	-66.1	-44.7	176.4	-72	176.3	-178.4	-179.9	0	112.8	Q71 L72 I73 Y77 E78 G79	Q71-K75 WeakPolarHBondContact O-CG 3.36Å; Q71-K75 PolarHBondContact O-N 2.73Å; L72-K75 PolarHBondContact O-N 3.21Å; I73-K75 VanDerWaalsContact C-N 3.27Å; I73-K75 PolarHBondContact O-N 2.93Å; K75-Y77 VanDerWaalsContact C-N 3.34Å; K75-E78 PolarHBondContact O-N 2.72Å; K75-G79 PolarHBondContact O-N 2.67Å
76	A	98.3	Very high	97.1	Very high	23 Å²	23	48.1 Å²	48.1	19%	0.19	30%	0.295	C	S	.	.	H	α-helix	trans	-64.2	-41	178.1	0	0	0	0	0	111.5	A36 E37 A40 L72 I73 G79 A80	A36-A76 HydrophobicContact CB-CB 4.14Å; E37-A76 HydrophobicContact CG-CB 4.44Å; A40-A76 HydrophobicContact CB-CB 3.85Å; L72-A76 WeakPolarHBondContact O-CB 3.47Å; L72-A76 PolarHBondContact O-N 3.43Å; I73-A76 PolarHBondContact O-N 2.87Å; I73-A76 VanDerWaalsContact O-N 3.15Å; A76-G79 PolarHBondContact O-N 2.71Å; A76-A80 WeakPolarHBondContact O-CB 3.47Å; A76-A80 PolarHBondContact O-N 3.21Å
77	Y	98	Very high	96.9	Very high	1 Å²	1	54.4 Å²	54.4	0%	0.004	32%	0.321	C	S	.	.	H	α-helix	trans	-60.5	-47.7	175.6	-172.1	-80.6	0	0	0	111.6	L43 K44 I47 I73 K75 G79 A80 T81 R83 L85 D88	L43-Y77 HydrophobicContact CB-CD2 4.33Å; L43-Y77 HydrophobicContact CB-CE2 4.34Å; K44-Y77 HydrophobicContact CB-CD2 4.36Å; K44-Y77 HydrophobicContact CB-CE2 3.77Å; I47-Y77 HydrophobicContact CD1-CE2 4.41Å; I73-Y77 VanDerWaalsContact O-CB 3.29Å; I73-Y77 WeakPolarHBondContact O-CB 3.25Å; I73-Y77 PolarHBondContact O-N 2.87Å; K75-Y77 VanDerWaalsContact C-N 3.34Å; Y77-G79 PolarHBondContact O-N 3.43Å; Y77-A80 PolarHBondContact O-N 3.28Å; Y77-T81 HydrophobicContact CD1-CG2 4.17Å; Y77-T81 HydrophobicContact CE1-CG2 3.88Å; Y77-T81 WeakPolarHBondContact CE1-OG1 3.47Å; Y77-T81 HydrophobicContact CE2-CG2 4.31Å; Y77-T81 HydrophobicContact CG-CG2 4.49Å; Y77-T81 WeakPolarHBondContact O-CB 3.4Å; Y77-T81 WeakPolarHBondContact O-CG2 3.48Å; Y77-T81 PolarHBondContact O-N 2.97Å; Y77-T81 PolarHBondContact O-OG1 3.28Å; Y77-R83 WeakPolarHBondContact CD1-O 3.06Å; Y77-L85 HydrophobicContact CD1-CB 3.92Å; Y77-L85 HydrophobicContact CD2-CD1 4.05Å; Y77-L85 HydrophobicContact CE1-CB 4.33Å; Y77-L85 HydrophobicContact CE1-CD1 4.45Å; Y77-L85 HydrophobicContact CE2-CD1 3.91Å; Y77-L85 HydrophobicContact CG-CB 4.08Å; Y77-L85 HydrophobicContact CG-CD1 4.37Å; Y77-D88 WeakPolarHBondContact CE1-OD2 3.4Å; Y77-D88 PolarHBondContact OH-OD2 2.88Å
78	E	97.3	Very high	96.7	Very high	100 Å²	100	54 Å²	54	47%	0.467	32%	0.318	S	S	.	.	H	α-helix	trans	-63.3	-41.5	177.2	-173.9	174.9	-165.5	0	0	111.9	C74 K75 A80 G82 R83 T84	C74-E78 WeakPolarHBondContact O-CB 3.48Å; C74-E78 PolarHBondContact O-N 3.36Å; K75-E78 PolarHBondContact O-N 2.72Å; E78-A80 VanDerWaalsContact C-N 3.32Å; E78-A80 PolarHBondContact O-N 3.47Å; E78-G82 VanDerWaalsContact O-CA 3.32Å; E78-G82 WeakPolarHBondContact O-CA 3.42Å; E78-G82 PolarHBondContact O-N 3.16Å; E78-R83 VanDerWaalsContact CA-O 3.32Å; E78-R83 WeakPolarHBondContact CA-O 3.33Å; E78-T84 HydrophobicContact CG-CG2 4.5Å
79	G	97.3	Very high	96.6	Very high	71 Å²	71	51.8 Å²	51.8	73%	0.732	30%	0.296	S	S	*	.	H	α-helix	trans	-62.1	-36.3	175.2	0	0	0	0	0	113.8	K75 A76 Y77	K75-G79 PolarHBondContact O-N 2.67Å; A76-G79 PolarHBondContact O-N 2.71Å; Y77-G79 PolarHBondContact O-N 3.43Å
80	A	94.6	Very high	96.3	Very high	73 Å²	73	55.7 Å²	55.7	60%	0.603	31%	0.312	S	S	*	.	H	α-helix	trans	-85	-30.7	-177.3	0	0	0	0	0	114.1	A76 Y77 E78	A76-A80 WeakPolarHBondContact O-CB 3.47Å; A76-A80 PolarHBondContact O-N 3.21Å; Y77-A80 PolarHBondContact O-N 3.28Å; E78-A80 VanDerWaalsContact C-N 3.32Å; E78-A80 PolarHBondContact O-N 3.47Å
81	T	93.5	Very high	95.9	Very high	34 Å²	34	58.4 Å²	58.4	21%	0.209	34%	0.341	C	S	.	.	H	α-helix	trans	-108.7	-21.6	-173.3	65.5	0	0	0	0	113.9	K44 Y77 R83	K44-T81 HydrophobicContact CB-CG2 4.42Å; K44-T81 HydrophobicContact CD-CG2 3.7Å; K44-T81 HydrophobicContact CG-CG2 3.89Å; Y77-T81 HydrophobicContact CD1-CG2 4.17Å; Y77-T81 HydrophobicContact CE1-CG2 3.88Å; Y77-T81 WeakPolarHBondContact CE1-OG1 3.47Å; Y77-T81 HydrophobicContact CE2-CG2 4.31Å; Y77-T81 HydrophobicContact CG-CG2 4.49Å; Y77-T81 WeakPolarHBondContact O-CB 3.4Å; Y77-T81 WeakPolarHBondContact O-CG2 3.48Å; Y77-T81 PolarHBondContact O-N 2.97Å; Y77-T81 PolarHBondContact O-OG1 3.28Å; T81-R83 PolarHBondContact O-N 3.42Å; T81-R83 PolarHBondContact OG1-N 2.97Å; T81-R83 VanDerWaalsContact OG1-N 3.09Å; T81-R83 PolarHBondContact OG1-O 3.24Å
82	G	95.2	Very high	95.4	Very high	67 Å²	67	58 Å²	58	69%	0.691	34%	0.341	S	S	*	.	S	Bend	trans	70.3	5.8	-168.2	0	0	0	0	0	114.4	E78	E78-G82 VanDerWaalsContact O-CA 3.32Å; E78-G82 WeakPolarHBondContact O-CA 3.42Å; E78-G82 PolarHBondContact O-N 3.16Å
83	R	94	Very high	95	Very high	118 Å²	118	54.9 Å²	54.9	45%	0.445	33%	0.325	S	S	.	.	S	Bend	trans	-120.9	152.3	176	-62.9	-172.1	-66.4	161.2	-4.9	109.9	Y77 E78 T81 D88	Y77-R83 WeakPolarHBondContact CD1-O 3.06Å; E78-R83 VanDerWaalsContact CA-O 3.32Å; E78-R83 WeakPolarHBondContact CA-O 3.33Å; T81-R83 PolarHBondContact O-N 3.42Å; T81-R83 PolarHBondContact OG1-N 2.97Å; T81-R83 VanDerWaalsContact OG1-N 3.09Å; T81-R83 PolarHBondContact OG1-O 3.24Å; R83-D88 WeakPolarHBondContact CD-OD1 3.42Å; R83-D88 IonicContact CZ-OD1 2.75Å; R83-D88 IonicContact CZ-OD2 2.99Å; R83-D88 IonicContact NE-OD1 3.32Å; R83-D88 PolarHBondContact NE-OD1 3.47Å; R83-D88 IonicContact NE-OD2 3.31Å; R83-D88 PolarHBondContact NE-OD2 2.96Å; R83-D88 IonicContact NH1-OD1 3.46Å; R83-D88 PolarHBondContact NH1-OD1 3.11Å; R83-D88 IonicContact NH1-OD2 3.76Å; R83-D88 IonicContact NH2-OD1 2.69Å; R83-D88 IonicContact NH2-OD2 3.08Å; R83-D88 PolarHBondContact NH2-OD2 2.82Å
84	T	96.3	Very high	94.6	Very high	37 Å²	37	56.8 Å²	56.8	23%	0.227	35%	0.345	C	S	.	.			trans	-81.5	140.3	175.9	61.8	0	0	0	0	110.1	E78 E86 K87 D88	E78-T84 HydrophobicContact CG-CG2 4.5Å; T84-E86 PolarHBondContact O-N 3.34Å; T84-K87 PolarHBondContact O-N 3.47Å; T84-K87 VanDerWaalsContact OG1-CG 3.28Å; T84-K87 WeakPolarHBondContact OG1-CG 3.32Å; T84-K87 PolarHBondContact OG1-N 2.95Å; T84-D88 PolarHBondContact O-N 3.07Å
85	L	96.2	Very high	94.5	Very high	3 Å²	3	58 Å²	58	2%	0.016	36%	0.361	C	S	.	.	H	α-helix	trans	-54.7	-37.3	175.3	179.4	61.2	0	0	0	111.7	L43 I47 Y77 K87 D88 L89 I105	L43-L85 HydrophobicContact CD1-CD1 4.27Å; L43-L85 HydrophobicContact CD1-CD2 3.79Å; I47-L85 HydrophobicContact CD1-CD1 3.67Å; Y77-L85 HydrophobicContact CD1-CB 3.92Å; Y77-L85 HydrophobicContact CD2-CD1 4.05Å; Y77-L85 HydrophobicContact CE1-CB 4.33Å; Y77-L85 HydrophobicContact CE1-CD1 4.45Å; Y77-L85 HydrophobicContact CE2-CD1 3.91Å; Y77-L85 HydrophobicContact CG-CB 4.08Å; Y77-L85 HydrophobicContact CG-CD1 4.37Å; L85-K87 PolarHBondContact O-N 3.19Å; L85-D88 PolarHBondContact O-N 3.35Å; L85-L89 HydrophobicContact CD1-CD1 4.34Å; L85-L89 HydrophobicContact CD1-CD2 4.47Å; L85-L89 HydrophobicContact CD1-CG 4.08Å; L85-L89 HydrophobicContact CG-CD1 4.01Å; L85-L89 HydrophobicContact CG-CG 4.22Å; L85-L89 WeakPolarHBondContact O-CB 3.27Å; L85-L89 VanDerWaalsContact O-CG 3.29Å; L85-L89 WeakPolarHBondContact O-CG 3.38Å; L85-L89 PolarHBondContact O-N 3.32Å; L85-I105 HydrophobicContact CD2-CG2 4.12Å; L85-I105 HydrophobicContact CG-CD1 4.37Å
86	E	95.9	Very high	94.3	Very high	87 Å²	87	53.1 Å²	53.1	41%	0.407	34%	0.342	S	S	.	.	H	α-helix	trans	-56.8	-43.7	175.6	-168.7	-159	141.8	0	0	113.2	T84 K90 L102 I105	T84-E86 PolarHBondContact O-N 3.34Å; E86-K90 WeakPolarHBondContact O-CG 3.38Å; E86-K90 PolarHBondContact O-N 3.35Å; E86-K90 VanDerWaalsContact O-N 3.13Å; E86-K90 IonicContact OE1-NZ 3.59Å; E86-K90 PolarHBondContact OE1-NZ 2.99Å; E86-L102 HydrophobicContact CB-CD2 4.43Å; E86-L102 HydrophobicContact CG-CD2 3.68Å; E86-I105 HydrophobicContact CB-CD1 4.02Å; E86-I105 HydrophobicContact CG-CD1 4.49Å
87	K	94.6	Very high	94.2	Very high	143 Å²	143	52.4 Å²	52.4	62%	0.622	34%	0.335	S	S	*	.	H	α-helix	trans	-68.8	-40.1	-179.5	-80	177.2	-179.5	177.4	0	111.6	T84 L85 K90 G91	T84-K87 PolarHBondContact O-N 3.47Å; T84-K87 VanDerWaalsContact OG1-CG 3.28Å; T84-K87 WeakPolarHBondContact OG1-CG 3.32Å; T84-K87 PolarHBondContact OG1-N 2.95Å; L85-K87 PolarHBondContact O-N 3.19Å; K87-K90 PolarHBondContact O-N 2.83Å; K87-G91 PolarHBondContact O-N 3.04Å; K87-G91 VanDerWaalsContact O-N 3.11Å
88	D	93.8	Very high	94.1	Very high	6 Å²	6	54.4 Å²	54.4	3%	0.032	34%	0.344	C	S	.	.	H	α-helix	trans	-70.6	-41.7	-179.4	-71.8	-4.9	0	0	0	110.4	I47 Y77 R83 T84 L85 K90 G91 D92	I47-D88 HydrophobicContact CD1-CB 4.5Å; I47-D88 HydrophobicContact CG2-CB 4.1Å; Y77-D88 WeakPolarHBondContact CE1-OD2 3.4Å; Y77-D88 PolarHBondContact OH-OD2 2.88Å; R83-D88 WeakPolarHBondContact CD-OD1 3.42Å; R83-D88 IonicContact CZ-OD1 2.75Å; R83-D88 IonicContact CZ-OD2 2.99Å; R83-D88 IonicContact NE-OD1 3.32Å; R83-D88 PolarHBondContact NE-OD1 3.47Å; R83-D88 IonicContact NE-OD2 3.31Å; R83-D88 PolarHBondContact NE-OD2 2.96Å; R83-D88 IonicContact NH1-OD1 3.46Å; R83-D88 PolarHBondContact NH1-OD1 3.11Å; R83-D88 IonicContact NH1-OD2 3.76Å; R83-D88 IonicContact NH2-OD1 2.69Å; R83-D88 IonicContact NH2-OD2 3.08Å; R83-D88 PolarHBondContact NH2-OD2 2.82Å; T84-D88 PolarHBondContact O-N 3.07Å; L85-D88 PolarHBondContact O-N 3.35Å; D88-K90 VanDerWaalsContact C-N 3.33Å; D88-K90 PolarHBondContact O-N 3.32Å; D88-G91 PolarHBondContact O-N 3.23Å; D88-D92 PolarHBondContact O-N 2.95Å
89	L	94.1	Very high	94.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-58.3	-42.3	172.1	-70.3	176.3	0	0	0	112.6	I47 L58 L62 L85 G91 D92 T93 L101 L102 I105	I47-L89 HydrophobicContact CD1-CD2 4.12Å; L58-L89 HydrophobicContact CD1-CD2 4.06Å; L58-L89 HydrophobicContact CD2-CD2 4.27Å; L62-L89 HydrophobicContact CD1-CD1 4.44Å; L85-L89 HydrophobicContact CD1-CD1 4.34Å; L85-L89 HydrophobicContact CD1-CD2 4.47Å; L85-L89 HydrophobicContact CD1-CG 4.08Å; L85-L89 HydrophobicContact CG-CD1 4.01Å; L85-L89 HydrophobicContact CG-CG 4.22Å; L85-L89 WeakPolarHBondContact O-CB 3.27Å; L85-L89 VanDerWaalsContact O-CG 3.29Å; L85-L89 WeakPolarHBondContact O-CG 3.38Å; L85-L89 PolarHBondContact O-N 3.32Å; L89-G91 PolarHBondContact O-N 3.5Å; L89-D92 PolarHBondContact O-N 2.91Å; L89-T93 WeakPolarHBondContact O-CB 3.33Å; L89-T93 PolarHBondContact O-N 3.45Å; L89-T93 PolarHBondContact O-OG1 3.46Å; L89-L101 HydrophobicContact CD1-CB 4.15Å; L89-L101 HydrophobicContact CD2-CD1 3.91Å; L89-L102 HydrophobicContact CB-CD2 4.08Å; L89-L102 HydrophobicContact CD1-CD2 4.37Å; L89-I105 HydrophobicContact CD1-CD1 3.83Å; L89-I105 HydrophobicContact CD1-CG1 4.45Å
90	K	92.8	Very high	94.1	Very high	101 Å²	101	52 Å²	52	44%	0.439	31%	0.312	S	S	.	.	H	α-helix	trans	-66.1	-23.9	175	-76.4	173.7	175.9	173.6	0	114	E86 K87 D88 L102	E86-K90 WeakPolarHBondContact O-CG 3.38Å; E86-K90 PolarHBondContact O-N 3.35Å; E86-K90 VanDerWaalsContact O-N 3.13Å; E86-K90 IonicContact OE1-NZ 3.59Å; E86-K90 PolarHBondContact OE1-NZ 2.99Å; K87-K90 PolarHBondContact O-N 2.83Å; D88-K90 VanDerWaalsContact C-N 3.33Å; D88-K90 PolarHBondContact O-N 3.32Å; K90-L102 HydrophobicContact CD-CD1 4.28Å; K90-L102 VanDerWaalsContact CE-CD1 3.46Å; K90-L102 HydrophobicContact CG-CD1 3.74Å; K90-L102 HydrophobicContact CG-CD2 4.12Å
91	G	88.8	Confident	94.2	Very high	60 Å²	60	48.5 Å²	48.5	62%	0.619	28%	0.283	S	S	*	.	H	α-helix	trans	-85.1	-33.6	179.3	0	0	0	0	0	112.9	K87 D88 L89	K87-G91 PolarHBondContact O-N 3.04Å; K87-G91 VanDerWaalsContact O-N 3.11Å; D88-G91 PolarHBondContact O-N 3.23Å; L89-G91 PolarHBondContact O-N 3.5Å
92	D	88.4	Confident	94.5	Very high	38 Å²	38	47.9 Å²	47.9	20%	0.203	28%	0.279	C	S	.	.	H	α-helix	trans	-114.8	-5.5	-166.8	-70.6	-67.7	0	0	0	114.7	I47 G51 T52 D88 L89	I47-D92 HydrophobicContact CG2-CB 3.94Å; I47-D92 VanDerWaalsContact CG2-OD2 3.23Å; I47-D92 WeakPolarHBondContact CG2-OD2 3.48Å; G51-D92 WeakPolarHBondContact CA-OD1 3.41Å; G51-D92 PolarHBondContact N-OD1 3.39Å; T52-D92 PolarHBondContact N-O 3.3Å; T52-D92 PolarHBondContact OG1-O 2.95Å; D88-D92 PolarHBondContact O-N 2.95Å; L89-D92 PolarHBondContact O-N 2.91Å
93	T	90.8	Very high	94.6	Very high	20 Å²	20	44.9 Å²	44.9	12%	0.123	25%	0.247	C	C	.	.			trans	-122.1	172.8	171.9	68.3	0	0	0	0	110.7	T52 L58 L89 F97 E98 L101	T52-T93 WeakPolarHBondContact OG1-CG2 3.17Å; L58-T93 HydrophobicContact CD1-CG2 4.09Å; L89-T93 WeakPolarHBondContact O-CB 3.33Å; L89-T93 PolarHBondContact O-N 3.45Å; L89-T93 PolarHBondContact O-OG1 3.46Å; T93-F97 HydrophobicContact CG2-CD1 4.28Å; T93-F97 HydrophobicContact CG2-CE1 4.05Å; T93-E98 WeakPolarHBondContact OG1-CA 3.28Å; T93-E98 VanDerWaalsContact OG1-CB 3.24Å; T93-E98 WeakPolarHBondContact OG1-CB 3.46Å; T93-E98 WeakPolarHBondContact OG1-CG 3.08Å; T93-L101 HydrophobicContact CG2-CD1 4.11Å
94	G	90.9	Very high	94.8	Very high	40 Å²	40	39.2 Å²	39.2	41%	0.412	23%	0.226	S	C	.	.			trans	-153.1	172.9	177.8	0	0	0	0	0	113.6	E98	G94-E98 WeakPolarHBondContact CA-OE2 3.47Å; G94-E98 PolarHBondContact O-N 3.02Å
95	G	94.6	Very high	94.9	Very high	50 Å²	50	37.9 Å²	37.9	52%	0.515	22%	0.217	S	C	.	.	H	α-helix	trans	62.7	-147.6	173.7	0	0	0	0	0	113.7	F97 E98 K99	G95-F97 VanDerWaalsContact C-N 3.31Å; G95-E98 PolarHBondContact O-N 3.18Å; G95-K99 WeakPolarHBondContact O-CG 3.32Å; G95-K99 PolarHBondContact O-N 3.47Å
96	D	95.4	Very high	95	Very high	44 Å²	44	38.8 Å²	38.8	24%	0.235	22%	0.223	C	C	.	.	H	α-helix	trans	-76.6	-20.9	-178.3	-56.9	-56	0	0	0	113	K99 L100 E288 Y330	D96-K99 PolarHBondContact O-N 3.25Å; D96-K99 IonicContact OD1-NZ 3.49Å; D96-K99 PolarHBondContact OD1-NZ 3.28Å; D96-L100 WeakPolarHBondContact O-CB 3.37Å; D96-L100 PolarHBondContact O-N 2.94Å; D96-E288 HydrophobicContact CB-CB 4.08Å; D96-E288 HydrophobicContact CB-CG 4.26Å; D96-Y330 HydrophobicContact CB-CD2 3.84Å; D96-Y330 HydrophobicContact CB-CE2 4Å; D96-Y330 HydrophobicContact CB-CG 4.17Å; D96-Y330 WeakPolarHBondContact O-CD2 2.77Å
97	F	95.5	Very high	95.1	Very high	7 Å²	7	37.1 Å²	37.1	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-62.9	-48.9	170.1	-179.3	-125.1	0	0	0	111.2	E55 I59 T93 G95 K99 L100 L101 E329 C333	E55-F97 HydrophobicContact CB-CE1 4.12Å; E55-F97 HydrophobicContact CB-CZ 4.06Å; E55-F97 HydrophobicContact CG-CE1 3.91Å; E55-F97 HydrophobicContact CG-CZ 4.38Å; I59-F97 HydrophobicContact CD1-CE2 3.94Å; I59-F97 HydrophobicContact CD1-CZ 4.19Å; I59-F97 HydrophobicContact CG1-CE2 3.74Å; I59-F97 HydrophobicContact CG1-CZ 3.99Å; T93-F97 HydrophobicContact CG2-CD1 4.28Å; T93-F97 HydrophobicContact CG2-CE1 4.05Å; G95-F97 VanDerWaalsContact C-N 3.31Å; F97-K99 PolarHBondContact O-N 3.35Å; F97-L100 PolarHBondContact O-N 2.87Å; F97-L101 HydrophobicContact CD1-CD1 4.37Å; F97-L101 HydrophobicContact CD2-CG 4.29Å; F97-L101 HydrophobicContact CE1-CD1 3.82Å; F97-L101 HydrophobicContact CE2-CD1 4.03Å; F97-L101 HydrophobicContact CE2-CD2 3.87Å; F97-L101 HydrophobicContact CE2-CG 3.96Å; F97-L101 HydrophobicContact CZ-CD1 3.63Å; F97-L101 HydrophobicContact CZ-CD2 4.19Å; F97-L101 HydrophobicContact CZ-CG 4.1Å; F97-L101 WeakPolarHBondContact O-CG 3.29Å; F97-L101 PolarHBondContact O-N 2.99Å; F97-E329 HydrophobicContact CB-CB 4.22Å; F97-E329 HydrophobicContact CD1-CB 3.83Å; F97-E329 HydrophobicContact CD1-CG 4.49Å; F97-E329 HydrophobicContact CD2-CB 3.65Å; F97-E329 WeakPolarHBondContact CD2-O 3.39Å; F97-E329 HydrophobicContact CE1-CB 4.04Å; F97-E329 HydrophobicContact CE1-CG 4.48Å; F97-E329 HydrophobicContact CE2-CB 3.88Å; F97-E329 HydrophobicContact CG-CB 3.63Å; F97-E329 HydrophobicContact CZ-CB 4.05Å; F97-C333 HydrophobicContact CD2-CB 4.22Å; F97-C333 HydrophobicContact CE2-CB 4.01Å
98	E	95.8	Very high	95.2	Very high	44 Å²	44	34.2 Å²	34.2	21%	0.206	22%	0.215	C	C	.	.	H	α-helix	trans	-55.2	-51.4	173.7	-179.3	-166.7	131.9	0	0	111.2	T93 G94 G95 L100 L101 L102	T93-E98 WeakPolarHBondContact OG1-CA 3.28Å; T93-E98 VanDerWaalsContact OG1-CB 3.24Å; T93-E98 WeakPolarHBondContact OG1-CB 3.46Å; T93-E98 WeakPolarHBondContact OG1-CG 3.08Å; G94-E98 WeakPolarHBondContact CA-OE2 3.47Å; G94-E98 PolarHBondContact O-N 3.02Å; G95-E98 PolarHBondContact O-N 3.18Å; E98-L100 VanDerWaalsContact C-N 3.27Å; E98-L100 PolarHBondContact O-N 3.46Å; E98-L101 PolarHBondContact O-N 3.32Å; E98-L101 VanDerWaalsContact O-N 3.17Å; E98-L102 HydrophobicContact CG-CD1 3.86Å; E98-L102 HydrophobicContact CG-CG 4.26Å; E98-L102 VanDerWaalsContact O-CG 3.28Å; E98-L102 WeakPolarHBondContact O-CG 3.42Å; E98-L102 PolarHBondContact O-N 2.91Å
99	K	96.9	Very high	95.4	Very high	120 Å²	120	35 Å²	35	52%	0.522	22%	0.222	S	C	.	.	H	α-helix	trans	-57.8	-40.8	-178.9	-65.3	175.7	-161.1	156.4	0	111.9	G95 D96 F97 A103	G95-K99 WeakPolarHBondContact O-CG 3.32Å; G95-K99 PolarHBondContact O-N 3.47Å; D96-K99 PolarHBondContact O-N 3.25Å; D96-K99 IonicContact OD1-NZ 3.49Å; D96-K99 PolarHBondContact OD1-NZ 3.28Å; F97-K99 PolarHBondContact O-N 3.35Å; K99-A103 VanDerWaalsContact O-CB 3.31Å; K99-A103 WeakPolarHBondContact O-CB 3.3Å; K99-A103 PolarHBondContact O-N 3.19Å
100	L	98	Very high	95.7	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.9	-45	177.5	178.4	59.9	0	0	0	112	D96 F97 E98 L102 A103 L104 T292 V296 Y330 C333 L334 I337	D96-L100 WeakPolarHBondContact O-CB 3.37Å; D96-L100 PolarHBondContact O-N 2.94Å; F97-L100 PolarHBondContact O-N 2.87Å; E98-L100 VanDerWaalsContact C-N 3.27Å; E98-L100 PolarHBondContact O-N 3.46Å; L100-L102 PolarHBondContact O-N 3.24Å; L100-A103 PolarHBondContact O-N 3.01Å; L100-L104 WeakPolarHBondContact O-CG 3.43Å; L100-L104 PolarHBondContact O-N 3.47Å; L100-T292 HydrophobicContact CB-CG2 4.22Å; L100-T292 HydrophobicContact CD1-CG2 3.77Å; L100-V296 HydrophobicContact CD1-CG2 3.53Å; L100-Y330 HydrophobicContact CB-CD2 4.09Å; L100-Y330 HydrophobicContact CB-CE2 3.98Å; L100-Y330 HydrophobicContact CD2-CD2 3.75Å; L100-Y330 HydrophobicContact CD2-CE2 3.8Å; L100-Y330 HydrophobicContact CG-CE2 4.4Å; L100-C333 HydrophobicContact CD2-CB 3.55Å; L100-C333 WeakPolarHBondContact CD2-SG 3.07Å; L100-L334 HydrophobicContact CD1-CD2 4.16Å; L100-L334 HydrophobicContact CD2-CD2 3.9Å; L100-L334 HydrophobicContact CD2-CG 3.95Å; L100-I337 HydrophobicContact CD1-CD1 3.88Å; L100-I337 HydrophobicContact CD2-CD1 4.34Å; L100-I337 HydrophobicContact CG-CD1 4.41Å
101	L	97.6	Very high	95.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63	-42.8	177.2	-64.2	-173.1	0	0	0	111.8	L58 L62 L89 T93 F97 E98 L104 I105	L58-L101 HydrophobicContact CB-CD1 4.25Å; L58-L101 HydrophobicContact CD1-CD1 3.86Å; L62-L101 HydrophobicContact CD1-CB 4.39Å; L62-L101 HydrophobicContact CD1-CD2 3.99Å; L89-L101 HydrophobicContact CD1-CB 4.15Å; L89-L101 HydrophobicContact CD2-CD1 3.91Å; T93-L101 HydrophobicContact CG2-CD1 4.11Å; F97-L101 HydrophobicContact CD1-CD1 4.37Å; F97-L101 HydrophobicContact CD2-CG 4.29Å; F97-L101 HydrophobicContact CE1-CD1 3.82Å; F97-L101 HydrophobicContact CE2-CD1 4.03Å; F97-L101 HydrophobicContact CE2-CD2 3.87Å; F97-L101 HydrophobicContact CE2-CG 3.96Å; F97-L101 HydrophobicContact CZ-CD1 3.63Å; F97-L101 HydrophobicContact CZ-CD2 4.19Å; F97-L101 HydrophobicContact CZ-CG 4.1Å; F97-L101 WeakPolarHBondContact O-CG 3.29Å; F97-L101 PolarHBondContact O-N 2.99Å; E98-L101 PolarHBondContact O-N 3.32Å; E98-L101 VanDerWaalsContact O-N 3.17Å; L101-L104 HydrophobicContact CD2-CD1 4.36Å; L101-L104 WeakPolarHBondContact O-CB 3.28Å; L101-L104 PolarHBondContact O-N 2.73Å; L101-I105 PolarHBondContact O-N 3.45Å; L101-I105 VanDerWaalsContact O-N 3.15Å
102	L	98	Very high	96.4	Very high	21 Å²	21	29 Å²	29	11%	0.11	18%	0.181	C	C	.	.	H	α-helix	trans	-62	-43.4	175.4	-66.9	177.1	0	0	0	111.6	E86 L89 K90 E98 L100 L104 I105 T106	E86-L102 HydrophobicContact CB-CD2 4.43Å; E86-L102 HydrophobicContact CG-CD2 3.68Å; L89-L102 HydrophobicContact CB-CD2 4.08Å; L89-L102 HydrophobicContact CD1-CD2 4.37Å; K90-L102 HydrophobicContact CD-CD1 4.28Å; K90-L102 VanDerWaalsContact CE-CD1 3.46Å; K90-L102 HydrophobicContact CG-CD1 3.74Å; K90-L102 HydrophobicContact CG-CD2 4.12Å; E98-L102 HydrophobicContact CG-CD1 3.86Å; E98-L102 HydrophobicContact CG-CG 4.26Å; E98-L102 VanDerWaalsContact O-CG 3.28Å; E98-L102 WeakPolarHBondContact O-CG 3.42Å; E98-L102 PolarHBondContact O-N 2.91Å; L100-L102 PolarHBondContact O-N 3.24Å; L102-L104 VanDerWaalsContact C-N 3.31Å; L102-L104 PolarHBondContact O-N 2.98Å; L102-I105 HydrophobicContact CD2-CD1 4.36Å; L102-I105 WeakPolarHBondContact O-CG1 3.3Å; L102-I105 PolarHBondContact O-N 3.27Å; L102-T106 WeakPolarHBondContact O-CB 3.18Å; L102-T106 PolarHBondContact O-N 3.49Å; L102-T106 VanDerWaalsContact O-N 3.1Å; L102-T106 PolarHBondContact O-OG1 3.31Å
103	A	98.3	Very high	96.8	Very high	3 Å²	3	27.2 Å²	27.2	3%	0.025	17%	0.171	C	C	.	.	H	α-helix	trans	-59.7	-42.2	175	0	0	0	0	0	111.5	K99 L100 I105 T106 Y111 T292 V296	K99-A103 VanDerWaalsContact O-CB 3.31Å; K99-A103 WeakPolarHBondContact O-CB 3.3Å; K99-A103 PolarHBondContact O-N 3.19Å; L100-A103 PolarHBondContact O-N 3.01Å; A103-I105 PolarHBondContact O-N 2.99Å; A103-T106 PolarHBondContact O-N 3.32Å; A103-Y111 HydrophobicContact CB-CD2 4.09Å; A103-Y111 HydrophobicContact CB-CE1 4.3Å; A103-Y111 HydrophobicContact CB-CE2 3.47Å; A103-Y111 VanDerWaalsContact CB-CE2 3.47Å; A103-T292 HydrophobicContact CB-CG2 4.07Å; A103-V296 HydrophobicContact CB-CB 4.39Å; A103-V296 HydrophobicContact CB-CG1 4.16Å; A103-V296 HydrophobicContact CB-CG2 3.98Å
104	L	98.2	Very high	97.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.5	-40.2	179	-72.3	169.2	0	0	0	112.9	L62 T63 N67 R70 L100 L101 L102 V296 I337	L62-L104 HydrophobicContact CB-CD1 4.19Å; T63-L104 HydrophobicContact CG2-CD1 4.07Å; N67-L104 PolarHBondContact ND2-O 3.29Å; R70-L104 WeakPolarHBondContact CD-O 3.25Å; R70-L104 PolarHBondContact NH1-O 3.14Å; L100-L104 WeakPolarHBondContact O-CG 3.43Å; L100-L104 PolarHBondContact O-N 3.47Å; L101-L104 HydrophobicContact CD2-CD1 4.36Å; L101-L104 WeakPolarHBondContact O-CB 3.28Å; L101-L104 PolarHBondContact O-N 2.73Å; L102-L104 VanDerWaalsContact C-N 3.31Å; L102-L104 PolarHBondContact O-N 2.98Å; L104-V296 HydrophobicContact CD2-CG1 4.37Å; L104-V296 HydrophobicContact CD2-CG2 3.98Å; L104-V296 HydrophobicContact CG-CG2 4.22Å; L104-I337 HydrophobicContact CD1-CD1 4.16Å; L104-I337 HydrophobicContact CD2-CD1 3.92Å; L104-I337 HydrophobicContact CD2-CG1 4.39Å; L104-I337 HydrophobicContact CG-CD1 4.45Å
105	I	98.1	Very high	97.5	Very high	9 Å²	9	29 Å²	29	5%	0.046	17%	0.167	C	C	.	.	H	α-helix	trans	-83.8	-10.9	-178.9	65.1	160.2	0	0	0	113.7	L62 Q71 L85 E86 L89 L101 L102 A103	L62-I105 HydrophobicContact CD1-CG2 4.05Å; L62-I105 HydrophobicContact CD2-CG2 3.69Å; L62-I105 HydrophobicContact CG-CG2 4.48Å; Q71-I105 PolarHBondContact NE2-O 3.47Å; L85-I105 HydrophobicContact CD2-CG2 4.12Å; L85-I105 HydrophobicContact CG-CD1 4.37Å; E86-I105 HydrophobicContact CB-CD1 4.02Å; E86-I105 HydrophobicContact CG-CD1 4.49Å; L89-I105 HydrophobicContact CD1-CD1 3.83Å; L89-I105 HydrophobicContact CD1-CG1 4.45Å; L101-I105 PolarHBondContact O-N 3.45Å; L101-I105 VanDerWaalsContact O-N 3.15Å; L102-I105 HydrophobicContact CD2-CD1 4.36Å; L102-I105 WeakPolarHBondContact O-CG1 3.3Å; L102-I105 PolarHBondContact O-N 3.27Å; A103-I105 PolarHBondContact O-N 2.99Å
106	T	98.4	Very high	97.6	Very high	21 Å²	21	26.6 Å²	26.6	13%	0.129	14%	0.143	C	C	.	.	S	Bend	trans	-80.1	133.6	-179.9	-60.2	0	0	0	0	110.5	N67 L102 A103 A110	N67-T106 PolarHBondContact ND2-O 2.68Å; L102-T106 WeakPolarHBondContact O-CB 3.18Å; L102-T106 PolarHBondContact O-N 3.49Å; L102-T106 VanDerWaalsContact O-N 3.1Å; L102-T106 PolarHBondContact O-OG1 3.31Å; A103-T106 PolarHBondContact O-N 3.32Å; T106-A110 HydrophobicContact CG2-CB 3.85Å
107	P	98.3	Very high	97.7	Very high	53 Å²	53	26.3 Å²	26.3	34%	0.344	14%	0.143	S	C	.	.			trans	-55.6	142	173	-25.5	33.1	0	0	0	112	A109 A110 Y111	P107-A109 PolarHBondContact O-N 3.13Å; P107-A110 HydrophobicContact CB-CB 4.17Å; P107-A110 HydrophobicContact CG-CB 4.44Å; P107-A110 CarbonylContact O-C 3.59Å; P107-A110 WeakPolarHBondContact O-CA 3.4Å; P107-A110 WeakPolarHBondContact O-CB 3.29Å; P107-A110 PolarHBondContact O-N 3.02Å; P107-Y111 PolarHBondContact O-N 2.79Å
108	P	97.5	Very high	97.7	Very high	81 Å²	81	30.7 Å²	30.7	53%	0.526	16%	0.163	S	C	.	.	H	α-helix	trans	-55.7	-43.8	-171.2	-28.8	35.3	0	0	0	114.7	N67 A110 Y111 D112	N67-P108 WeakPolarHBondContact OD1-CD 3.44Å; P108-A110 VanDerWaalsContact C-N 3.33Å; P108-A110 PolarHBondContact O-N 3.45Å; P108-Y111 PolarHBondContact O-N 3.49Å; P108-D112 PolarHBondContact O-N 2.97Å
109	A	98.1	Very high	97.6	Very high	22 Å²	22	28.8 Å²	28.8	18%	0.182	16%	0.155	C	C	.	.	H	α-helix	trans	-67.5	-33.3	177.9	0	0	0	0	0	112.9	P107 C113 A144 V148	P107-A109 PolarHBondContact O-N 3.13Å; A109-C113 VanDerWaalsContact O-CB 3.27Å; A109-C113 WeakPolarHBondContact O-CB 3.32Å; A109-C113 PolarHBondContact O-N 3.18Å; A109-A144 HydrophobicContact CB-CB 3.72Å; A109-V148 HydrophobicContact CB-CG2 3.99Å
110	A	98.4	Very high	97.5	Very high	9 Å²	9	23.3 Å²	23.3	7%	0.074	13%	0.131	C	C	.	.	H	α-helix	trans	-71.4	-38.9	173.7	0	0	0	0	0	111.2	T106 P107 P108 C113 H114 V148	T106-A110 HydrophobicContact CG2-CB 3.85Å; P107-A110 HydrophobicContact CB-CB 4.17Å; P107-A110 HydrophobicContact CG-CB 4.44Å; P107-A110 CarbonylContact O-C 3.59Å; P107-A110 WeakPolarHBondContact O-CA 3.4Å; P107-A110 WeakPolarHBondContact O-CB 3.29Å; P107-A110 PolarHBondContact O-N 3.02Å; P108-A110 VanDerWaalsContact C-N 3.33Å; P108-A110 PolarHBondContact O-N 3.45Å; A110-C113 WeakPolarHBondContact O-CB 3.43Å; A110-C113 PolarHBondContact O-N 3.06Å; A110-H114 WeakPolarHBondContact O-CB 3.27Å; A110-H114 PolarHBondContact O-CD2 3.04Å; A110-H114 PolarHBondContact O-N 2.98Å; A110-H114 PolarHBondContact O-ND1 3.43Å; A110-V148 HydrophobicContact CB-CG1 4.01Å
111	Y	98.4	Very high	97.2	Very high	19 Å²	19	30.3 Å²	30.3	8%	0.075	16%	0.162	C	C	.	.	H	α-helix	trans	-63.6	-47.2	176.7	-172.9	-122.3	0	0	0	111.7	A103 P107 P108 C113 H114 E115 R293 V296	A103-Y111 HydrophobicContact CB-CD2 4.09Å; A103-Y111 HydrophobicContact CB-CE1 4.3Å; A103-Y111 HydrophobicContact CB-CE2 3.47Å; A103-Y111 VanDerWaalsContact CB-CE2 3.47Å; P107-Y111 PolarHBondContact O-N 2.79Å; P108-Y111 PolarHBondContact O-N 3.49Å; Y111-C113 VanDerWaalsContact C-N 3.31Å; Y111-C113 PolarHBondContact O-N 3.4Å; Y111-H114 PolarHBondContact O-N 3.23Å; Y111-E115 HydrophobicContact CE1-CG 4.34Å; Y111-E115 HydrophobicContact CE2-CG 4.14Å; Y111-E115 WeakPolarHBondContact O-CG 3.5Å; Y111-E115 PolarHBondContact O-N 3.18Å; Y111-R293 HydrophobicContact CE1-CB 4.47Å; Y111-R293 HydrophobicContact CE1-CG 4.21Å; Y111-R293 WeakPolarHBondContact OH-CA 3.47Å; Y111-V296 HydrophobicContact CE1-CB 4.46Å; Y111-V296 HydrophobicContact CE1-CG1 4.41Å
112	D	98.3	Very high	96.7	Very high	8 Å²	8	33.2 Å²	33.2	4%	0.043	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-40.6	173.2	-77.2	-17.4	0	0	0	111.6	P108 H114 E115 V116 R137 L145	P108-D112 PolarHBondContact O-N 2.97Å; D112-H114 PolarHBondContact O-N 3.39Å; D112-E115 PolarHBondContact O-N 3.5Å; D112-V116 WeakPolarHBondContact O-CB 3.38Å; D112-V116 WeakPolarHBondContact O-CG2 3.29Å; D112-V116 PolarHBondContact O-N 3.03Å; D112-R137 IonicContact OD1-CZ 3.33Å; D112-R137 IonicContact OD1-NE 3.82Å; D112-R137 PolarHBondContact OD1-NE 2.87Å; D112-R137 IonicContact OD1-NH2 3.13Å; D112-R137 PolarHBondContact OD1-NH2 3.43Å; D112-R137 IonicContact OD2-CZ 2.75Å; D112-R137 IonicContact OD2-NE 2.75Å; D112-R137 PolarHBondContact OD2-NE 3.37Å; D112-R137 IonicContact OD2-NH2 3.03Å; D112-L145 HydrophobicContact CB-CD1 3.71Å; D112-L145 HydrophobicContact CB-CG 4.07Å
113	C	98.3	Very high	95.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.9	-44.8	175	173.7	0	0	0	0	111.9	A109 A110 Y111 T117 L145 V148 Y149	A109-C113 VanDerWaalsContact O-CB 3.27Å; A109-C113 WeakPolarHBondContact O-CB 3.32Å; A109-C113 PolarHBondContact O-N 3.18Å; A110-C113 WeakPolarHBondContact O-CB 3.43Å; A110-C113 PolarHBondContact O-N 3.06Å; Y111-C113 VanDerWaalsContact C-N 3.31Å; Y111-C113 PolarHBondContact O-N 3.4Å; C113-T117 VanDerWaalsContact O-CB 3.29Å; C113-T117 WeakPolarHBondContact O-CB 3.42Å; C113-T117 PolarHBondContact O-N 3.22Å; C113-T117 PolarHBondContact O-OG1 3.23Å; C113-L145 HydrophobicContact CB-CD2 4.42Å; C113-L145 HydrophobicContact CB-CG 4.43Å; C113-V148 HydrophobicContact CB-CB 4.28Å; C113-V148 HydrophobicContact CB-CG1 3.96Å; C113-Y149 WeakPolarHBondContact SG-CA 3.36Å
114	H	97.8	Very high	95.1	Very high	66 Å²	66	40.2 Å²	40.2	31%	0.306	26%	0.258	S	S	.	.	H	α-helix	trans	-66.6	-43.8	179.9	-62.9	168.7	0	0	0	111	A110 Y111 D112 T117 Q118 E152	A110-H114 WeakPolarHBondContact O-CB 3.27Å; A110-H114 PolarHBondContact O-CD2 3.04Å; A110-H114 PolarHBondContact O-N 2.98Å; A110-H114 PolarHBondContact O-ND1 3.43Å; Y111-H114 PolarHBondContact O-N 3.23Å; D112-H114 PolarHBondContact O-N 3.39Å; H114-T117 PolarHBondContact O-N 3.5Å; H114-Q118 WeakPolarHBondContact O-CG 3.24Å; H114-Q118 PolarHBondContact O-N 3.37Å; H114-E152 IonicContact CD2-OE2 3.91Å; H114-E152 PolarHBondContact CD2-OE2 3.27Å; H114-E152 VanDerWaalsContact CD2-OE2 3.25Å; H114-E152 IonicContact NE2-OE1 3.81Å; H114-E152 PolarHBondContact NE2-OE1 3.44Å; H114-E152 IonicContact NE2-OE2 3.95Å; H114-E152 PolarHBondContact NE2-OE2 2.86Å
115	E	97.9	Very high	94.6	Very high	31 Å²	31	41.8 Å²	41.8	15%	0.145	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-46.5	175.9	-71.5	-66.6	120.4	0	0	111.6	Y111 D112 T117 Q118 A119 V129 I133 R293	Y111-E115 HydrophobicContact CE1-CG 4.34Å; Y111-E115 HydrophobicContact CE2-CG 4.14Å; Y111-E115 WeakPolarHBondContact O-CG 3.5Å; Y111-E115 PolarHBondContact O-N 3.18Å; D112-E115 PolarHBondContact O-N 3.5Å; E115-T117 VanDerWaalsContact C-N 3.34Å; E115-T117 PolarHBondContact O-N 3.26Å; E115-Q118 PolarHBondContact O-N 2.89Å; E115-A119 VanDerWaalsContact O-CB 3.32Å; E115-A119 WeakPolarHBondContact O-CB 3.24Å; E115-A119 PolarHBondContact O-N 3.29Å; E115-V129 HydrophobicContact CB-CG1 4.3Å; E115-I133 HydrophobicContact CB-CD1 3.81Å; E115-R293 HydrophobicContact CG-CG 4.26Å; E115-R293 WeakPolarHBondContact OE2-CD 3.24Å; E115-R293 IonicContact OE2-CZ 2.68Å; E115-R293 IonicContact OE2-NH1 3.65Å; E115-R293 PolarHBondContact OE2-NH1 3.13Å
116	V	97.4	Very high	94.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-43.1	175.3	168.4	0	0	0	0	111.2	D112 A119 M120 L130 I133 F134 L145 L157	D112-V116 WeakPolarHBondContact O-CB 3.38Å; D112-V116 WeakPolarHBondContact O-CG2 3.29Å; D112-V116 PolarHBondContact O-N 3.03Å; V116-A119 PolarHBondContact O-N 2.91Å; V116-M120 HydrophobicContact CG1-CE 3.65Å; V116-M120 HydrophobicContact CG1-SD 4.29Å; V116-M120 WeakPolarHBondContact O-CG 3.41Å; V116-M120 PolarHBondContact O-N 2.88Å; V116-M120 VanDerWaalsContact O-N 3.12Å; V116-L130 HydrophobicContact CB-CD2 4.45Å; V116-L130 HydrophobicContact CG1-CD2 4.05Å; V116-L130 HydrophobicContact CG2-CD2 4.33Å; V116-I133 HydrophobicContact CG2-CB 4.45Å; V116-I133 HydrophobicContact CG2-CD1 3.65Å; V116-I133 HydrophobicContact CG2-CG2 4.07Å; V116-F134 HydrophobicContact CG1-CE2 4.34Å; V116-F134 HydrophobicContact CG1-CZ 4.29Å; V116-F134 HydrophobicContact CG2-CE2 4.07Å; V116-F134 HydrophobicContact CG2-CZ 4.11Å; V116-L145 HydrophobicContact CG2-CD1 4.14Å; V116-L157 HydrophobicContact CG1-CD1 3.82Å
117	T	96.4	Very high	94.1	Very high	39 Å²	39	47.8 Å²	47.8	24%	0.239	29%	0.293	C	S	.	.	H	α-helix	trans	-63.7	-42.8	178.3	-59.5	0	0	0	0	111.7	C113 H114 E115 M120 K121 Y149	C113-T117 VanDerWaalsContact O-CB 3.29Å; C113-T117 WeakPolarHBondContact O-CB 3.42Å; C113-T117 PolarHBondContact O-N 3.22Å; C113-T117 PolarHBondContact O-OG1 3.23Å; H114-T117 PolarHBondContact O-N 3.5Å; E115-T117 VanDerWaalsContact C-N 3.34Å; E115-T117 PolarHBondContact O-N 3.26Å; T117-M120 PolarHBondContact O-N 3.41Å; T117-K121 WeakPolarHBondContact O-CB 3.37Å; T117-K121 PolarHBondContact O-N 2.76Å; T117-Y149 WeakPolarHBondContact OG1-CE2 3.31Å
118	Q	95	Very high	93.9	Very high	99 Å²	99	48.7 Å²	48.7	46%	0.463	30%	0.301	S	S	.	.	H	α-helix	trans	-68.2	-36.1	175.7	-67.9	-43.1	-57.5	0	0	112.1	H114 E115 M120 K121	H114-Q118 WeakPolarHBondContact O-CG 3.24Å; H114-Q118 PolarHBondContact O-N 3.37Å; E115-Q118 PolarHBondContact O-N 2.89Å; Q118-M120 PolarHBondContact O-N 3.27Å; Q118-K121 PolarHBondContact O-N 3.36Å; Q118-K121 VanDerWaalsContact O-N 3.13Å
119	A	95.4	Very high	93.8	Very high	3 Å²	3	45.2 Å²	45.2	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-29.5	176.5	0	0	0	0	0	112.6	E115 V116 T125 K126 V129 L130	E115-A119 VanDerWaalsContact O-CB 3.32Å; E115-A119 WeakPolarHBondContact O-CB 3.24Å; E115-A119 PolarHBondContact O-N 3.29Å; V116-A119 PolarHBondContact O-N 2.91Å; A119-T125 WeakPolarHBondContact O-CA 3.29Å; A119-T125 WeakPolarHBondContact O-CG2 3.39Å; A119-K126 HydrophobicContact CB-CB 4.01Å; A119-K126 PolarHBondContact O-N 3.45Å; A119-V129 HydrophobicContact CB-CB 3.95Å; A119-V129 HydrophobicContact CB-CG1 4.04Å; A119-L130 HydrophobicContact CB-CD2 3.83Å; A119-L130 HydrophobicContact CB-CG 4.17Å
120	M	94.7	Very high	93.7	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.025	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	7.5	176.4	-67.2	-174.3	-55.1	0	0	114.1	V116 T117 Q118 L130 Y149 L157 K160 L161 E164	V116-M120 HydrophobicContact CG1-CE 3.65Å; V116-M120 HydrophobicContact CG1-SD 4.29Å; V116-M120 WeakPolarHBondContact O-CG 3.41Å; V116-M120 PolarHBondContact O-N 2.88Å; V116-M120 VanDerWaalsContact O-N 3.12Å; T117-M120 PolarHBondContact O-N 3.41Å; Q118-M120 PolarHBondContact O-N 3.27Å; M120-L130 HydrophobicContact CG-CD1 4.48Å; M120-L130 HydrophobicContact CG-CD2 4.36Å; M120-Y149 HydrophobicContact CE-CE2 4.01Å; M120-L157 HydrophobicContact CE-CD1 3.97Å; M120-K160 HydrophobicContact CE-CG 3.7Å; M120-K160 HydrophobicContact SD-CG 3.73Å; M120-L161 HydrophobicContact CG-CD2 4.46Å; M120-L161 HydrophobicContact SD-CD2 3.54Å; M120-L161 VanDerWaalsContact SD-CD2 3.54Å; M120-L161 HydrophobicContact SD-CG 3.97Å; M120-E164 HydrophobicContact CB-CG 4.03Å; M120-E164 HydrophobicContact CG-CB 4.4Å; M120-E164 HydrophobicContact CG-CG 4.07Å; M120-E164 HydrophobicContact SD-CG 4.11Å
121	K	91	Very high	93.6	Very high	147 Å²	147	44 Å²	44	64%	0.639	27%	0.267	S	S	*	.	S	Bend	trans	-103	128.5	-174.3	-172.1	-177.2	178.3	-173.9	0	111.3	T117 Q118	T117-K121 WeakPolarHBondContact O-CB 3.37Å; T117-K121 PolarHBondContact O-N 2.76Å; Q118-K121 PolarHBondContact O-N 3.36Å; Q118-K121 VanDerWaalsContact O-N 3.13Å
122	G	86.4	Confident	93.4	Very high	62 Å²	62	43.3 Å²	43.3	64%	0.639	27%	0.265	S	S	*	.	S	Bend	trans	106.1	-158.9	172.4	0	0	0	0	0	112.2
123	A	79.9	Confident	93.3	Very high	114 Å²	114	42.9 Å²	42.9	94%	0.942	26%	0.263	S	S	*	.	S	Bend	trans	-85.3	117	173.9	0	0	0	0	0	109.2
124	G	83.1	Confident	93.2	Very high	56 Å²	56	43.1 Å²	43.1	58%	0.577	26%	0.263	S	S	*	.	S	Bend	trans	86.4	175.2	-174.5	0	0	0	0	0	113
125	T	88.4	Confident	92.9	Very high	34 Å²	34	40.7 Å²	40.7	21%	0.209	26%	0.255	C	S	.	.			trans	-126	140.2	-175	-53.5	0	0	0	0	109.3	A119 D127 L130 E164 V165	A119-T125 WeakPolarHBondContact O-CA 3.29Å; A119-T125 WeakPolarHBondContact O-CG2 3.39Å; T125-D127 VanDerWaalsContact C-N 3.3Å; T125-D127 WeakPolarHBondContact CB-OD1 3.49Å; T125-D127 WeakPolarHBondContact CG2-OD1 3.5Å; T125-D127 PolarHBondContact O-N 3.13Å; T125-D127 VanDerWaalsContact O-N 3.14Å; T125-L130 HydrophobicContact CG2-CD1 3.41Å; T125-L130 VanDerWaalsContact CG2-CD1 3.41Å; T125-L130 HydrophobicContact CG2-CG 4.38Å; T125-E164 PolarHBondContact OG1-O 2.58Å; T125-V165 HydrophobicContact CG2-CG1 4.19Å
126	K	92.6	Very high	92.6	Very high	123 Å²	123	39.7 Å²	39.7	54%	0.535	25%	0.251	S	S	.	.			trans	-84.8	76.4	171.2	-63.4	-174.1	179	-175.8	0	109.7	A119 S128 V129 L130	A119-K126 HydrophobicContact CB-CB 4.01Å; A119-K126 PolarHBondContact O-N 3.45Å; K126-S128 PolarHBondContact O-N 3.36Å; K126-V129 HydrophobicContact CB-CB 4.48Å; K126-V129 HydrophobicContact CB-CG2 4.11Å; K126-V129 PolarHBondContact O-N 2.94Å; K126-V129 VanDerWaalsContact O-N 3.07Å; K126-L130 PolarHBondContact O-N 3.05Å
127	D	93.1	Very high	92.4	Very high	33 Å²	33	40.5 Å²	40.5	18%	0.176	25%	0.254	C	S	.	.	H	α-helix	trans	-59.2	-33.5	-172.1	-65.6	-34.9	0	0	0	113	T125 V129 L130 I131 F169 E253	T125-D127 VanDerWaalsContact C-N 3.3Å; T125-D127 WeakPolarHBondContact CB-OD1 3.49Å; T125-D127 WeakPolarHBondContact CG2-OD1 3.5Å; T125-D127 PolarHBondContact O-N 3.13Å; T125-D127 VanDerWaalsContact O-N 3.14Å; D127-V129 VanDerWaalsContact C-N 3.29Å; D127-V129 PolarHBondContact O-N 3.05Å; D127-L130 PolarHBondContact O-N 3.37Å; D127-L130 VanDerWaalsContact O-N 3.11Å; D127-I131 WeakPolarHBondContact O-CB 3.48Å; D127-I131 VanDerWaalsContact O-CG1 3.23Å; D127-I131 WeakPolarHBondContact O-CG1 3.32Å; D127-I131 PolarHBondContact O-N 2.8Å; D127-F169 HydrophobicContact CB-CE1 4.06Å; D127-F169 HydrophobicContact CB-CZ 3.84Å; D127-F169 WeakPolarHBondContact OD1-CE1 3.09Å; D127-E253 HydrophobicContact CB-CG 4.05Å
128	S	93.8	Very high	92.1	Very high	71 Å²	71	40.8 Å²	40.8	50%	0.497	26%	0.258	S	S	.	.	H	α-helix	trans	-57.8	-37.2	175.7	59.1	0	0	0	0	113.8	K126 E132	K126-S128 PolarHBondContact O-N 3.36Å; S128-E132 WeakPolarHBondContact O-CB 3.4Å; S128-E132 PolarHBondContact O-N 3.11Å
129	V	95.9	Very high	91.9	Very high	8 Å²	8	41.7 Å²	41.7	5%	0.048	26%	0.261	C	S	.	.	H	α-helix	trans	-70.5	-41.2	176.9	179.6	0	0	0	0	110.4	E115 A119 K126 D127 E132 I133	E115-V129 HydrophobicContact CB-CG1 4.3Å; A119-V129 HydrophobicContact CB-CB 3.95Å; A119-V129 HydrophobicContact CB-CG1 4.04Å; K126-V129 HydrophobicContact CB-CB 4.48Å; K126-V129 HydrophobicContact CB-CG2 4.11Å; K126-V129 PolarHBondContact O-N 2.94Å; K126-V129 VanDerWaalsContact O-N 3.07Å; D127-V129 VanDerWaalsContact C-N 3.29Å; D127-V129 PolarHBondContact O-N 3.05Å; V129-E132 PolarHBondContact O-N 3.03Å; V129-I133 HydrophobicContact CG1-CD1 3.91Å; V129-I133 WeakPolarHBondContact O-CG1 3.43Å; V129-I133 PolarHBondContact O-N 2.88Å
130	L	96.4	Very high	91.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.5	-43	176.6	-58	-177.7	0	0	0	110.8	V116 A119 M120 T125 K126 D127 F134 L161 V165 L173	V116-L130 HydrophobicContact CB-CD2 4.45Å; V116-L130 HydrophobicContact CG1-CD2 4.05Å; V116-L130 HydrophobicContact CG2-CD2 4.33Å; A119-L130 HydrophobicContact CB-CD2 3.83Å; A119-L130 HydrophobicContact CB-CG 4.17Å; M120-L130 HydrophobicContact CG-CD1 4.48Å; M120-L130 HydrophobicContact CG-CD2 4.36Å; T125-L130 HydrophobicContact CG2-CD1 3.41Å; T125-L130 VanDerWaalsContact CG2-CD1 3.41Å; T125-L130 HydrophobicContact CG2-CG 4.38Å; K126-L130 PolarHBondContact O-N 3.05Å; D127-L130 PolarHBondContact O-N 3.37Å; D127-L130 VanDerWaalsContact O-N 3.11Å; L130-F134 HydrophobicContact CB-CD2 4.34Å; L130-F134 HydrophobicContact CD2-CE2 4.2Å; L130-F134 WeakPolarHBondContact O-CB 3.37Å; L130-F134 VanDerWaalsContact O-CD2 3.24Å; L130-F134 WeakPolarHBondContact O-CD2 3.24Å; L130-F134 PolarHBondContact O-N 3.26Å; L130-L161 HydrophobicContact CD1-CD2 4.18Å; L130-L161 HydrophobicContact CD2-CD2 4.31Å; L130-V165 HydrophobicContact CD1-CG1 4.25Å; L130-L173 HydrophobicContact CB-CD1 4.13Å; L130-L173 HydrophobicContact CB-CD2 4.03Å; L130-L173 HydrophobicContact CD1-CD2 3.9Å
131	I	95.5	Very high	91.9	Very high	6 Å²	6	50.8 Å²	50.8	3%	0.031	30%	0.302	C	S	.	.	H	α-helix	trans	-59.3	-51.9	175.1	-68.6	166.1	0	0	0	110.1	D127 I133 A135 F169 E256 L257 A260	D127-I131 WeakPolarHBondContact O-CB 3.48Å; D127-I131 VanDerWaalsContact O-CG1 3.23Å; D127-I131 WeakPolarHBondContact O-CG1 3.32Å; D127-I131 PolarHBondContact O-N 2.8Å; I131-I133 PolarHBondContact O-N 3.44Å; I131-A135 WeakPolarHBondContact O-CB 3.5Å; I131-A135 PolarHBondContact O-N 2.71Å; I131-F169 HydrophobicContact CD1-CE2 4.01Å; I131-F169 HydrophobicContact CD1-CZ 4.45Å; I131-F169 HydrophobicContact CG1-CE2 3.78Å; I131-F169 HydrophobicContact CG1-CZ 4.2Å; I131-E256 HydrophobicContact CD1-CB 3.91Å; I131-L257 HydrophobicContact CB-CD1 4.23Å; I131-L257 HydrophobicContact CD1-CB 4.29Å; I131-L257 HydrophobicContact CG1-CB 4.01Å; I131-L257 HydrophobicContact CG1-CD1 3.95Å; I131-L257 HydrophobicContact CG2-CD1 4.01Å; I131-A260 HydrophobicContact CG2-CB 3.68Å
132	E	95.3	Very high	92.2	Very high	4 Å²	4	44 Å²	44	2%	0.019	27%	0.273	C	S	.	.	H	α-helix	trans	-55.7	-49.9	-179.9	-176.4	-165.8	126.7	0	0	111.6	S128 V129 S136 Y272 F273 L276 R293	S128-E132 WeakPolarHBondContact O-CB 3.4Å; S128-E132 PolarHBondContact O-N 3.11Å; V129-E132 PolarHBondContact O-N 3.03Å; E132-S136 WeakPolarHBondContact O-CB 3.32Å; E132-S136 PolarHBondContact O-N 2.86Å; E132-S136 PolarHBondContact O-OG 3.38Å; E132-Y272 WeakPolarHBondContact CA-OH 3.34Å; E132-Y272 HydrophobicContact CG-CE1 4.46Å; E132-F273 HydrophobicContact CG-CE1 3.93Å; E132-L276 HydrophobicContact CB-CD1 4.38Å; E132-L276 HydrophobicContact CG-CD1 3.74Å; E132-R293 VanDerWaalsContact CD-NE 3.29Å; E132-R293 IonicContact OE1-CZ 2.93Å; E132-R293 IonicContact OE1-NE 2.66Å; E132-R293 PolarHBondContact OE1-NE 3.05Å; E132-R293 IonicContact OE2-CZ 2.94Å; E132-R293 IonicContact OE2-NE 3.76Å; E132-R293 PolarHBondContact OE2-NE 3.3Å; E132-R293 VanDerWaalsContact OE2-NE 3.08Å; E132-R293 IonicContact OE2-NH2 2.71Å; E132-R293 PolarHBondContact OE2-NH2 2.6Å
133	I	96	Very high	92.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-68.4	-57.4	-176.8	-66.8	174.3	0	0	0	110.1	E115 V116 V129 I131 A135 S136 R137 L145	E115-I133 HydrophobicContact CB-CD1 3.81Å; V116-I133 HydrophobicContact CG2-CB 4.45Å; V116-I133 HydrophobicContact CG2-CD1 3.65Å; V116-I133 HydrophobicContact CG2-CG2 4.07Å; V129-I133 HydrophobicContact CG1-CD1 3.91Å; V129-I133 WeakPolarHBondContact O-CG1 3.43Å; V129-I133 PolarHBondContact O-N 2.88Å; I131-I133 PolarHBondContact O-N 3.44Å; I133-A135 VanDerWaalsContact C-N 3.32Å; I133-A135 PolarHBondContact O-N 3.31Å; I133-S136 PolarHBondContact O-N 3.47Å; I133-S136 PolarHBondContact O-OG 3.24Å; I133-R137 HydrophobicContact CG2-CG 3.92Å; I133-R137 WeakPolarHBondContact O-CB 3.4Å; I133-R137 VanDerWaalsContact O-CG 3.22Å; I133-R137 WeakPolarHBondContact O-CG 3.48Å; I133-R137 PolarHBondContact O-N 2.75Å; I133-L145 HydrophobicContact CG2-CD1 3.97Å
134	F	95	Very high	93.5	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.018	23%	0.227	C	C	.	.	H	α-helix	trans	-73.3	-21.2	-172.1	-67.7	-66	0	0	0	113.9	V116 L130 I142 L157 L161 L173 L176 A177	V116-F134 HydrophobicContact CG1-CE2 4.34Å; V116-F134 HydrophobicContact CG1-CZ 4.29Å; V116-F134 HydrophobicContact CG2-CE2 4.07Å; V116-F134 HydrophobicContact CG2-CZ 4.11Å; L130-F134 HydrophobicContact CB-CD2 4.34Å; L130-F134 HydrophobicContact CD2-CE2 4.2Å; L130-F134 WeakPolarHBondContact O-CB 3.37Å; L130-F134 VanDerWaalsContact O-CD2 3.24Å; L130-F134 WeakPolarHBondContact O-CD2 3.24Å; L130-F134 PolarHBondContact O-N 3.26Å; F134-I142 HydrophobicContact CD1-CD1 4.06Å; F134-L157 HydrophobicContact CE1-CD2 4.49Å; F134-L157 HydrophobicContact CZ-CD2 4.18Å; F134-L161 HydrophobicContact CE2-CD1 3.94Å; F134-L161 HydrophobicContact CE2-CD2 4.16Å; F134-L161 HydrophobicContact CZ-CD1 3.76Å; F134-L173 HydrophobicContact CB-CD1 4Å; F134-L173 HydrophobicContact CD2-CD1 3.78Å; F134-L173 HydrophobicContact CD2-CG 4.18Å; F134-L173 HydrophobicContact CG-CD1 4.24Å; F134-L176 HydrophobicContact CB-CB 3.96Å; F134-L176 HydrophobicContact CB-CD1 4.48Å; F134-A177 HydrophobicContact CD1-CB 3.68Å; F134-A177 HydrophobicContact CE1-CB 3.5Å; F134-A177 HydrophobicContact CG-CB 4.31Å; F134-A177 HydrophobicContact CZ-CB 4.01Å
135	A	91.8	Very high	94.2	Very high	15 Å²	15	38 Å²	38	12%	0.124	20%	0.2	C	C	.	.	H	α-helix	trans	-78.7	-29	172.4	0	0	0	0	0	113.3	I131 I133 A260 V261	I131-A135 WeakPolarHBondContact O-CB 3.5Å; I131-A135 PolarHBondContact O-N 2.71Å; I133-A135 VanDerWaalsContact C-N 3.32Å; I133-A135 PolarHBondContact O-N 3.31Å; A135-A260 HydrophobicContact CB-CB 4.16Å; A135-V261 HydrophobicContact CB-CG2 3.54Å
136	S	91.8	Very high	94.7	Very high	10 Å²	10	38.1 Å²	38.1	7%	0.07	20%	0.198	C	C	.	.	H	α-helix	trans	-101.4	-27.4	-170.8	66.9	0	0	0	0	115.3	E132 I133	E132-S136 WeakPolarHBondContact O-CB 3.32Å; E132-S136 PolarHBondContact O-N 2.86Å; E132-S136 PolarHBondContact O-OG 3.38Å; I133-S136 PolarHBondContact O-N 3.47Å; I133-S136 PolarHBondContact O-OG 3.24Å
137	R	92.7	Very high	95	Very high	17 Å²	17	37.4 Å²	37.4	6%	0.064	20%	0.2	C	C	.	.			trans	-76.4	140.9	-173.7	-66	-46.1	-179.3	-109.1	2.1	111.9	D112 I133 Q141 I142 S297	D112-R137 IonicContact OD1-CZ 3.33Å; D112-R137 IonicContact OD1-NE 3.82Å; D112-R137 PolarHBondContact OD1-NE 2.87Å; D112-R137 IonicContact OD1-NH2 3.13Å; D112-R137 PolarHBondContact OD1-NH2 3.43Å; D112-R137 IonicContact OD2-CZ 2.75Å; D112-R137 IonicContact OD2-NE 2.75Å; D112-R137 PolarHBondContact OD2-NE 3.37Å; D112-R137 IonicContact OD2-NH2 3.03Å; I133-R137 HydrophobicContact CG2-CG 3.92Å; I133-R137 WeakPolarHBondContact O-CB 3.4Å; I133-R137 VanDerWaalsContact O-CG 3.22Å; I133-R137 WeakPolarHBondContact O-CG 3.48Å; I133-R137 PolarHBondContact O-N 2.75Å; R137-Q141 HydrophobicContact CB-CB 3.94Å; R137-Q141 HydrophobicContact CG-CB 4.35Å; R137-I142 HydrophobicContact CB-CD1 4.36Å; R137-I142 HydrophobicContact CB-CG1 3.79Å; R137-S297 PolarHBondContact NH2-OG 3.37Å
138	S	90.6	Very high	95.2	Very high	46 Å²	46	37.3 Å²	37.3	32%	0.322	20%	0.2	S	C	.	.			trans	-67.3	163.8	171	62.9	0	0	0	0	111.5	Q140 Q141 I142	S138-Q140 VanDerWaalsContact C-N 3.27Å; S138-Q140 PolarHBondContact O-N 2.84Å; S138-Q141 PolarHBondContact O-N 3.16Å; S138-Q141 VanDerWaalsContact O-N 3.15Å; S138-Q141 VanDerWaalsContact OG-CG 3.32Å; S138-Q141 WeakPolarHBondContact OG-CG 3.29Å; S138-Q141 PolarHBondContact OG-N 3.31Å; S138-Q141 PolarHBondContact OG-OE1 3.21Å; S138-I142 PolarHBondContact O-N 2.84Å
139	K	91.6	Very high	95.5	Very high	118 Å²	118	34.3 Å²	34.3	51%	0.513	18%	0.178	S	C	.	.	H	α-helix	trans	-52.5	-46.1	173.8	178.6	172.5	-174.1	173	0	112	Q141 I142 E143 G179	K139-Q141 VanDerWaalsContact C-N 3.35Å; K139-Q141 PolarHBondContact O-N 3.44Å; K139-I142 PolarHBondContact O-N 3.03Å; K139-E143 WeakPolarHBondContact O-CG 3.33Å; K139-E143 PolarHBondContact O-N 3.39Å; K139-G179 VanDerWaalsContact CD-O 3.26Å; K139-G179 WeakPolarHBondContact CD-O 3.5Å; K139-G179 WeakPolarHBondContact CE-O 3.26Å; K139-G179 WeakPolarHBondContact CG-O 3.15Å
140	Q	93.4	Very high	95.6	Very high	141 Å²	141	40.9 Å²	40.9	66%	0.659	20%	0.202	S	C	*	.	H	α-helix	trans	-63.4	-40.2	-179.4	-64.7	83	-9.6	0	0	112	S138 A144	S138-Q140 VanDerWaalsContact C-N 3.27Å; S138-Q140 PolarHBondContact O-N 2.84Å; Q140-A144 WeakPolarHBondContact O-CB 3.35Å; Q140-A144 PolarHBondContact O-N 3.09Å
141	Q	95.6	Very high	95.6	Very high	58 Å²	58	49.6 Å²	49.6	27%	0.271	24%	0.24	S	C	.	.	H	α-helix	trans	-66.2	-41.5	175.8	-74.2	166.3	-46.4	0	0	111.6	R137 S138 K139 A144 L145	R137-Q141 HydrophobicContact CB-CB 3.94Å; R137-Q141 HydrophobicContact CG-CB 4.35Å; S138-Q141 PolarHBondContact O-N 3.16Å; S138-Q141 VanDerWaalsContact O-N 3.15Å; S138-Q141 VanDerWaalsContact OG-CG 3.32Å; S138-Q141 WeakPolarHBondContact OG-CG 3.29Å; S138-Q141 PolarHBondContact OG-N 3.31Å; S138-Q141 PolarHBondContact OG-OE1 3.21Å; K139-Q141 VanDerWaalsContact C-N 3.35Å; K139-Q141 PolarHBondContact O-N 3.44Å; Q141-A144 PolarHBondContact O-N 3.32Å; Q141-L145 WeakPolarHBondContact O-CB 3.31Å; Q141-L145 PolarHBondContact O-N 3.24Å
142	I	96.6	Very high	95.7	Very high	5 Å²	5	54 Å²	54	3%	0.026	26%	0.26	C	S	.	.	H	α-helix	trans	-65.4	-41.5	176.9	-69.7	-172.7	0	0	0	111.8	F134 R137 S138 K139 L145 K146 L176 A177	F134-I142 HydrophobicContact CD1-CD1 4.06Å; R137-I142 HydrophobicContact CB-CD1 4.36Å; R137-I142 HydrophobicContact CB-CG1 3.79Å; S138-I142 PolarHBondContact O-N 2.84Å; K139-I142 PolarHBondContact O-N 3.03Å; I142-L145 PolarHBondContact O-N 3.16Å; I142-K146 HydrophobicContact CG2-CD 4.48Å; I142-K146 WeakPolarHBondContact O-CG 3.12Å; I142-K146 PolarHBondContact O-N 3.38Å; I142-L176 VanDerWaalsContact CD1-O 3.23Å; I142-L176 WeakPolarHBondContact CD1-O 3.23Å; I142-A177 WeakPolarHBondContact CG2-O 3.32Å
143	E	97.1	Very high	95.7	Very high	67 Å²	67	55.8 Å²	55.8	31%	0.313	27%	0.272	S	S	.	.	H	α-helix	trans	-61.7	-47.5	173.8	-67.5	-52.7	146.5	0	0	111.7	K139 L145 K146 D147	K139-E143 WeakPolarHBondContact O-CG 3.33Å; K139-E143 PolarHBondContact O-N 3.39Å; E143-L145 VanDerWaalsContact C-N 3.3Å; E143-L145 PolarHBondContact O-N 2.87Å; E143-K146 VanDerWaalsContact CD-CE 3.43Å; E143-K146 PolarHBondContact O-N 3.03Å; E143-K146 VanDerWaalsContact O-N 3.16Å; E143-K146 IonicContact OE1-NZ 3.16Å; E143-K146 PolarHBondContact OE1-NZ 2.75Å; E143-K146 WeakPolarHBondContact OE2-CE 3.19Å; E143-K146 IonicContact OE2-NZ 3.25Å; E143-K146 PolarHBondContact OE2-NZ 2.78Å; E143-D147 PolarHBondContact O-N 3.13Å
144	A	97.9	Very high	95.7	Very high	37 Å²	37	64.6 Å²	64.6	31%	0.306	31%	0.313	S	S	.	.	H	α-helix	trans	-61.4	-38.7	178.4	0	0	0	0	0	112.4	A109 Q140 Q141 D147 V148	A109-A144 HydrophobicContact CB-CB 3.72Å; Q140-A144 WeakPolarHBondContact O-CB 3.35Å; Q140-A144 PolarHBondContact O-N 3.09Å; Q141-A144 PolarHBondContact O-N 3.32Å; A144-D147 PolarHBondContact O-N 3.22Å; A144-V148 WeakPolarHBondContact O-CG2 3.37Å; A144-V148 PolarHBondContact O-N 2.89Å
145	L	98.2	Very high	95.8	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-60.9	-49.6	174	-172.2	176.2	0	0	0	110.5	D112 C113 V116 I133 Q141 I142 E143 D147 V148 Y149 L157	D112-L145 HydrophobicContact CB-CD1 3.71Å; D112-L145 HydrophobicContact CB-CG 4.07Å; C113-L145 HydrophobicContact CB-CD2 4.42Å; C113-L145 HydrophobicContact CB-CG 4.43Å; V116-L145 HydrophobicContact CG2-CD1 4.14Å; I133-L145 HydrophobicContact CG2-CD1 3.97Å; Q141-L145 WeakPolarHBondContact O-CB 3.31Å; Q141-L145 PolarHBondContact O-N 3.24Å; I142-L145 PolarHBondContact O-N 3.16Å; E143-L145 VanDerWaalsContact C-N 3.3Å; E143-L145 PolarHBondContact O-N 2.87Å; L145-D147 VanDerWaalsContact C-N 3.31Å; L145-D147 PolarHBondContact O-N 3.3Å; L145-V148 PolarHBondContact O-N 3.39Å; L145-Y149 WeakPolarHBondContact O-CB 3.44Å; L145-Y149 PolarHBondContact O-N 3.36Å; L145-L157 HydrophobicContact CD2-CD2 3.32Å
146	K	98.1	Very high	96	Very high	38 Å²	38	72.1 Å²	72.1	17%	0.165	35%	0.345	C	S	.	.	H	α-helix	trans	-58.7	-41.7	178	-74.9	-177.5	-60	-178.1	0	112.1	I142 E143 Y149 R150 L157 K178	I142-K146 HydrophobicContact CG2-CD 4.48Å; I142-K146 WeakPolarHBondContact O-CG 3.12Å; I142-K146 PolarHBondContact O-N 3.38Å; E143-K146 VanDerWaalsContact CD-CE 3.43Å; E143-K146 PolarHBondContact O-N 3.03Å; E143-K146 VanDerWaalsContact O-N 3.16Å; E143-K146 IonicContact OE1-NZ 3.16Å; E143-K146 PolarHBondContact OE1-NZ 2.75Å; E143-K146 WeakPolarHBondContact OE2-CE 3.19Å; E143-K146 IonicContact OE2-NZ 3.25Å; E143-K146 PolarHBondContact OE2-NZ 2.78Å; K146-Y149 PolarHBondContact O-N 2.92Å; K146-R150 WeakPolarHBondContact O-CB 3.25Å; K146-R150 PolarHBondContact O-N 2.87Å; K146-L157 HydrophobicContact CG-CB 4.38Å; K146-L157 HydrophobicContact CG-CD2 3.87Å; K146-K178 PolarHBondContact NZ-O 3.3Å
147	D	98.3	Very high	96.3	Very high	108 Å²	108	71.8 Å²	71.8	58%	0.578	34%	0.342	S	S	*	.	H	α-helix	trans	-62.5	-45.7	177.6	-75.1	-19.4	0	0	0	111.7	E143 A144 L145 K151	E143-D147 PolarHBondContact O-N 3.13Å; A144-D147 PolarHBondContact O-N 3.22Å; L145-D147 VanDerWaalsContact C-N 3.31Å; L145-D147 PolarHBondContact O-N 3.3Å; D147-K151 WeakPolarHBondContact O-CB 3.48Å; D147-K151 PolarHBondContact O-N 3.43Å
148	V	98.4	Very high	96.5	Very high	30 Å²	30	72.3 Å²	72.3	18%	0.182	35%	0.346	C	S	.	.	H	α-helix	trans	-64.7	-45.3	176.2	177.3	0	0	0	0	110.9	A109 A110 C113 A144 L145 R150 K151 E152	A109-V148 HydrophobicContact CB-CG2 3.99Å; A110-V148 HydrophobicContact CB-CG1 4.01Å; C113-V148 HydrophobicContact CB-CB 4.28Å; C113-V148 HydrophobicContact CB-CG1 3.96Å; A144-V148 WeakPolarHBondContact O-CG2 3.37Å; A144-V148 PolarHBondContact O-N 2.89Å; L145-V148 PolarHBondContact O-N 3.39Å; V148-R150 PolarHBondContact O-N 3.25Å; V148-K151 WeakPolarHBondContact O-CB 3.16Å; V148-K151 PolarHBondContact O-N 3.38Å; V148-K151 VanDerWaalsContact O-N 3.11Å; V148-E152 HydrophobicContact CG1-CG 4.02Å; V148-E152 WeakPolarHBondContact O-CG 3.45Å; V148-E152 PolarHBondContact O-N 3.46Å
149	Y	98.3	Very high	96.7	Very high	8 Å²	8	77 Å²	77	3%	0.031	36%	0.363	C	S	.	.	H	α-helix	trans	-58.1	-46.9	179.2	-174.5	-87.4	0	0	0	112	C113 T117 M120 L145 K146 K151 E152 T153 K155 L157 K160	C113-Y149 WeakPolarHBondContact SG-CA 3.36Å; T117-Y149 WeakPolarHBondContact OG1-CE2 3.31Å; M120-Y149 HydrophobicContact CE-CE2 4.01Å; L145-Y149 WeakPolarHBondContact O-CB 3.44Å; L145-Y149 PolarHBondContact O-N 3.36Å; K146-Y149 PolarHBondContact O-N 2.92Å; Y149-K151 VanDerWaalsContact C-N 3.33Å; Y149-K151 PolarHBondContact O-N 2.92Å; Y149-E152 PolarHBondContact O-N 3.2Å; Y149-T153 WeakPolarHBondContact CD1-OG1 3.45Å; Y149-T153 HydrophobicContact CD2-CG2 4.24Å; Y149-T153 HydrophobicContact CE1-CG2 4.42Å; Y149-T153 VanDerWaalsContact CE1-OG1 3.26Å; Y149-T153 WeakPolarHBondContact CE1-OG1 3.27Å; Y149-T153 HydrophobicContact CE2-CG2 4Å; Y149-T153 WeakPolarHBondContact O-CB 3.22Å; Y149-T153 WeakPolarHBondContact O-CG2 3.42Å; Y149-T153 PolarHBondContact O-N 3.28Å; Y149-T153 PolarHBondContact O-OG1 3.02Å; Y149-K155 WeakPolarHBondContact CD1-O 3.25Å; Y149-K155 HydrophobicContact CE1-CB 4.13Å; Y149-L157 HydrophobicContact CD1-CB 3.62Å; Y149-L157 HydrophobicContact CD1-CD1 4.18Å; Y149-L157 HydrophobicContact CD1-CG 4.46Å; Y149-L157 HydrophobicContact CD2-CD1 3.85Å; Y149-L157 HydrophobicContact CE1-CB 4.05Å; Y149-L157 HydrophobicContact CE1-CD1 4.21Å; Y149-L157 HydrophobicContact CE2-CD1 3.9Å; Y149-L157 HydrophobicContact CG-CB 3.98Å; Y149-L157 HydrophobicContact CG-CD1 4Å; Y149-L157 HydrophobicContact CG-CG 4.43Å; Y149-K160 WeakPolarHBondContact OH-CG 3.4Å
150	R	98.1	Very high	96.9	Very high	147 Å²	147	74 Å²	74	56%	0.555	35%	0.35	S	S	*	.	H	α-helix	trans	-62.7	-40.6	176.4	177.4	174.8	-84.5	-108.6	-0.7	111.6	K146 V148 E154 K155 D156	K146-R150 WeakPolarHBondContact O-CB 3.25Å; K146-R150 PolarHBondContact O-N 2.87Å; V148-R150 PolarHBondContact O-N 3.25Å; R150-E154 VanDerWaalsContact O-CA 3.25Å; R150-E154 WeakPolarHBondContact O-CA 3.43Å; R150-E154 PolarHBondContact O-N 2.71Å; R150-K155 WeakPolarHBondContact CA-O 3.16Å; R150-D156 IonicContact NH2-OD2 3.37Å; R150-D156 PolarHBondContact NH2-OD2 2.97Å; R150-D156 VanDerWaalsContact NH2-OD2 3.16Å
151	K	98.2	Very high	96.9	Very high	183 Å²	183	67.3 Å²	67.3	80%	0.796	32%	0.319	S	S	*	.	H	α-helix	trans	-66.5	-40.3	179.2	-176.5	-176.4	175.7	-171.7	0	112.7	D147 V148 Y149	D147-K151 WeakPolarHBondContact O-CB 3.48Å; D147-K151 PolarHBondContact O-N 3.43Å; V148-K151 WeakPolarHBondContact O-CB 3.16Å; V148-K151 PolarHBondContact O-N 3.38Å; V148-K151 VanDerWaalsContact O-N 3.11Å; Y149-K151 VanDerWaalsContact C-N 3.33Å; Y149-K151 PolarHBondContact O-N 2.92Å
152	E	97	Very high	96.8	Very high	98 Å²	98	68.4 Å²	68.4	46%	0.458	33%	0.329	S	S	.	.	H	α-helix	trans	-84.5	-31.1	-175.3	-69.6	-175.7	170	0	0	113.2	H114 V148 Y149	H114-E152 IonicContact CD2-OE2 3.91Å; H114-E152 PolarHBondContact CD2-OE2 3.27Å; H114-E152 VanDerWaalsContact CD2-OE2 3.25Å; H114-E152 IonicContact NE2-OE1 3.81Å; H114-E152 PolarHBondContact NE2-OE1 3.44Å; H114-E152 IonicContact NE2-OE2 3.95Å; H114-E152 PolarHBondContact NE2-OE2 2.86Å; V148-E152 HydrophobicContact CG1-CG 4.02Å; V148-E152 WeakPolarHBondContact O-CG 3.45Å; V148-E152 PolarHBondContact O-N 3.46Å; Y149-E152 PolarHBondContact O-N 3.2Å
153	T	95.5	Very high	96.6	Very high	42 Å²	42	72.1 Å²	72.1	26%	0.258	36%	0.356	S	S	.	.	H	α-helix	trans	-112.1	-11.7	-171.8	72.3	0	0	0	0	114.4	Y149 K155	Y149-T153 WeakPolarHBondContact CD1-OG1 3.45Å; Y149-T153 HydrophobicContact CD2-CG2 4.24Å; Y149-T153 HydrophobicContact CE1-CG2 4.42Å; Y149-T153 VanDerWaalsContact CE1-OG1 3.26Å; Y149-T153 WeakPolarHBondContact CE1-OG1 3.27Å; Y149-T153 HydrophobicContact CE2-CG2 4Å; Y149-T153 WeakPolarHBondContact O-CB 3.22Å; Y149-T153 WeakPolarHBondContact O-CG2 3.42Å; Y149-T153 PolarHBondContact O-N 3.28Å; Y149-T153 PolarHBondContact O-OG1 3.02Å; T153-K155 PolarHBondContact O-N 3.21Å; T153-K155 VanDerWaalsContact O-N 3.11Å; T153-K155 PolarHBondContact OG1-N 3.16Å
154	E	96.4	Very high	96.4	Very high	184 Å²	184	71.6 Å²	71.6	86%	0.86	35%	0.353	S	S	*	.	S	Bend	trans	57.2	16.2	-170.8	-55.2	-175.5	157.2	0	0	114.2	R150	R150-E154 VanDerWaalsContact O-CA 3.25Å; R150-E154 WeakPolarHBondContact O-CA 3.43Å; R150-E154 PolarHBondContact O-N 2.71Å
155	K	96.2	Very high	96	Very high	131 Å²	131	70.3 Å²	70.3	57%	0.57	34%	0.342	S	S	*	.	S	Bend	trans	-116.3	159.3	-178.9	-67.6	175.7	-174.8	179.8	0	111.6	Y149 R150 T153	Y149-K155 WeakPolarHBondContact CD1-O 3.25Å; Y149-K155 HydrophobicContact CE1-CB 4.13Å; R150-K155 WeakPolarHBondContact CA-O 3.16Å; T153-K155 PolarHBondContact O-N 3.21Å; T153-K155 VanDerWaalsContact O-N 3.11Å; T153-K155 PolarHBondContact OG1-N 3.16Å
156	D	96.9	Very high	95.6	Very high	46 Å²	46	75.1 Å²	75.1	25%	0.246	38%	0.376	C	S	.	.			trans	-83.6	129.5	172.1	-166.8	-87.7	0	0	0	111.1	R150 I158 E159 K160	R150-D156 IonicContact NH2-OD2 3.37Å; R150-D156 PolarHBondContact NH2-OD2 2.97Å; R150-D156 VanDerWaalsContact NH2-OD2 3.16Å; D156-I158 VanDerWaalsContact C-N 3.34Å; D156-I158 WeakPolarHBondContact OD1-CA 3.22Å; D156-I158 VanDerWaalsContact OD1-CB 3.3Å; D156-I158 WeakPolarHBondContact OD1-CB 3.37Å; D156-I158 PolarHBondContact OD1-N 3.16Å; D156-E159 HydrophobicContact CB-CB 4.06Å; D156-E159 HydrophobicContact CB-CG 3.9Å; D156-E159 PolarHBondContact OD1-N 3.28Å; D156-K160 PolarHBondContact O-N 2.81Å
157	L	96.8	Very high	95.3	Very high	4 Å²	4	75.8 Å²	75.8	2%	0.021	39%	0.393	C	S	.	.	H	α-helix	trans	-66.5	-37.3	-178.4	178.5	60.3	0	0	0	112	V116 M120 F134 L145 K146 Y149 K160 L161	V116-L157 HydrophobicContact CG1-CD1 3.82Å; M120-L157 HydrophobicContact CE-CD1 3.97Å; F134-L157 HydrophobicContact CE1-CD2 4.49Å; F134-L157 HydrophobicContact CZ-CD2 4.18Å; L145-L157 HydrophobicContact CD2-CD2 3.32Å; K146-L157 HydrophobicContact CG-CB 4.38Å; K146-L157 HydrophobicContact CG-CD2 3.87Å; Y149-L157 HydrophobicContact CD1-CB 3.62Å; Y149-L157 HydrophobicContact CD1-CD1 4.18Å; Y149-L157 HydrophobicContact CD1-CG 4.46Å; Y149-L157 HydrophobicContact CD2-CD1 3.85Å; Y149-L157 HydrophobicContact CE1-CB 4.05Å; Y149-L157 HydrophobicContact CE1-CD1 4.21Å; Y149-L157 HydrophobicContact CE2-CD1 3.9Å; Y149-L157 HydrophobicContact CG-CB 3.98Å; Y149-L157 HydrophobicContact CG-CD1 4Å; Y149-L157 HydrophobicContact CG-CG 4.43Å; L157-K160 PolarHBondContact O-N 3.49Å; L157-L161 HydrophobicContact CD1-CD1 4.19Å; L157-L161 HydrophobicContact CD1-CG 4.19Å; L157-L161 HydrophobicContact CG-CD1 3.98Å; L157-L161 HydrophobicContact CG-CG 4.44Å; L157-L161 WeakPolarHBondContact O-CB 3.14Å; L157-L161 WeakPolarHBondContact O-CG 3.47Å; L157-L161 PolarHBondContact O-N 2.64Å
158	I	96.4	Very high	94.9	Very high	28 Å²	28	72.6 Å²	72.6	14%	0.144	38%	0.376	C	S	.	.	H	α-helix	trans	-70	-42.1	-177.9	-60.3	-58.1	0	0	0	110	D156 L161 T162 I174 A177 K178	D156-I158 VanDerWaalsContact C-N 3.34Å; D156-I158 WeakPolarHBondContact OD1-CA 3.22Å; D156-I158 VanDerWaalsContact OD1-CB 3.3Å; D156-I158 WeakPolarHBondContact OD1-CB 3.37Å; D156-I158 PolarHBondContact OD1-N 3.16Å; I158-L161 PolarHBondContact O-N 3.13Å; I158-T162 WeakPolarHBondContact O-CB 3.12Å; I158-T162 PolarHBondContact O-N 3.26Å; I158-T162 PolarHBondContact O-OG1 3.09Å; I158-I174 HydrophobicContact CG2-CD1 4.28Å; I158-I174 HydrophobicContact CG2-CG2 3.92Å; I158-A177 HydrophobicContact CD1-CB 3.53Å; I158-K178 HydrophobicContact CD1-CG 4.21Å
159	E	95.8	Very high	94.6	Very high	143 Å²	143	71.8 Å²	71.8	67%	0.668	37%	0.37	S	S	*	.	H	α-helix	trans	-61.8	-43.5	173.5	-65.7	-177.1	171.3	0	0	111.6	D156 T162 S163	D156-E159 HydrophobicContact CB-CB 4.06Å; D156-E159 HydrophobicContact CB-CG 3.9Å; D156-E159 PolarHBondContact OD1-N 3.28Å; E159-T162 WeakPolarHBondContact O-CB 3.23Å; E159-T162 PolarHBondContact O-N 3.09Å; E159-S163 PolarHBondContact O-N 3.3Å; E159-S163 VanDerWaalsContact O-N 3.15Å
160	K	95.2	Very high	94.3	Very high	57 Å²	57	72.1 Å²	72.1	25%	0.248	37%	0.373	C	S	.	.	H	α-helix	trans	-61.6	-49.8	176.3	178.5	63.7	175.3	167.9	0	111.7	M120 Y149 D156 L157 T162 S163 E164	M120-K160 HydrophobicContact CE-CG 3.7Å; M120-K160 HydrophobicContact SD-CG 3.73Å; Y149-K160 WeakPolarHBondContact OH-CG 3.4Å; D156-K160 PolarHBondContact O-N 2.81Å; L157-K160 PolarHBondContact O-N 3.49Å; K160-T162 PolarHBondContact O-N 3.33Å; K160-S163 PolarHBondContact O-N 3.01Å; K160-S163 PolarHBondContact O-OG 3.34Å; K160-E164 HydrophobicContact CD-CG 4.07Å; K160-E164 WeakPolarHBondContact CE-OE1 3.17Å; K160-E164 HydrophobicContact CG-CG 4.36Å; K160-E164 IonicContact NZ-OE1 3.05Å; K160-E164 PolarHBondContact NZ-OE1 3.31Å; K160-E164 IonicContact NZ-OE2 3.14Å; K160-E164 WeakPolarHBondContact O-CG 3.47Å; K160-E164 PolarHBondContact O-N 3.12Å; K160-E164 VanDerWaalsContact O-N 3.16Å
161	L	94.6	Very high	94	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-57.9	-41	177.5	-76	166	0	0	0	111.2	M120 L130 F134 L157 I158 S163 E164 V165 L173 I174 A177	M120-L161 HydrophobicContact CG-CD2 4.46Å; M120-L161 HydrophobicContact SD-CD2 3.54Å; M120-L161 VanDerWaalsContact SD-CD2 3.54Å; M120-L161 HydrophobicContact SD-CG 3.97Å; L130-L161 HydrophobicContact CD1-CD2 4.18Å; L130-L161 HydrophobicContact CD2-CD2 4.31Å; F134-L161 HydrophobicContact CE2-CD1 3.94Å; F134-L161 HydrophobicContact CE2-CD2 4.16Å; F134-L161 HydrophobicContact CZ-CD1 3.76Å; L157-L161 HydrophobicContact CD1-CD1 4.19Å; L157-L161 HydrophobicContact CD1-CG 4.19Å; L157-L161 HydrophobicContact CG-CD1 3.98Å; L157-L161 HydrophobicContact CG-CG 4.44Å; L157-L161 WeakPolarHBondContact O-CB 3.14Å; L157-L161 WeakPolarHBondContact O-CG 3.47Å; L157-L161 PolarHBondContact O-N 2.64Å; I158-L161 PolarHBondContact O-N 3.13Å; L161-S163 PolarHBondContact O-N 3.14Å; L161-E164 PolarHBondContact O-N 2.86Å; L161-V165 WeakPolarHBondContact O-CG2 3.47Å; L161-V165 PolarHBondContact O-N 2.7Å; L161-L173 HydrophobicContact CD2-CD2 3.98Å; L161-I174 HydrophobicContact CB-CD1 3.34Å; L161-I174 HydrophobicContact CD1-CD1 4.19Å; L161-I174 HydrophobicContact CG-CD1 4.41Å; L161-A177 HydrophobicContact CD1-CB 3.66Å
162	T	93.6	Very high	93.8	Very high	81 Å²	81	61.5 Å²	61.5	50%	0.497	33%	0.331	S	S	.	.	H	α-helix	trans	-60.9	-28.6	177.7	-56	0	0	0	0	112.2	I158 E159 K160	I158-T162 WeakPolarHBondContact O-CB 3.12Å; I158-T162 PolarHBondContact O-N 3.26Å; I158-T162 PolarHBondContact O-OG1 3.09Å; E159-T162 WeakPolarHBondContact O-CB 3.23Å; E159-T162 PolarHBondContact O-N 3.09Å; K160-T162 PolarHBondContact O-N 3.33Å
163	S	92.6	Very high	93.7	Very high	83 Å²	83	56.8 Å²	56.8	58%	0.58	31%	0.309	S	S	*	.	H	α-helix	trans	-84.6	-21.2	175.4	69.4	0	0	0	0	114.5	E159 K160 L161	E159-S163 PolarHBondContact O-N 3.3Å; E159-S163 VanDerWaalsContact O-N 3.15Å; K160-S163 PolarHBondContact O-N 3.01Å; K160-S163 PolarHBondContact O-OG 3.34Å; L161-S163 PolarHBondContact O-N 3.14Å
164	E	92.4	Very high	93.6	Very high	55 Å²	55	55.7 Å²	55.7	26%	0.257	30%	0.301	S	S	.	.	H	α-helix	trans	-95.3	-28.5	-175.1	-63.9	-54	126.3	0	0	114	M120 T125 K160 L161	M120-E164 HydrophobicContact CB-CG 4.03Å; M120-E164 HydrophobicContact CG-CB 4.4Å; M120-E164 HydrophobicContact CG-CG 4.07Å; M120-E164 HydrophobicContact SD-CG 4.11Å; T125-E164 PolarHBondContact OG1-O 2.58Å; K160-E164 HydrophobicContact CD-CG 4.07Å; K160-E164 WeakPolarHBondContact CE-OE1 3.17Å; K160-E164 HydrophobicContact CG-CG 4.36Å; K160-E164 IonicContact NZ-OE1 3.05Å; K160-E164 PolarHBondContact NZ-OE1 3.31Å; K160-E164 IonicContact NZ-OE2 3.14Å; K160-E164 WeakPolarHBondContact O-CG 3.47Å; K160-E164 PolarHBondContact O-N 3.12Å; K160-E164 VanDerWaalsContact O-N 3.16Å; L161-E164 PolarHBondContact O-N 2.86Å
165	V	89.8	Confident	93.5	Very high	10 Å²	10	48.5 Å²	48.5	6%	0.061	27%	0.269	C	S	.	.			trans	-122.1	147.9	-178.2	-64.1	0	0	0	0	111	T125 L130 L161 F169 S170 L173	T125-V165 HydrophobicContact CG2-CG1 4.19Å; L130-V165 HydrophobicContact CD1-CG1 4.25Å; L161-V165 WeakPolarHBondContact O-CG2 3.47Å; L161-V165 PolarHBondContact O-N 2.7Å; V165-F169 HydrophobicContact CB-CD1 4.03Å; V165-F169 HydrophobicContact CB-CE1 4Å; V165-F169 HydrophobicContact CG1-CD1 4.14Å; V165-F169 HydrophobicContact CG1-CE1 3.61Å; V165-S170 VanDerWaalsContact O-CB 3.25Å; V165-S170 WeakPolarHBondContact O-CB 3.15Å; V165-S170 PolarHBondContact O-OG 3.17Å; V165-L173 HydrophobicContact CG1-CD2 4.36Å; V165-L173 HydrophobicContact CG2-CD2 3.99Å
166	S	89.1	Confident	93.3	Very high	102 Å²	102	42.8 Å²	42.8	71%	0.713	24%	0.244	S	C	*	.			trans	-126	174.8	-175.9	72.4	0	0	0	0	113	S170	S166-S170 VanDerWaalsContact C-CB 3.48Å; S166-S170 WeakPolarHBondContact O-CB 2.98Å; S166-S170 PolarHBondContact O-N 3.31Å
167	G	91.1	Very high	93.3	Very high	51 Å²	51	40.6 Å²	40.6	53%	0.526	23%	0.232	S	C	.	.	H	α-helix	trans	66.3	-156.9	175.9	0	0	0	0	0	114.5	F169 S170 K171	G167-F169 VanDerWaalsContact C-N 3.34Å; G167-S170 WeakPolarHBondContact O-CB 3.28Å; G167-S170 PolarHBondContact O-N 3.42Å; G167-K171 PolarHBondContact O-N 2.83Å
168	D	90.6	Very high	93.1	Very high	41 Å²	41	44.1 Å²	44.1	22%	0.219	25%	0.248	C	C	.	.	H	α-helix	trans	-72.6	-27.5	-179.1	-71.5	-46.2	0	0	0	112.8	S170 K171 A172 E212 I216 L254	D168-S170 VanDerWaalsContact C-N 3.34Å; D168-S170 PolarHBondContact O-N 2.88Å; D168-K171 PolarHBondContact O-N 2.63Å; D168-K171 WeakPolarHBondContact OD1-CD 3.29Å; D168-K171 WeakPolarHBondContact OD1-CE 3.34Å; D168-K171 IonicContact OD1-NZ 3.25Å; D168-K171 PolarHBondContact OD1-NZ 3.24Å; D168-A172 PolarHBondContact O-N 3.26Å; D168-E212 HydrophobicContact CB-CB 4.19Å; D168-I216 HydrophobicContact CB-CD1 3.93Å; D168-I216 WeakPolarHBondContact O-CD1 3.43Å; D168-L254 HydrophobicContact CB-CD1 4.43Å; D168-L254 HydrophobicContact CB-CD2 3.71Å
169	F	91.5	Very high	92.7	Very high	14 Å²	14	43.1 Å²	43.1	6%	0.061	24%	0.244	C	C	.	.	H	α-helix	trans	-56.3	-48.3	168.6	172.5	-118	0	0	0	111.2	D127 I131 V165 G167 K171 A172 L173 E253 L254 L257	D127-F169 HydrophobicContact CB-CE1 4.06Å; D127-F169 HydrophobicContact CB-CZ 3.84Å; D127-F169 WeakPolarHBondContact OD1-CE1 3.09Å; I131-F169 HydrophobicContact CD1-CE2 4.01Å; I131-F169 HydrophobicContact CD1-CZ 4.45Å; I131-F169 HydrophobicContact CG1-CE2 3.78Å; I131-F169 HydrophobicContact CG1-CZ 4.2Å; V165-F169 HydrophobicContact CB-CD1 4.03Å; V165-F169 HydrophobicContact CB-CE1 4Å; V165-F169 HydrophobicContact CG1-CD1 4.14Å; V165-F169 HydrophobicContact CG1-CE1 3.61Å; G167-F169 VanDerWaalsContact C-N 3.34Å; F169-K171 PolarHBondContact O-N 2.99Å; F169-A172 PolarHBondContact O-N 3.09Å; F169-L173 HydrophobicContact CE1-CD2 4.38Å; F169-L173 HydrophobicContact CE2-CD1 4.48Å; F169-L173 HydrophobicContact CZ-CD1 4.47Å; F169-L173 HydrophobicContact CZ-CD2 4.12Å; F169-L173 WeakPolarHBondContact O-CB 3.3Å; F169-L173 PolarHBondContact O-N 3.2Å; F169-E253 HydrophobicContact CB-CB 4.31Å; F169-E253 HydrophobicContact CD1-CB 4.01Å; F169-E253 HydrophobicContact CD2-CB 3.71Å; F169-E253 WeakPolarHBondContact CD2-O 3.39Å; F169-E253 HydrophobicContact CE1-CB 4.23Å; F169-E253 HydrophobicContact CE2-CB 3.96Å; F169-E253 HydrophobicContact CG-CB 3.74Å; F169-E253 HydrophobicContact CZ-CB 4.22Å; F169-L254 HydrophobicContact CB-CB 4.36Å; F169-L257 HydrophobicContact CD2-CB 4.17Å; F169-L257 HydrophobicContact CD2-CD2 3.8Å; F169-L257 HydrophobicContact CE2-CB 4.11Å; F169-L257 HydrophobicContact CE2-CD2 3.84Å; F169-L257 HydrophobicContact CE2-CG 4.48Å
170	S	92.8	Very high	92.3	Very high	14 Å²	14	42 Å²	42	10%	0.098	24%	0.239	C	C	.	.	H	α-helix	trans	-56	-48.4	174.7	-175.8	0	0	0	0	112	V165 S166 G167 D168 A172 L173 I174	V165-S170 VanDerWaalsContact O-CB 3.25Å; V165-S170 WeakPolarHBondContact O-CB 3.15Å; V165-S170 PolarHBondContact O-OG 3.17Å; S166-S170 VanDerWaalsContact C-CB 3.48Å; S166-S170 WeakPolarHBondContact O-CB 2.98Å; S166-S170 PolarHBondContact O-N 3.31Å; G167-S170 WeakPolarHBondContact O-CB 3.28Å; G167-S170 PolarHBondContact O-N 3.42Å; D168-S170 VanDerWaalsContact C-N 3.34Å; D168-S170 PolarHBondContact O-N 2.88Å; S170-A172 VanDerWaalsContact C-N 3.33Å; S170-A172 PolarHBondContact O-N 2.8Å; S170-L173 PolarHBondContact O-N 3.01Å; S170-I174 WeakPolarHBondContact O-CB 3.43Å; S170-I174 VanDerWaalsContact O-CG1 3.22Å; S170-I174 WeakPolarHBondContact O-CG1 3.48Å; S170-I174 PolarHBondContact O-N 2.79Å
171	K	92.6	Very high	92	Very high	107 Å²	107	42 Å²	42	47%	0.465	24%	0.237	S	C	.	.	H	α-helix	trans	-57.8	-45.2	179.1	-63.2	178.1	-166.6	159.2	0	112.2	G167 D168 F169 L175 I216	G167-K171 PolarHBondContact O-N 2.83Å; D168-K171 PolarHBondContact O-N 2.63Å; D168-K171 WeakPolarHBondContact OD1-CD 3.29Å; D168-K171 WeakPolarHBondContact OD1-CE 3.34Å; D168-K171 IonicContact OD1-NZ 3.25Å; D168-K171 PolarHBondContact OD1-NZ 3.24Å; F169-K171 PolarHBondContact O-N 2.99Å; K171-L175 WeakPolarHBondContact O-CG 3.45Å; K171-L175 PolarHBondContact O-N 2.83Å; K171-I216 HydrophobicContact CB-CD1 4.44Å
172	A	92.9	Very high	91.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.7	-47.3	179.7	0	0	0	0	0	111.9	D168 F169 S170 I174 L175 L176 I216 L254 L257	D168-A172 PolarHBondContact O-N 3.26Å; F169-A172 PolarHBondContact O-N 3.09Å; S170-A172 VanDerWaalsContact C-N 3.33Å; S170-A172 PolarHBondContact O-N 2.8Å; A172-I174 PolarHBondContact O-N 3.29Å; A172-L175 PolarHBondContact O-N 2.99Å; A172-L176 WeakPolarHBondContact O-CG 3.27Å; A172-L176 PolarHBondContact O-N 3.46Å; A172-I216 HydrophobicContact CB-CD1 4.01Å; A172-I216 HydrophobicContact CB-CG1 3.89Å; A172-I216 HydrophobicContact CB-CG2 4.01Å; A172-L254 HydrophobicContact CB-CD1 4.05Å; A172-L257 HydrophobicContact CB-CD2 3.51Å
173	L	94.3	Very high	91.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62	-43.7	179.6	-165.6	72.1	0	0	0	111.6	L130 F134 L161 V165 F169 S170 L175 L176 A177 L257	L130-L173 HydrophobicContact CB-CD1 4.13Å; L130-L173 HydrophobicContact CB-CD2 4.03Å; L130-L173 HydrophobicContact CD1-CD2 3.9Å; F134-L173 HydrophobicContact CB-CD1 4Å; F134-L173 HydrophobicContact CD2-CD1 3.78Å; F134-L173 HydrophobicContact CD2-CG 4.18Å; F134-L173 HydrophobicContact CG-CD1 4.24Å; L161-L173 HydrophobicContact CD2-CD2 3.98Å; V165-L173 HydrophobicContact CG1-CD2 4.36Å; V165-L173 HydrophobicContact CG2-CD2 3.99Å; F169-L173 HydrophobicContact CE1-CD2 4.38Å; F169-L173 HydrophobicContact CE2-CD1 4.48Å; F169-L173 HydrophobicContact CZ-CD1 4.47Å; F169-L173 HydrophobicContact CZ-CD2 4.12Å; F169-L173 WeakPolarHBondContact O-CB 3.3Å; F169-L173 PolarHBondContact O-N 3.2Å; S170-L173 PolarHBondContact O-N 3.01Å; L173-L175 VanDerWaalsContact C-N 3.33Å; L173-L175 PolarHBondContact O-N 2.85Å; L173-L176 PolarHBondContact O-N 3.27Å; L173-A177 WeakPolarHBondContact O-CB 3.31Å; L173-A177 PolarHBondContact O-N 2.98Å; L173-L257 HydrophobicContact CB-CD2 4.24Å; L173-L257 HydrophobicContact CD1-CD1 4.39Å; L173-L257 HydrophobicContact CD1-CD2 4.33Å
174	I	94.7	Very high	90.8	Very high	18 Å²	18	42.9 Å²	42.9	9%	0.092	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-38.4	177.1	-67.7	-49.5	0	0	0	111.9	I158 L161 S170 A172 L176 A177 K178	I158-I174 HydrophobicContact CG2-CD1 4.28Å; I158-I174 HydrophobicContact CG2-CG2 3.92Å; L161-I174 HydrophobicContact CB-CD1 3.34Å; L161-I174 HydrophobicContact CD1-CD1 4.19Å; L161-I174 HydrophobicContact CG-CD1 4.41Å; S170-I174 WeakPolarHBondContact O-CB 3.43Å; S170-I174 VanDerWaalsContact O-CG1 3.22Å; S170-I174 WeakPolarHBondContact O-CG1 3.48Å; S170-I174 PolarHBondContact O-N 2.79Å; A172-I174 PolarHBondContact O-N 3.29Å; I174-L176 VanDerWaalsContact C-N 3.31Å; I174-L176 PolarHBondContact O-N 2.9Å; I174-A177 PolarHBondContact O-N 2.94Å; I174-K178 HydrophobicContact CG2-CD 4.31Å; I174-K178 HydrophobicContact CG2-CG 4.47Å; I174-K178 VanDerWaalsContact O-CG 3.28Å; I174-K178 WeakPolarHBondContact O-CG 3.33Å; I174-K178 PolarHBondContact O-N 3.41Å
175	L	93.4	Very high	90.6	Very high	33 Å²	33	45.9 Å²	45.9	17%	0.173	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-38.9	176.2	-77.7	170.6	0	0	0	112.4	K171 A172 L173 I216 C220	K171-L175 WeakPolarHBondContact O-CG 3.45Å; K171-L175 PolarHBondContact O-N 2.83Å; A172-L175 PolarHBondContact O-N 2.99Å; L173-L175 VanDerWaalsContact C-N 3.33Å; L173-L175 PolarHBondContact O-N 2.85Å; L175-I216 HydrophobicContact CD1-CG2 3.37Å; L175-C220 HydrophobicContact CB-CB 3.93Å; L175-C220 HydrophobicContact CD1-CB 4.26Å
176	L	93.4	Very high	90.5	Very high	11 Å²	11	49.4 Å²	49.4	6%	0.058	30%	0.295	C	S	.	.	H	α-helix	trans	-69.7	-46.4	175.7	-62.1	167	0	0	0	110.9	F134 I142 A172 L173 I174 K178 G179 C220 L257 V261	F134-L176 HydrophobicContact CB-CB 3.96Å; F134-L176 HydrophobicContact CB-CD1 4.48Å; I142-L176 VanDerWaalsContact CD1-O 3.23Å; I142-L176 WeakPolarHBondContact CD1-O 3.23Å; A172-L176 WeakPolarHBondContact O-CG 3.27Å; A172-L176 PolarHBondContact O-N 3.46Å; L173-L176 PolarHBondContact O-N 3.27Å; I174-L176 VanDerWaalsContact C-N 3.31Å; I174-L176 PolarHBondContact O-N 2.9Å; L176-K178 PolarHBondContact O-N 3.41Å; L176-G179 PolarHBondContact O-N 2.95Å; L176-C220 HydrophobicContact CD2-CB 4.05Å; L176-C220 HydrophobicContact CG-CB 4.38Å; L176-L257 HydrophobicContact CD1-CD1 3.67Å; L176-L257 HydrophobicContact CD1-CD2 4.29Å; L176-L257 HydrophobicContact CD1-CG 4.26Å; L176-V261 HydrophobicContact CD1-CG2 3.53Å; L176-V261 HydrophobicContact CD2-CG1 4.22Å; L176-V261 HydrophobicContact CD2-CG2 4.16Å; L176-V261 HydrophobicContact CG-CG2 4.49Å
177	A	95	Very high	90.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-25.8	178.8	0	0	0	0	0	113.4	F134 I142 I158 L161 L173 I174 G179	F134-A177 HydrophobicContact CD1-CB 3.68Å; F134-A177 HydrophobicContact CE1-CB 3.5Å; F134-A177 HydrophobicContact CG-CB 4.31Å; F134-A177 HydrophobicContact CZ-CB 4.01Å; I142-A177 WeakPolarHBondContact CG2-O 3.32Å; I158-A177 HydrophobicContact CD1-CB 3.53Å; L161-A177 HydrophobicContact CD1-CB 3.66Å; L173-A177 WeakPolarHBondContact O-CB 3.31Å; L173-A177 PolarHBondContact O-N 2.98Å; I174-A177 PolarHBondContact O-N 2.94Å; A177-G179 PolarHBondContact O-N 3.42Å
178	K	93.6	Very high	90.9	Very high	79 Å²	79	49.6 Å²	49.6	34%	0.343	28%	0.278	S	S	.	.	H	α-helix	trans	-66.2	-26	170.5	-78.7	175.6	177.5	-174.2	0	112.9	K146 I158 I174 L176 E180	K146-K178 PolarHBondContact NZ-O 3.3Å; I158-K178 HydrophobicContact CD1-CG 4.21Å; I174-K178 HydrophobicContact CG2-CD 4.31Å; I174-K178 HydrophobicContact CG2-CG 4.47Å; I174-K178 VanDerWaalsContact O-CG 3.28Å; I174-K178 WeakPolarHBondContact O-CG 3.33Å; I174-K178 PolarHBondContact O-N 3.41Å; L176-K178 PolarHBondContact O-N 3.41Å; K178-E180 VanDerWaalsContact C-N 3.32Å; K178-E180 HydrophobicContact CB-CG 4.02Å
179	G	88.8	Confident	91	Very high	6 Å²	6	51.2 Å²	51.2	6%	0.062	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	24.7	179.9	0	0	0	0	0	113.6	K139 L176 A177	K139-G179 VanDerWaalsContact CD-O 3.26Å; K139-G179 WeakPolarHBondContact CD-O 3.5Å; K139-G179 WeakPolarHBondContact CE-O 3.26Å; K139-G179 WeakPolarHBondContact CG-O 3.15Å; L176-G179 PolarHBondContact O-N 2.95Å; A177-G179 PolarHBondContact O-N 3.42Å
180	E	87.4	Confident	91.2	Very high	120 Å²	120	53 Å²	53	56%	0.561	31%	0.312	S	S	*	.			trans	-92.7	10	-173.8	-71	175.3	-172.3	0	0	114	K178 D182	K178-E180 VanDerWaalsContact C-N 3.32Å; K178-E180 HydrophobicContact CB-CG 4.02Å; E180-D182 PolarHBondContact O-N 2.68Å
181	R	87.9	Confident	91.2	Very high	56 Å²	56	55.8 Å²	55.8	21%	0.211	32%	0.322	C	S	.	.			trans	-57.5	136.5	174.7	-176	-179.9	-66.9	-82.9	1.7	110.2	G183 L219 C220 R222	R181-G183 PolarHBondContact O-N 3.4Å; R181-L219 VanDerWaalsContact CZ-O 3.29Å; R181-L219 PolarHBondContact NH1-O 2.96Å; R181-L219 PolarHBondContact NH2-O 3.4Å; R181-C220 PolarHBondContact NH2-O 3.37Å; R181-R222 VanDerWaalsContact CG-O 3.32Å; R181-R222 WeakPolarHBondContact CG-O 3.18Å; R181-R222 PolarHBondContact NH1-O 2.71Å
182	D	86.3	Confident	91.3	Very high	77 Å²	77	50.7 Å²	50.7	41%	0.412	30%	0.3	S	S	.	.			trans	-59.3	125.9	174.9	-178.2	11.7	0	0	0	110.6	E180 S184 K221 S223	E180-D182 PolarHBondContact O-N 2.68Å; D182-S184 VanDerWaalsContact CG-OG 3.24Å; D182-S184 VanDerWaalsContact OD1-CB 3.23Å; D182-S184 WeakPolarHBondContact OD1-CB 3.38Å; D182-S184 PolarHBondContact OD1-N 3Å; D182-S184 PolarHBondContact OD1-OG 2.95Å; D182-S184 PolarHBondContact OD2-OG 3.32Å; D182-K221 PolarHBondContact N-O 3.44Å; D182-S223 WeakPolarHBondContact O-CA 3.48Å; D182-S223 WeakPolarHBondContact O-CB 3.43Å
183	G	83.8	Confident	91.3	Very high	72 Å²	72	57.4 Å²	57.4	74%	0.742	33%	0.325	S	S	*	.			trans	-92.8	5.8	178.1	0	0	0	0	0	113.6	R181	R181-G183 PolarHBondContact O-N 3.4Å
184	S	86.4	Confident	91.2	Very high	34 Å²	34	60.5 Å²	60.5	24%	0.238	34%	0.34	C	S	.	.			trans	-65.3	140.1	180	75.1	0	0	0	0	111.9	D182 S223	D182-S184 VanDerWaalsContact CG-OG 3.24Å; D182-S184 VanDerWaalsContact OD1-CB 3.23Å; D182-S184 WeakPolarHBondContact OD1-CB 3.38Å; D182-S184 PolarHBondContact OD1-N 3Å; D182-S184 PolarHBondContact OD1-OG 2.95Å; D182-S184 PolarHBondContact OD2-OG 3.32Å; S184-S223 WeakPolarHBondContact O-CB 3.23Å; S184-S223 PolarHBondContact O-OG 2.95Å; S184-S223 VanDerWaalsContact O-OG 3.14Å
185	N	87.2	Confident	91.1	Very high	119 Å²	119	59.8 Å²	59.8	64%	0.636	34%	0.336	S	S	*	.			trans	-93.3	-4	171.4	-73.4	-24.7	0	0	0	112.9
186	S	88.7	Confident	91	Very high	84 Å²	84	58.2 Å²	58.2	59%	0.587	33%	0.328	S	S	*	.			trans	-76.1	139.8	177.3	51.6	0	0	0	0	111
187	V	93.1	Very high	90.7	Very high	62 Å²	62	60.5 Å²	60.5	38%	0.376	34%	0.338	S	S	.	.			trans	-112.9	123.5	175.8	178.7	0	0	0	0	109.4	V189 P225 Q229	V187-V189 HydrophobicContact CG1-CG2 4.27Å; V187-P225 HydrophobicContact CG2-CB 3.68Å; V187-Q229 HydrophobicContact CG1-CB 3.59Å; V187-Q229 HydrophobicContact CG1-CG 3.79Å
188	D	94.1	Very high	90.1	Very high	94 Å²	94	66 Å²	66	50%	0.503	36%	0.362	S	S	.	.			trans	-97.2	101.7	165.8	-176.9	-23.3	0	0	0	108.7	G190 K191 A192 Q226	D188-G190 VanDerWaalsContact C-N 3.29Å; D188-G190 PolarHBondContact O-N 2.93Å; D188-G190 WeakPolarHBondContact OD1-CA 3.23Å; D188-G190 PolarHBondContact OD1-N 2.97Å; D188-K191 HydrophobicContact CB-CB 3.83Å; D188-K191 PolarHBondContact O-N 2.59Å; D188-K191 PolarHBondContact OD1-N 3.31Å; D188-A192 PolarHBondContact O-N 3.21Å; D188-Q226 PolarHBondContact O-NE2 3.3Å
189	V	93.9	Very high	89.3	Confident	76 Å²	76	63.7 Å²	63.7	46%	0.461	36%	0.355	S	S	.	.	H	α-helix	trans	-64.3	-35.1	-179.4	-178.5	0	0	0	0	111.6	V187 A192 R193 Q229	V187-V189 HydrophobicContact CG1-CG2 4.27Å; V189-A192 PolarHBondContact O-N 3.14Å; V189-R193 WeakPolarHBondContact O-CB 3.34Å; V189-R193 PolarHBondContact O-N 3.2Å; V189-Q229 HydrophobicContact CG2-CG 4.39Å
190	G	94.6	Very high	89.1	Confident	52 Å²	52	63.4 Å²	63.4	54%	0.536	35%	0.352	S	S	.	.	H	α-helix	trans	-64.8	-43.1	176.8	0	0	0	0	0	111.2	D188 R193 E194	D188-G190 VanDerWaalsContact C-N 3.29Å; D188-G190 PolarHBondContact O-N 2.93Å; D188-G190 WeakPolarHBondContact OD1-CA 3.23Å; D188-G190 PolarHBondContact OD1-N 2.97Å; G190-R193 PolarHBondContact O-N 2.65Å; G190-E194 WeakPolarHBondContact O-CB 3.36Å; G190-E194 PolarHBondContact O-N 2.97Å
191	K	93.9	Very high	89	Confident	72 Å²	72	59.9 Å²	59.9	31%	0.313	33%	0.334	S	S	.	.	H	α-helix	trans	-67.6	-39.3	174.3	-169.1	70.2	-162.7	167.7	0	112.5	D188 R193 E194 D195	D188-K191 HydrophobicContact CB-CB 3.83Å; D188-K191 PolarHBondContact O-N 2.59Å; D188-K191 PolarHBondContact OD1-N 3.31Å; K191-R193 VanDerWaalsContact C-N 3.33Å; K191-R193 PolarHBondContact O-N 2.9Å; K191-E194 IonicContact NZ-OE2 2.72Å; K191-E194 PolarHBondContact NZ-OE2 2.99Å; K191-E194 PolarHBondContact O-N 2.99Å; K191-D195 VanDerWaalsContact CE-OD1 3.32Å; K191-D195 WeakPolarHBondContact CE-OD1 3.46Å; K191-D195 IonicContact NZ-OD1 3.85Å; K191-D195 WeakPolarHBondContact O-CB 3.39Å; K191-D195 PolarHBondContact O-N 3Å
192	A	93.7	Very high	88.6	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-59.3	-46.3	176.1	0	0	0	0	0	111.2	D188 V189 D195 A196 Q226 Q229 T230 E233	D188-A192 PolarHBondContact O-N 3.21Å; V189-A192 PolarHBondContact O-N 3.14Å; A192-D195 PolarHBondContact O-N 3.28Å; A192-A196 VanDerWaalsContact O-CB 3.28Å; A192-A196 WeakPolarHBondContact O-CB 3.26Å; A192-A196 PolarHBondContact O-N 2.76Å; A192-Q226 VanDerWaalsContact N-NE2 3.16Å; A192-Q229 HydrophobicContact CB-CB 3.85Å; A192-Q229 HydrophobicContact CB-CG 3.47Å; A192-Q229 VanDerWaalsContact CB-CG 3.47Å; A192-T230 WeakPolarHBondContact CA-OG1 3.49Å; A192-E233 HydrophobicContact CB-CG 4.21Å
193	R	93.8	Very high	87.6	Confident	140 Å²	140	58.5 Å²	58.5	53%	0.528	33%	0.327	S	S	.	.	H	α-helix	trans	-64.8	-40.2	176	-173.8	176.4	175.3	164.9	3.6	112	V189 G190 K191 A196 E197 E233 I237	V189-R193 WeakPolarHBondContact O-CB 3.34Å; V189-R193 PolarHBondContact O-N 3.2Å; G190-R193 PolarHBondContact O-N 2.65Å; K191-R193 VanDerWaalsContact C-N 3.33Å; K191-R193 PolarHBondContact O-N 2.9Å; R193-A196 PolarHBondContact O-N 3.48Å; R193-E197 VanDerWaalsContact O-CB 3.24Å; R193-E197 WeakPolarHBondContact O-CB 3.38Å; R193-E197 PolarHBondContact O-N 3Å; R193-E233 HydrophobicContact CB-CG 4.19Å; R193-I237 HydrophobicContact CG-CD1 4.3Å
194	E	92.3	Very high	86.8	Confident	66 Å²	66	55 Å²	55	31%	0.308	29%	0.292	S	S	.	.	H	α-helix	trans	-62.5	-49.3	175.5	-176	179.3	-144.3	0	0	112	G190 K191 A196 E197 K198	G190-E194 WeakPolarHBondContact O-CB 3.36Å; G190-E194 PolarHBondContact O-N 2.97Å; K191-E194 IonicContact NZ-OE2 2.72Å; K191-E194 PolarHBondContact NZ-OE2 2.99Å; K191-E194 PolarHBondContact O-N 2.99Å; E194-A196 VanDerWaalsContact C-N 3.32Å; E194-A196 PolarHBondContact O-N 2.75Å; E194-E197 PolarHBondContact O-N 3.08Å; E194-K198 HydrophobicContact CG-CD 3.74Å; E194-K198 HydrophobicContact CG-CG 4.18Å; E194-K198 WeakPolarHBondContact O-CB 3.22Å; E194-K198 PolarHBondContact O-N 3.04Å; E194-K198 IonicContact OE1-NZ 3.78Å; E194-K198 PolarHBondContact OE1-NZ 3.34Å
195	D	91.9	Very high	85.8	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.016	29%	0.289	C	S	.	.	I	π-helix	trans	-59.9	-43.8	178.4	-80.6	-10.6	0	0	0	110.3	K191 A192 T199 L200 I218 R222 T230	K191-D195 VanDerWaalsContact CE-OD1 3.32Å; K191-D195 WeakPolarHBondContact CE-OD1 3.46Å; K191-D195 IonicContact NZ-OD1 3.85Å; K191-D195 WeakPolarHBondContact O-CB 3.39Å; K191-D195 PolarHBondContact O-N 3Å; A192-D195 PolarHBondContact O-N 3.28Å; D195-T199 VanDerWaalsContact O-CB 3.27Å; D195-T199 WeakPolarHBondContact O-CB 3.13Å; D195-T199 PolarHBondContact O-N 3.04Å; D195-L200 PolarHBondContact O-N 3.26Å; D195-I218 HydrophobicContact CB-CD1 3.8Å; D195-R222 IonicContact OD1-NH2 2.67Å; D195-R222 PolarHBondContact OD1-NH2 2.87Å; D195-R222 VanDerWaalsContact OD1-NH2 3.13Å; D195-R222 IonicContact OD2-CZ 3.34Å; D195-R222 IonicContact OD2-NE 2.71Å; D195-R222 PolarHBondContact OD2-NE 3.3Å; D195-R222 IonicContact OD2-NH2 3.16Å; D195-R222 PolarHBondContact OD2-NH2 2.82Å; D195-T230 HydrophobicContact CB-CG2 4.02Å
196	A	91	Very high	84.4	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.287	C	S	.	.	I	π-helix	trans	-63.2	-51.2	175.2	0	0	0	0	0	112.8	A192 R193 E194 Y201 T230 E233 I237	A192-A196 VanDerWaalsContact O-CB 3.28Å; A192-A196 WeakPolarHBondContact O-CB 3.26Å; A192-A196 PolarHBondContact O-N 2.76Å; R193-A196 PolarHBondContact O-N 3.48Å; E194-A196 VanDerWaalsContact C-N 3.32Å; E194-A196 PolarHBondContact O-N 2.75Å; A196-Y201 VanDerWaalsContact O-CB 3.32Å; A196-Y201 WeakPolarHBondContact O-CB 3.46Å; A196-Y201 PolarHBondContact O-N 2.82Å; A196-T230 HydrophobicContact CB-CG2 4.21Å; A196-E233 HydrophobicContact CB-CB 3.81Å; A196-I237 HydrophobicContact CB-CD1 3.96Å
197	E	88	Confident	83	Confident	58 Å²	58	58 Å²	58	27%	0.271	28%	0.284	S	S	.	.	I	π-helix	trans	-75.8	-53.6	-172.2	-165.8	-174.7	158.4	0	0	112.7	R193 E194 K202 I237	R193-E197 VanDerWaalsContact O-CB 3.24Å; R193-E197 WeakPolarHBondContact O-CB 3.38Å; R193-E197 PolarHBondContact O-N 3Å; E194-E197 PolarHBondContact O-N 3.08Å; E197-K202 HydrophobicContact CG-CD 4.5Å; E197-K202 WeakPolarHBondContact O-CB 3.36Å; E197-K202 VanDerWaalsContact O-CG 3.24Å; E197-K202 WeakPolarHBondContact O-CG 3.1Å; E197-K202 PolarHBondContact O-N 3.11Å; E197-K202 WeakPolarHBondContact OE1-CE 3.17Å; E197-K202 IonicContact OE1-NZ 3.79Å; E197-K202 PolarHBondContact OE1-NZ 3.4Å; E197-I237 HydrophobicContact CB-CD1 3.77Å; E197-I237 HydrophobicContact CG-CD1 4.31Å; E197-I237 HydrophobicContact CG-CG2 4.35Å
198	K	81.9	Confident	80.6	Confident	116 Å²	116	67.9 Å²	67.9	50%	0.504	32%	0.315	S	S	.	.	I	π-helix	trans	-81.9	-37.7	-170.4	-63	-171.4	-169.1	164.4	0	111.8	E194 A203	E194-K198 HydrophobicContact CG-CD 3.74Å; E194-K198 HydrophobicContact CG-CG 4.18Å; E194-K198 WeakPolarHBondContact O-CB 3.22Å; E194-K198 PolarHBondContact O-N 3.04Å; E194-K198 IonicContact OE1-NZ 3.78Å; E194-K198 PolarHBondContact OE1-NZ 3.34Å; K198-A203 PolarHBondContact O-N 3.43Å
199	T	77.6	Confident	78.8	Confident	31 Å²	31	65.5 Å²	65.5	19%	0.19	31%	0.313	C	S	.	.	I	π-helix	trans	-98.5	-53.8	-168.7	-47.6	0	0	0	0	111.3	D195 A203 K214 I218	D195-T199 VanDerWaalsContact O-CB 3.27Å; D195-T199 WeakPolarHBondContact O-CB 3.13Å; D195-T199 PolarHBondContact O-N 3.04Å; T199-A203 WeakPolarHBondContact O-CB 3.02Å; T199-K214 HydrophobicContact CG2-CB 3.62Å; T199-K214 HydrophobicContact CG2-CD 3.98Å; T199-K214 HydrophobicContact CG2-CG 3.99Å; T199-I218 HydrophobicContact CG2-CD1 3.25Å; T199-I218 HydrophobicContact CG2-CG1 4.21Å
200	L	83.9	Confident	77.3	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.295	C	S	.	.	I	π-helix	trans	-79	-46.2	-177.4	-60.9	176	0	0	0	112.2	D195 G204 F215 I218 T230 Y234 L242	D195-L200 PolarHBondContact O-N 3.26Å; L200-G204 WeakPolarHBondContact O-CA 3.28Å; L200-G204 PolarHBondContact O-N 2.94Å; L200-F215 HydrophobicContact CB-CZ 4.29Å; L200-F215 HydrophobicContact CD2-CD1 3.71Å; L200-F215 HydrophobicContact CD2-CD2 4.01Å; L200-F215 HydrophobicContact CD2-CE1 3.77Å; L200-F215 HydrophobicContact CD2-CE2 4.05Å; L200-F215 HydrophobicContact CD2-CG 3.83Å; L200-F215 HydrophobicContact CD2-CZ 3.93Å; L200-F215 WeakPolarHBondContact O-CZ 3.21Å; L200-I218 HydrophobicContact CD2-CD1 4.26Å; L200-I218 HydrophobicContact CG-CD1 4.2Å; L200-T230 HydrophobicContact CD1-CG2 3.8Å; L200-Y234 HydrophobicContact CB-CD2 3.62Å; L200-Y234 HydrophobicContact CB-CE2 3.53Å; L200-Y234 HydrophobicContact CD1-CD2 4.23Å; L200-L242 HydrophobicContact CB-CD1 4.43Å; L200-L242 HydrophobicContact CD1-CD1 4.09Å; L200-L242 HydrophobicContact CD1-CD2 4.16Å
201	Y	84.3	Confident	76.4	Confident	46 Å²	46	62.5 Å²	62.5	18%	0.18	28%	0.283	C	S	.	.	I	π-helix	trans	-82.7	-57.3	-175.1	-176.5	-118	0	0	0	113.3	A196 E205 K206 I237 S238	A196-Y201 VanDerWaalsContact O-CB 3.32Å; A196-Y201 WeakPolarHBondContact O-CB 3.46Å; A196-Y201 PolarHBondContact O-N 2.82Å; Y201-E205 HydrophobicContact CD2-CB 4.43Å; Y201-E205 WeakPolarHBondContact CD2-OE2 3.47Å; Y201-E205 VanDerWaalsContact CE2-OE2 3.28Å; Y201-E205 WeakPolarHBondContact CE2-OE2 3.48Å; Y201-E205 PolarHBondContact O-N 3.31Å; Y201-K206 HydrophobicContact CE1-CD 4.25Å; Y201-K206 PolarHBondContact O-N 3.24Å; Y201-K206 VanDerWaalsContact OH-CE 3.27Å; Y201-K206 WeakPolarHBondContact OH-CE 3.34Å; Y201-I237 HydrophobicContact CD1-CG2 3.69Å; Y201-I237 HydrophobicContact CE1-CG2 4.13Å; Y201-I237 HydrophobicContact CG-CG2 4.09Å; Y201-S238 VanDerWaalsContact CD2-CB 3.44Å
202	K	80.1	Confident	75.8	Confident	96 Å²	96	61.9 Å²	61.9	42%	0.417	28%	0.281	S	S	.	.	I	π-helix	trans	-71.5	-32.7	-176.9	-74.1	174.2	-172.7	168.4	0	113.9	E197	E197-K202 HydrophobicContact CG-CD 4.5Å; E197-K202 WeakPolarHBondContact O-CB 3.36Å; E197-K202 VanDerWaalsContact O-CG 3.24Å; E197-K202 WeakPolarHBondContact O-CG 3.1Å; E197-K202 PolarHBondContact O-N 3.11Å; E197-K202 WeakPolarHBondContact OE1-CE 3.17Å; E197-K202 IonicContact OE1-NZ 3.79Å; E197-K202 PolarHBondContact OE1-NZ 3.4Å
203	A	66.4	Low	75.2	Confident	7 Å²	7	64.6 Å²	64.6	6%	0.058	30%	0.3	C	S	.	.	I	π-helix	trans	-97.4	-11.1	-178.6	0	0	0	0	0	114.3	K198 T199 K214	K198-A203 PolarHBondContact O-N 3.43Å; T199-A203 WeakPolarHBondContact O-CB 3.02Å; A203-K214 HydrophobicContact CB-CD 3.94Å
204	G	66.1	Low	74.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.289	C	S	.	.	I	π-helix	trans	-96.6	-91.6	166.6	0	0	0	0	0	111.6	L200 K206 K207	L200-G204 WeakPolarHBondContact O-CA 3.28Å; L200-G204 PolarHBondContact O-N 2.94Å; G204-K206 VanDerWaalsContact C-N 3.26Å; G204-K206 PolarHBondContact O-N 3.47Å; G204-K207 PolarHBondContact O-N 3.47Å; G204-K207 VanDerWaalsContact O-N 3.14Å
205	E	64.9	Low	74.4	Confident	37 Å²	37	58.3 Å²	58.3	17%	0.173	28%	0.275	C	S	.	.	I	π-helix	trans	-59.8	-22.5	-167.8	-64.9	-163.1	136.7	0	0	116.4	Y201 K240 S245	Y201-E205 HydrophobicContact CD2-CB 4.43Å; Y201-E205 WeakPolarHBondContact CD2-OE2 3.47Å; Y201-E205 VanDerWaalsContact CE2-OE2 3.28Å; Y201-E205 WeakPolarHBondContact CE2-OE2 3.48Å; Y201-E205 PolarHBondContact O-N 3.31Å; E205-K240 WeakPolarHBondContact OE1-CD 3.41Å; E205-K240 IonicContact OE1-NZ 3.13Å; E205-K240 PolarHBondContact OE1-NZ 3.44Å; E205-K240 VanDerWaalsContact OE1-NZ 3.13Å; E205-S245 WeakPolarHBondContact OE1-CB 3.38Å; E205-S245 PolarHBondContact OE1-OG 2.9Å
206	K	58.9	Low	74.3	Confident	139 Å²	139	58.4 Å²	58.4	60%	0.604	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	5.9	-178.9	-74.6	-161.3	173.5	-178.6	0	114.7	Y201 G204	Y201-K206 HydrophobicContact CE1-CD 4.25Å; Y201-K206 PolarHBondContact O-N 3.24Å; Y201-K206 VanDerWaalsContact OH-CE 3.27Å; Y201-K206 WeakPolarHBondContact OH-CE 3.34Å; G204-K206 VanDerWaalsContact C-N 3.26Å; G204-K206 PolarHBondContact O-N 3.47Å
207	K	58	Low	74.1	Confident	122 Å²	122	63 Å²	63	53%	0.53	30%	0.297	S	S	.	.	S	Bend	trans	-116.8	153.9	174.1	-71.4	-172.3	176.7	-174.7	0	110.4	G204 G209	G204-K207 PolarHBondContact O-N 3.47Å; G204-K207 VanDerWaalsContact O-N 3.14Å; K207-G209 PolarHBondContact O-N 3.33Å
208	W	44.2	Very low	74.1	Confident	270 Å²	270	60.4 Å²	60.4	100%	1.023	29%	0.285	S	S	*	.	S	Bend	trans	-72.8	106.8	168.3	-174.9	-77.8	0	0	0	108.1
209	G	54.8	Low	74.4	Confident	45 Å²	45	55 Å²	55	46%	0.464	26%	0.261	S	S	.	.	S	Bend	trans	86.5	146.1	-167.9	0	0	0	0	0	112.3	K207	K207-G209 PolarHBondContact O-N 3.33Å
210	T	63.1	Low	75	Confident	14 Å²	14	53.6 Å²	53.6	9%	0.086	25%	0.253	C	S	.	.			trans	-88.9	151	177.5	-68.8	0	0	0	0	110.6	E212 F215 E249 M250	T210-E212 PolarHBondContact O-N 3.25Å; T210-F215 HydrophobicContact CG2-CD2 3.66Å; T210-F215 HydrophobicContact CG2-CE2 3.54Å; T210-F215 HydrophobicContact CG2-CG 4.42Å; T210-F215 HydrophobicContact CG2-CZ 4.19Å; T210-E249 WeakPolarHBondContact OG1-CB 3.25Å; T210-M250 HydrophobicContact CG2-CE 3.46Å; T210-M250 VanDerWaalsContact CG2-CE 3.46Å
211	D	75.6	Confident	75.2	Confident	50 Å²	50	57.1 Å²	57.1	27%	0.267	27%	0.269	S	S	.	.			trans	-88.8	83.3	167.6	-170.4	-25.3	0	0	0	108.2	S213 K214 F215	D211-S213 PolarHBondContact O-N 3.23Å; D211-S213 VanDerWaalsContact O-N 3.16Å; D211-K214 HydrophobicContact CB-CB 4.34Å; D211-K214 HydrophobicContact CB-CD 4.05Å; D211-K214 HydrophobicContact CB-CG 4.38Å; D211-K214 WeakPolarHBondContact O-CB 3.24Å; D211-K214 PolarHBondContact O-N 3.28Å; D211-K214 WeakPolarHBondContact OD2-CD 3.39Å; D211-K214 WeakPolarHBondContact OD2-CE 3.23Å; D211-K214 IonicContact OD2-NZ 2.73Å; D211-K214 PolarHBondContact OD2-NZ 3.2Å; D211-F215 PolarHBondContact O-N 3.14Å
212	E	80.3	Confident	75.6	Confident	60 Å²	60	57.7 Å²	57.7	28%	0.28	27%	0.27	S	S	.	.	H	α-helix	trans	-55.7	-35.7	-173.6	-63.2	82.6	-179.8	0	0	111.2	D168 T210 K214 F215 I216 M250 L254	D168-E212 HydrophobicContact CB-CB 4.19Å; T210-E212 PolarHBondContact O-N 3.25Å; E212-K214 VanDerWaalsContact C-N 3.27Å; E212-K214 PolarHBondContact O-N 3Å; E212-F215 PolarHBondContact O-N 3.48Å; E212-I216 HydrophobicContact CB-CD1 4.49Å; E212-I216 WeakPolarHBondContact O-CB 3.4Å; E212-I216 WeakPolarHBondContact O-CD1 3.49Å; E212-I216 WeakPolarHBondContact O-CG1 3.37Å; E212-I216 PolarHBondContact O-N 3.35Å; E212-M250 HydrophobicContact CG-CE 4.26Å; E212-L254 HydrophobicContact CB-CD2 4Å; E212-L254 HydrophobicContact CG-CD2 3.79Å
213	S	82.6	Confident	76.1	Confident	56 Å²	56	53.1 Å²	53.1	39%	0.392	25%	0.251	S	S	.	.	H	α-helix	trans	-61	-34.7	179.6	-66.6	0	0	0	0	112.6	D211 E217	D211-S213 PolarHBondContact O-N 3.23Å; D211-S213 VanDerWaalsContact O-N 3.16Å; S213-E217 WeakPolarHBondContact O-CB 3.4Å; S213-E217 PolarHBondContact O-N 3.41Å
214	K	83.3	Confident	77.1	Confident	70 Å²	70	54.2 Å²	54.2	30%	0.304	26%	0.255	S	S	.	.	H	α-helix	trans	-72.5	-39.9	176	-80.5	178.5	-178	142.4	0	113.2	T199 A203 D211 E212 I216 E217 I218	T199-K214 HydrophobicContact CG2-CB 3.62Å; T199-K214 HydrophobicContact CG2-CD 3.98Å; T199-K214 HydrophobicContact CG2-CG 3.99Å; A203-K214 HydrophobicContact CB-CD 3.94Å; D211-K214 HydrophobicContact CB-CB 4.34Å; D211-K214 HydrophobicContact CB-CD 4.05Å; D211-K214 HydrophobicContact CB-CG 4.38Å; D211-K214 WeakPolarHBondContact O-CB 3.24Å; D211-K214 PolarHBondContact O-N 3.28Å; D211-K214 WeakPolarHBondContact OD2-CD 3.39Å; D211-K214 WeakPolarHBondContact OD2-CE 3.23Å; D211-K214 IonicContact OD2-NZ 2.73Å; D211-K214 PolarHBondContact OD2-NZ 3.2Å; E212-K214 VanDerWaalsContact C-N 3.27Å; E212-K214 PolarHBondContact O-N 3Å; K214-I216 VanDerWaalsContact C-N 3.34Å; K214-E217 PolarHBondContact O-N 3.07Å; K214-I218 PolarHBondContact O-N 3.24Å
215	F	86.4	Confident	78.2	Confident	5 Å²	5	55.4 Å²	55.4	2%	0.022	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-49.8	173.4	-85.8	-113	0	0	0	109.6	L200 T210 D211 E212 E217 I218 L219 L242 I246 M250 L258	L200-F215 HydrophobicContact CB-CZ 4.29Å; L200-F215 HydrophobicContact CD2-CD1 3.71Å; L200-F215 HydrophobicContact CD2-CD2 4.01Å; L200-F215 HydrophobicContact CD2-CE1 3.77Å; L200-F215 HydrophobicContact CD2-CE2 4.05Å; L200-F215 HydrophobicContact CD2-CG 3.83Å; L200-F215 HydrophobicContact CD2-CZ 3.93Å; L200-F215 WeakPolarHBondContact O-CZ 3.21Å; T210-F215 HydrophobicContact CG2-CD2 3.66Å; T210-F215 HydrophobicContact CG2-CE2 3.54Å; T210-F215 HydrophobicContact CG2-CG 4.42Å; T210-F215 HydrophobicContact CG2-CZ 4.19Å; D211-F215 PolarHBondContact O-N 3.14Å; E212-F215 PolarHBondContact O-N 3.48Å; F215-E217 PolarHBondContact O-N 3.18Å; F215-I218 PolarHBondContact O-N 2.69Å; F215-L219 HydrophobicContact CB-CD1 4.29Å; F215-L219 HydrophobicContact CD1-CD1 4.08Å; F215-L219 VanDerWaalsContact O-CB 3.25Å; F215-L219 WeakPolarHBondContact O-CB 3.38Å; F215-L219 WeakPolarHBondContact O-CG 3.39Å; F215-L219 PolarHBondContact O-N 3.11Å; F215-L242 HydrophobicContact CE1-CD1 3.87Å; F215-I246 HydrophobicContact CD1-CG1 4.31Å; F215-I246 HydrophobicContact CE1-CG1 4.24Å; F215-M250 HydrophobicContact CB-CE 3.99Å; F215-M250 HydrophobicContact CD1-CE 3.82Å; F215-M250 HydrophobicContact CD2-CE 4.18Å; F215-M250 HydrophobicContact CE1-CE 4.34Å; F215-M250 HydrophobicContact CG-CE 3.73Å; F215-L258 HydrophobicContact CB-CD1 4.32Å
216	I	88.6	Confident	79.5	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-56.5	-47	178.2	-69.2	169.8	0	0	0	111.6	D168 K171 A172 L175 E212 K214 I218 C220 L254 L258	D168-I216 HydrophobicContact CB-CD1 3.93Å; D168-I216 WeakPolarHBondContact O-CD1 3.43Å; K171-I216 HydrophobicContact CB-CD1 4.44Å; A172-I216 HydrophobicContact CB-CD1 4.01Å; A172-I216 HydrophobicContact CB-CG1 3.89Å; A172-I216 HydrophobicContact CB-CG2 4.01Å; L175-I216 HydrophobicContact CD1-CG2 3.37Å; E212-I216 HydrophobicContact CB-CD1 4.49Å; E212-I216 WeakPolarHBondContact O-CB 3.4Å; E212-I216 WeakPolarHBondContact O-CD1 3.49Å; E212-I216 WeakPolarHBondContact O-CG1 3.37Å; E212-I216 PolarHBondContact O-N 3.35Å; K214-I216 VanDerWaalsContact C-N 3.34Å; I216-I218 PolarHBondContact O-N 3.35Å; I216-C220 WeakPolarHBondContact O-CB 3.4Å; I216-C220 PolarHBondContact O-N 2.94Å; I216-L254 HydrophobicContact CD1-CD1 3.95Å; I216-L254 HydrophobicContact CG1-CD1 4.17Å; I216-L258 HydrophobicContact CG1-CD2 4.32Å
217	E	86.2	Confident	81.1	Confident	97 Å²	97	47.7 Å²	47.7	45%	0.453	23%	0.229	S	C	.	.	H	α-helix	trans	-60.4	-43.3	-178.5	-171.5	-176.5	175.3	0	0	112.6	S213 K214 F215 K221	S213-E217 WeakPolarHBondContact O-CB 3.4Å; S213-E217 PolarHBondContact O-N 3.41Å; K214-E217 PolarHBondContact O-N 3.07Å; F215-E217 PolarHBondContact O-N 3.18Å; E217-K221 HydrophobicContact CG-CD 4.16Å; E217-K221 VanDerWaalsContact O-CB 3.23Å; E217-K221 WeakPolarHBondContact O-CB 3.15Å; E217-K221 WeakPolarHBondContact O-CG 3.37Å; E217-K221 PolarHBondContact O-N 3.36Å
218	I	88.3	Confident	82.6	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-71.4	-55	178.5	-68.2	176	0	0	0	110	D195 T199 L200 K214 F215 I216 C220 K221 R222 L227	D195-I218 HydrophobicContact CB-CD1 3.8Å; T199-I218 HydrophobicContact CG2-CD1 3.25Å; T199-I218 HydrophobicContact CG2-CG1 4.21Å; L200-I218 HydrophobicContact CD2-CD1 4.26Å; L200-I218 HydrophobicContact CG-CD1 4.2Å; K214-I218 PolarHBondContact O-N 3.24Å; F215-I218 PolarHBondContact O-N 2.69Å; I216-I218 PolarHBondContact O-N 3.35Å; I218-C220 VanDerWaalsContact C-N 3.35Å; I218-C220 PolarHBondContact O-N 3.26Å; I218-K221 PolarHBondContact O-N 3.31Å; I218-R222 HydrophobicContact CG2-CG 3.98Å; I218-R222 WeakPolarHBondContact O-CB 3.21Å; I218-R222 VanDerWaalsContact O-CG 3.26Å; I218-R222 WeakPolarHBondContact O-CG 3.41Å; I218-R222 PolarHBondContact O-N 3.33Å; I218-L227 HydrophobicContact CG2-CD2 3.94Å
219	L	88.9	Confident	84.9	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-70.4	-30.8	-167	-62	180	0	0	0	112.7	R181 F215 L227 L242 I246 L258 V261 A262	R181-L219 VanDerWaalsContact CZ-O 3.29Å; R181-L219 PolarHBondContact NH1-O 2.96Å; R181-L219 PolarHBondContact NH2-O 3.4Å; F215-L219 HydrophobicContact CB-CD1 4.29Å; F215-L219 HydrophobicContact CD1-CD1 4.08Å; F215-L219 VanDerWaalsContact O-CB 3.25Å; F215-L219 WeakPolarHBondContact O-CB 3.38Å; F215-L219 WeakPolarHBondContact O-CG 3.39Å; F215-L219 PolarHBondContact O-N 3.11Å; L219-L227 HydrophobicContact CD2-CD2 3.93Å; L219-L227 WeakPolarHBondContact O-CD1 3.33Å; L219-L242 HydrophobicContact CD1-CD2 4.25Å; L219-L242 HydrophobicContact CD2-CD2 3.81Å; L219-I246 HydrophobicContact CD1-CD1 4.17Å; L219-L258 HydrophobicContact CB-CD2 4.27Å; L219-L258 HydrophobicContact CD1-CB 4.48Å; L219-L258 HydrophobicContact CD1-CD2 4.1Å; L219-V261 WeakPolarHBondContact O-CG1 3.32Å; L219-A262 HydrophobicContact CB-CB 4.11Å; L219-A262 HydrophobicContact CD1-CB 3.71Å; L219-A262 HydrophobicContact CD2-CB 3.6Å; L219-A262 HydrophobicContact CG-CB 3.97Å
220	C	90	Very high	86.6	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.014	14%	0.141	C	C	.	.	H	α-helix	trans	-88.4	-22.7	178.5	-62	0	0	0	0	113.6	L175 L176 R181 I216 I218	L175-C220 HydrophobicContact CB-CB 3.93Å; L175-C220 HydrophobicContact CD1-CB 4.26Å; L176-C220 HydrophobicContact CD2-CB 4.05Å; L176-C220 HydrophobicContact CG-CB 4.38Å; R181-C220 PolarHBondContact NH2-O 3.37Å; I216-C220 WeakPolarHBondContact O-CB 3.4Å; I216-C220 PolarHBondContact O-N 2.94Å; I218-C220 VanDerWaalsContact C-N 3.35Å; I218-C220 PolarHBondContact O-N 3.26Å
221	K	89.3	Confident	87.9	Confident	75 Å²	75	28.4 Å²	28.4	33%	0.326	14%	0.139	S	C	.	.	H	α-helix	trans	-108.4	-31.5	-173	-60.2	-176	174.6	178.4	0	115.7	D182 E217 I218	D182-K221 PolarHBondContact N-O 3.44Å; E217-K221 HydrophobicContact CG-CD 4.16Å; E217-K221 VanDerWaalsContact O-CB 3.23Å; E217-K221 WeakPolarHBondContact O-CB 3.15Å; E217-K221 WeakPolarHBondContact O-CG 3.37Å; E217-K221 PolarHBondContact O-N 3.36Å; I218-K221 PolarHBondContact O-N 3.31Å
222	R	91	Very high	88.6	Confident	57 Å²	57	27.2 Å²	27.2	22%	0.215	13%	0.133	C	C	.	.	S	Bend	trans	-67.2	149.5	-177.8	-66.4	-65.3	-173.5	-95.7	-9.7	111	R181 D195 I218 Q226 L227	R181-R222 VanDerWaalsContact CG-O 3.32Å; R181-R222 WeakPolarHBondContact CG-O 3.18Å; R181-R222 PolarHBondContact NH1-O 2.71Å; D195-R222 IonicContact OD1-NH2 2.67Å; D195-R222 PolarHBondContact OD1-NH2 2.87Å; D195-R222 VanDerWaalsContact OD1-NH2 3.13Å; D195-R222 IonicContact OD2-CZ 3.34Å; D195-R222 IonicContact OD2-NE 2.71Å; D195-R222 PolarHBondContact OD2-NE 3.3Å; D195-R222 IonicContact OD2-NH2 3.16Å; D195-R222 PolarHBondContact OD2-NH2 2.82Å; I218-R222 HydrophobicContact CG2-CG 3.98Å; I218-R222 WeakPolarHBondContact O-CB 3.21Å; I218-R222 VanDerWaalsContact O-CG 3.26Å; I218-R222 WeakPolarHBondContact O-CG 3.41Å; I218-R222 PolarHBondContact O-N 3.33Å; R222-Q226 HydrophobicContact CB-CG 4.37Å; R222-L227 HydrophobicContact CB-CD1 4.32Å; R222-L227 HydrophobicContact CB-CD2 3.66Å; R222-L227 HydrophobicContact CB-CG 3.63Å; R222-L227 HydrophobicContact CG-CD2 4.23Å
223	S	90.3	Very high	89.1	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.007	13%	0.126	C	C	.	.			trans	-64.3	155.3	175.9	69.4	0	0	0	0	111.1	D182 S184 Q226 L227	D182-S223 WeakPolarHBondContact O-CA 3.48Å; D182-S223 WeakPolarHBondContact O-CB 3.43Å; S184-S223 WeakPolarHBondContact O-CB 3.23Å; S184-S223 PolarHBondContact O-OG 2.95Å; S184-S223 VanDerWaalsContact O-OG 3.14Å; S223-Q226 PolarHBondContact O-N 3.39Å; S223-Q226 VanDerWaalsContact OG-CB 3.24Å; S223-Q226 WeakPolarHBondContact OG-CB 3.42Å; S223-Q226 PolarHBondContact OG-N 3.37Å; S223-L227 WeakPolarHBondContact O-CG 3.49Å; S223-L227 PolarHBondContact O-N 2.9Å
224	I	88.5	Confident	89.5	Confident	30 Å²	30	23 Å²	23	15%	0.154	11%	0.107	C	C	.	.	H	α-helix	trans	-58.2	-45.7	-179.4	-58.6	-62.2	0	0	0	111.3	Q226 L227 R228 V266	I224-Q226 PolarHBondContact O-N 3.35Å; I224-L227 PolarHBondContact O-N 3.41Å; I224-R228 WeakPolarHBondContact O-CG 3.28Å; I224-R228 PolarHBondContact O-N 3.37Å; I224-V266 HydrophobicContact CD1-CG2 3.61Å; I224-V266 HydrophobicContact CG2-CG1 4.36Å
225	P	89.9	Confident	89.7	Confident	24 Å²	24	23.2 Å²	23.2	16%	0.156	11%	0.108	C	C	.	.	H	α-helix	trans	-62.4	-42.1	176.4	-26	39.3	0	0	0	113	V187 L227 R228 Q229	V187-P225 HydrophobicContact CG2-CB 3.68Å; P225-L227 PolarHBondContact O-N 3.15Å; P225-R228 PolarHBondContact O-N 3Å; P225-Q229 PolarHBondContact O-N 2.69Å
226	Q	92.2	Very high	89.9	Confident	13 Å²	13	28.5 Å²	28.5	6%	0.061	14%	0.137	C	C	.	.	H	α-helix	trans	-61.8	-43.5	176.5	-176.2	64.9	38.3	0	0	111.5	D188 A192 R222 S223 I224 Q229 T230	D188-Q226 PolarHBondContact O-NE2 3.3Å; A192-Q226 VanDerWaalsContact N-NE2 3.16Å; R222-Q226 HydrophobicContact CB-CG 4.37Å; S223-Q226 PolarHBondContact O-N 3.39Å; S223-Q226 VanDerWaalsContact OG-CB 3.24Å; S223-Q226 WeakPolarHBondContact OG-CB 3.42Å; S223-Q226 PolarHBondContact OG-N 3.37Å; I224-Q226 PolarHBondContact O-N 3.35Å; Q226-Q229 PolarHBondContact O-N 2.73Å; Q226-T230 PolarHBondContact O-N 3.38Å; Q226-T230 PolarHBondContact O-OG1 2.62Å; Q226-T230 VanDerWaalsContact O-OG1 3.07Å
227	L	91	Very high	90	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-62.8	-43	177.2	-77.7	177.8	0	0	0	112.1	I218 L219 R222 S223 I224 P225 Q229 T230 L231 V266	I218-L227 HydrophobicContact CG2-CD2 3.94Å; L219-L227 HydrophobicContact CD2-CD2 3.93Å; L219-L227 WeakPolarHBondContact O-CD1 3.33Å; R222-L227 HydrophobicContact CB-CD1 4.32Å; R222-L227 HydrophobicContact CB-CD2 3.66Å; R222-L227 HydrophobicContact CB-CG 3.63Å; R222-L227 HydrophobicContact CG-CD2 4.23Å; S223-L227 WeakPolarHBondContact O-CG 3.49Å; S223-L227 PolarHBondContact O-N 2.9Å; I224-L227 PolarHBondContact O-N 3.41Å; P225-L227 PolarHBondContact O-N 3.15Å; L227-Q229 VanDerWaalsContact C-N 3.28Å; L227-Q229 PolarHBondContact O-N 2.82Å; L227-T230 CarbonylContact O-C 3.32Å; L227-T230 WeakPolarHBondContact O-CA 3.32Å; L227-T230 WeakPolarHBondContact O-CB 3.27Å; L227-T230 PolarHBondContact O-N 3.21Å; L227-L231 WeakPolarHBondContact O-CG 3.28Å; L227-L231 PolarHBondContact O-N 3.19Å; L227-V266 HydrophobicContact CB-CG1 4.13Å; L227-V266 HydrophobicContact CB-CG2 4.21Å; L227-V266 HydrophobicContact CD1-CG2 3.81Å
228	R	90.6	Very high	90	Very high	13 Å²	13	27 Å²	27	5%	0.049	13%	0.133	C	C	.	.	H	α-helix	trans	-55.1	-46	175.8	-73	172.9	171.3	-174	-5.4	111.2	L11 S14 P15 I224 P225 L231 V232 V266 K267	L11-R228 HydrophobicContact CD2-CG 3.97Å; L11-R228 WeakPolarHBondContact O-CD 3.34Å; S14-R228 PolarHBondContact O-NH1 2.98Å; P15-R228 PolarHBondContact O-NH1 2.98Å; I224-R228 WeakPolarHBondContact O-CG 3.28Å; I224-R228 PolarHBondContact O-N 3.37Å; P225-R228 PolarHBondContact O-N 3Å; R228-L231 PolarHBondContact O-N 2.8Å; R228-V232 PolarHBondContact O-N 3.49Å; R228-V266 HydrophobicContact CG-CG1 3.58Å; R228-V266 PolarHBondContact NE-O 3.27Å; R228-V266 PolarHBondContact NH2-O 3.46Å; R228-V266 VanDerWaalsContact NH2-O 3.11Å; R228-K267 PolarHBondContact NH2-O 2.92Å
229	Q	91.8	Very high	90	Very high	25 Å²	25	29.9 Å²	29.9	12%	0.117	16%	0.164	C	C	.	.	H	α-helix	trans	-62.6	-44.5	174.5	-170.9	63.7	34.1	0	0	111.6	V187 V189 A192 P225 Q226 L227 L231 V232 E233	V187-Q229 HydrophobicContact CG1-CB 3.59Å; V187-Q229 HydrophobicContact CG1-CG 3.79Å; V189-Q229 HydrophobicContact CG2-CG 4.39Å; A192-Q229 HydrophobicContact CB-CB 3.85Å; A192-Q229 HydrophobicContact CB-CG 3.47Å; A192-Q229 VanDerWaalsContact CB-CG 3.47Å; P225-Q229 PolarHBondContact O-N 2.69Å; Q226-Q229 PolarHBondContact O-N 2.73Å; L227-Q229 VanDerWaalsContact C-N 3.28Å; L227-Q229 PolarHBondContact O-N 2.82Å; Q229-L231 VanDerWaalsContact C-N 3.29Å; Q229-L231 PolarHBondContact O-N 2.95Å; Q229-V232 PolarHBondContact O-N 2.96Å; Q229-V232 VanDerWaalsContact O-N 3.16Å; Q229-E233 HydrophobicContact CG-CG 4.4Å; Q229-E233 PolarHBondContact NE2-OE1 3.15Å; Q229-E233 WeakPolarHBondContact O-CG 3.41Å; Q229-E233 PolarHBondContact O-N 3.3Å
230	T	91.7	Very high	89.9	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-58.5	-38.8	177.3	-58.9	0	0	0	0	112.2	A192 D195 A196 L200 Q226 L227 Y234	A192-T230 WeakPolarHBondContact CA-OG1 3.49Å; D195-T230 HydrophobicContact CB-CG2 4.02Å; A196-T230 HydrophobicContact CB-CG2 4.21Å; L200-T230 HydrophobicContact CD1-CG2 3.8Å; Q226-T230 PolarHBondContact O-N 3.38Å; Q226-T230 PolarHBondContact O-OG1 2.62Å; Q226-T230 VanDerWaalsContact O-OG1 3.07Å; L227-T230 CarbonylContact O-C 3.32Å; L227-T230 WeakPolarHBondContact O-CA 3.32Å; L227-T230 WeakPolarHBondContact O-CB 3.27Å; L227-T230 PolarHBondContact O-N 3.21Å; T230-Y234 VanDerWaalsContact O-CB 3.28Å; T230-Y234 WeakPolarHBondContact O-CB 3.39Å; T230-Y234 PolarHBondContact O-N 2.87Å
231	L	89.3	Confident	89.8	Confident	6 Å²	6	34.5 Å²	34.5	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-65.2	-39.4	176.9	-63.3	178.6	0	0	0	112.4	L8 L227 R228 Q229 Y234 K235 L242 A262 V266	L8-L231 HydrophobicContact CD2-CB 3.6Å; L227-L231 WeakPolarHBondContact O-CG 3.28Å; L227-L231 PolarHBondContact O-N 3.19Å; R228-L231 PolarHBondContact O-N 2.8Å; Q229-L231 VanDerWaalsContact C-N 3.29Å; Q229-L231 PolarHBondContact O-N 2.95Å; L231-Y234 PolarHBondContact O-N 2.95Å; L231-K235 PolarHBondContact O-N 3.46Å; L231-K235 VanDerWaalsContact O-N 3.11Å; L231-L242 HydrophobicContact CD2-CB 3.69Å; L231-L242 HydrophobicContact CD2-CD2 3.37Å; L231-L242 HydrophobicContact CD2-CG 4.16Å; L231-A262 WeakPolarHBondContact CD1-O 3.26Å; L231-V266 HydrophobicContact CD1-CG1 4.04Å
232	V	89.8	Confident	89.5	Confident	25 Å²	25	31.2 Å²	31.2	15%	0.152	17%	0.17	C	C	.	.	H	α-helix	trans	-65.7	-49.8	176.6	171.6	0	0	0	0	110.4	L8 V12 R228 Q229 Y234 K235 N236	L8-V232 HydrophobicContact CB-CG2 4.47Å; L8-V232 HydrophobicContact CD2-CG2 3.92Å; V12-V232 HydrophobicContact CG2-CG2 3.7Å; R228-V232 PolarHBondContact O-N 3.49Å; Q229-V232 PolarHBondContact O-N 2.96Å; Q229-V232 VanDerWaalsContact O-N 3.16Å; V232-Y234 VanDerWaalsContact C-N 3.26Å; V232-Y234 PolarHBondContact O-N 3.3Å; V232-K235 PolarHBondContact O-N 2.77Å; V232-N236 VanDerWaalsContact O-CG 3.27Å; V232-N236 PolarHBondContact O-N 2.82Å; V232-N236 PolarHBondContact O-ND2 3.17Å
233	E	91.8	Very high	89.3	Confident	28 Å²	28	29.3 Å²	29.3	13%	0.131	16%	0.164	C	C	.	.	H	α-helix	trans	-59.4	-39.7	176.2	-64.7	-59.1	157.3	0	0	111.5	A192 R193 A196 Q229 N236 I237	A192-E233 HydrophobicContact CB-CG 4.21Å; R193-E233 HydrophobicContact CB-CG 4.19Å; A196-E233 HydrophobicContact CB-CB 3.81Å; Q229-E233 HydrophobicContact CG-CG 4.4Å; Q229-E233 PolarHBondContact NE2-OE1 3.15Å; Q229-E233 WeakPolarHBondContact O-CG 3.41Å; Q229-E233 PolarHBondContact O-N 3.3Å; E233-N236 PolarHBondContact O-N 2.94Å; E233-I237 WeakPolarHBondContact O-CD1 3.43Å; E233-I237 VanDerWaalsContact O-CG1 3.25Å; E233-I237 WeakPolarHBondContact O-CG1 3.33Å; E233-I237 PolarHBondContact O-N 2.93Å
234	Y	89.9	Confident	89.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-58.5	-51	176.6	-173.6	-93.3	0	0	0	111.7	L200 T230 L231 V232 N236 I237 S238 L242 S245	L200-Y234 HydrophobicContact CB-CD2 3.62Å; L200-Y234 HydrophobicContact CB-CE2 3.53Å; L200-Y234 HydrophobicContact CD1-CD2 4.23Å; T230-Y234 VanDerWaalsContact O-CB 3.28Å; T230-Y234 WeakPolarHBondContact O-CB 3.39Å; T230-Y234 PolarHBondContact O-N 2.87Å; L231-Y234 PolarHBondContact O-N 2.95Å; V232-Y234 VanDerWaalsContact C-N 3.26Å; V232-Y234 PolarHBondContact O-N 3.3Å; Y234-N236 VanDerWaalsContact C-N 3.28Å; Y234-N236 PolarHBondContact O-N 3.01Å; Y234-I237 PolarHBondContact O-N 3.4Å; Y234-I237 VanDerWaalsContact O-N 3.09Å; Y234-S238 WeakPolarHBondContact CD1-OG 3.45Å; Y234-S238 VanDerWaalsContact CE1-OG 3.28Å; Y234-S238 WeakPolarHBondContact CE1-OG 3.28Å; Y234-S238 WeakPolarHBondContact O-CB 3.35Å; Y234-S238 PolarHBondContact O-N 3.23Å; Y234-S238 PolarHBondContact O-OG 2.89Å; Y234-L242 HydrophobicContact CD1-CB 4.03Å; Y234-L242 HydrophobicContact CD1-CD1 4.12Å; Y234-L242 HydrophobicContact CD2-CD1 4.18Å; Y234-L242 HydrophobicContact CE1-CB 4.27Å; Y234-L242 HydrophobicContact CE1-CD1 3.9Å; Y234-L242 HydrophobicContact CE2-CD1 3.96Å; Y234-L242 HydrophobicContact CG-CD1 4.24Å; Y234-S245 WeakPolarHBondContact OH-CB 3.33Å; Y234-S245 PolarHBondContact OH-OG 3.43Å
235	K	89.3	Confident	88.9	Confident	74 Å²	74	32 Å²	32	32%	0.322	18%	0.176	S	C	.	.	H	α-helix	trans	-60	-39	177.7	-177.5	171.2	178.5	-178.6	0	112	D6 L8 L231 V232 I237 G239 K240 T241	D6-K235 PolarHBondContact O-NZ 3.05Å; L8-K235 HydrophobicContact CB-CD 4.36Å; L8-K235 HydrophobicContact CD1-CB 4.15Å; L8-K235 HydrophobicContact CD1-CD 3.35Å; L8-K235 HydrophobicContact CD1-CG 4.36Å; L8-K235 HydrophobicContact CG-CD 4.44Å; L231-K235 PolarHBondContact O-N 3.46Å; L231-K235 VanDerWaalsContact O-N 3.11Å; V232-K235 PolarHBondContact O-N 2.77Å; K235-I237 VanDerWaalsContact C-N 3.29Å; K235-I237 PolarHBondContact O-N 3.21Å; K235-G239 WeakPolarHBondContact O-CA 3.23Å; K235-G239 PolarHBondContact O-N 3.21Å; K235-K240 WeakPolarHBondContact CA-O 3.31Å; K235-T241 HydrophobicContact CD-CG2 4.28Å
236	N	90.4	Very high	88.7	Confident	116 Å²	116	30.9 Å²	30.9	62%	0.62	17%	0.168	S	C	*	.	H	α-helix	trans	-64.4	-33.2	177.2	-67.8	-20	0	0	0	112.8	V232 E233 Y234	V232-N236 VanDerWaalsContact O-CG 3.27Å; V232-N236 PolarHBondContact O-N 2.82Å; V232-N236 PolarHBondContact O-ND2 3.17Å; E233-N236 PolarHBondContact O-N 2.94Å; Y234-N236 VanDerWaalsContact C-N 3.28Å; Y234-N236 PolarHBondContact O-N 3.01Å
237	I	89.9	Confident	88.4	Confident	49 Å²	49	34.6 Å²	34.6	25%	0.251	19%	0.186	S	C	.	.	H	α-helix	trans	-87	-47.7	-177.5	-67.1	159.8	0	0	0	112	R193 A196 E197 Y201 E233 Y234 K235	R193-I237 HydrophobicContact CG-CD1 4.3Å; A196-I237 HydrophobicContact CB-CD1 3.96Å; E197-I237 HydrophobicContact CB-CD1 3.77Å; E197-I237 HydrophobicContact CG-CD1 4.31Å; E197-I237 HydrophobicContact CG-CG2 4.35Å; Y201-I237 HydrophobicContact CD1-CG2 3.69Å; Y201-I237 HydrophobicContact CE1-CG2 4.13Å; Y201-I237 HydrophobicContact CG-CG2 4.09Å; E233-I237 WeakPolarHBondContact O-CD1 3.43Å; E233-I237 VanDerWaalsContact O-CG1 3.25Å; E233-I237 WeakPolarHBondContact O-CG1 3.33Å; E233-I237 PolarHBondContact O-N 2.93Å; Y234-I237 PolarHBondContact O-N 3.4Å; Y234-I237 VanDerWaalsContact O-N 3.09Å; K235-I237 VanDerWaalsContact C-N 3.29Å; K235-I237 PolarHBondContact O-N 3.21Å
238	S	87.3	Confident	88	Confident	21 Å²	21	37.3 Å²	37.3	15%	0.147	22%	0.215	C	C	.	.	H	α-helix	trans	-88.7	-23.9	-171.9	70.7	0	0	0	0	113.1	Y201 Y234 K240	Y201-S238 VanDerWaalsContact CD2-CB 3.44Å; Y234-S238 WeakPolarHBondContact CD1-OG 3.45Å; Y234-S238 VanDerWaalsContact CE1-OG 3.28Å; Y234-S238 WeakPolarHBondContact CE1-OG 3.28Å; Y234-S238 WeakPolarHBondContact O-CB 3.35Å; Y234-S238 PolarHBondContact O-N 3.23Å; Y234-S238 PolarHBondContact O-OG 2.89Å; S238-K240 PolarHBondContact O-N 3.25Å; S238-K240 PolarHBondContact OG-N 2.97Å; S238-K240 VanDerWaalsContact OG-N 3.08Å; S238-K240 PolarHBondContact OG-O 3.28Å
239	G	87.5	Confident	87.6	Confident	65 Å²	65	40.7 Å²	40.7	67%	0.67	23%	0.231	S	C	*	.	S	Bend	trans	75.7	1.1	-170.1	0	0	0	0	0	114.2	K235	K235-G239 WeakPolarHBondContact O-CA 3.23Å; K235-G239 PolarHBondContact O-N 3.21Å
240	K	86.8	Confident	87.3	Confident	94 Å²	94	40.3 Å²	40.3	41%	0.409	23%	0.229	S	C	.	.	S	Bend	trans	-121	156.8	178.3	-65.6	-179	-171.2	169	0	111.3	E205 K235 S238	E205-K240 WeakPolarHBondContact OE1-CD 3.41Å; E205-K240 IonicContact OE1-NZ 3.13Å; E205-K240 PolarHBondContact OE1-NZ 3.44Å; E205-K240 VanDerWaalsContact OE1-NZ 3.13Å; K235-K240 WeakPolarHBondContact CA-O 3.31Å; S238-K240 PolarHBondContact O-N 3.25Å; S238-K240 PolarHBondContact OG-N 2.97Å; S238-K240 VanDerWaalsContact OG-N 3.08Å; S238-K240 PolarHBondContact OG-O 3.28Å
241	T	86.7	Confident	86.9	Confident	6 Å²	6	45 Å²	45	4%	0.037	26%	0.262	C	S	.	.			trans	-74.8	150.2	169.5	69.3	0	0	0	0	110.1	D6 L8 K235 Q243 Q244 S245	D6-T241 HydrophobicContact CB-CG2 4.3Å; D6-T241 WeakPolarHBondContact OD1-CG2 3.38Å; D6-T241 PolarHBondContact OD1-OG1 3.35Å; L8-T241 HydrophobicContact CD1-CG2 4.06Å; K235-T241 HydrophobicContact CD-CG2 4.28Å; T241-Q243 PolarHBondContact O-N 3.42Å; T241-Q244 WeakPolarHBondContact O-CB 3.34Å; T241-Q244 PolarHBondContact O-N 3.46Å; T241-Q244 VanDerWaalsContact O-N 3.14Å; T241-Q244 VanDerWaalsContact OG1-CG 3.24Å; T241-Q244 WeakPolarHBondContact OG1-CG 3.37Å; T241-Q244 PolarHBondContact OG1-N 3.17Å; T241-Q244 PolarHBondContact OG1-OE1 2.9Å; T241-S245 PolarHBondContact O-N 3.36Å; T241-S245 PolarHBondContact O-OG 3.5Å
242	L	84.4	Confident	86.9	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-60.5	-31.3	177.5	-172.3	65.6	0	0	0	111.6	L200 F215 L219 L231 Y234 S245 I246 A262	L200-L242 HydrophobicContact CB-CD1 4.43Å; L200-L242 HydrophobicContact CD1-CD1 4.09Å; L200-L242 HydrophobicContact CD1-CD2 4.16Å; F215-L242 HydrophobicContact CE1-CD1 3.87Å; L219-L242 HydrophobicContact CD1-CD2 4.25Å; L219-L242 HydrophobicContact CD2-CD2 3.81Å; L231-L242 HydrophobicContact CD2-CB 3.69Å; L231-L242 HydrophobicContact CD2-CD2 3.37Å; L231-L242 HydrophobicContact CD2-CG 4.16Å; Y234-L242 HydrophobicContact CD1-CB 4.03Å; Y234-L242 HydrophobicContact CD1-CD1 4.12Å; Y234-L242 HydrophobicContact CD2-CD1 4.18Å; Y234-L242 HydrophobicContact CE1-CB 4.27Å; Y234-L242 HydrophobicContact CE1-CD1 3.9Å; Y234-L242 HydrophobicContact CE2-CD1 3.96Å; Y234-L242 HydrophobicContact CG-CD1 4.24Å; L242-S245 PolarHBondContact O-N 2.74Å; L242-I246 HydrophobicContact CD2-CD1 4.25Å; L242-I246 HydrophobicContact CG-CD1 3.9Å; L242-I246 HydrophobicContact CG-CG1 4.33Å; L242-I246 WeakPolarHBondContact O-CG1 3.45Å; L242-I246 PolarHBondContact O-N 3.34Å; L242-A262 HydrophobicContact CD2-CB 4.46Å
243	Q	85.6	Confident	86.9	Confident	17 Å²	17	49.5 Å²	49.5	8%	0.079	29%	0.291	C	S	.	.	H	α-helix	trans	-58.5	-52.4	173.7	-174.2	175.2	-9.8	0	0	111.4	T241 S245 I246 E247 V259 V263	T241-Q243 PolarHBondContact O-N 3.42Å; Q243-S245 PolarHBondContact O-N 2.85Å; Q243-I246 PolarHBondContact O-N 3.46Å; Q243-E247 HydrophobicContact CG-CG 4.12Å; Q243-E247 WeakPolarHBondContact CG-OE1 3.17Å; Q243-E247 PolarHBondContact NE2-OE1 3.35Å; Q243-E247 WeakPolarHBondContact O-CB 3.38Å; Q243-E247 WeakPolarHBondContact O-CG 3.5Å; Q243-E247 PolarHBondContact O-N 3.41Å; Q243-V259 HydrophobicContact CG-CG1 4.34Å; Q243-V259 HydrophobicContact CG-CG2 4.38Å; Q243-V263 HydrophobicContact CB-CG1 4.1Å; Q243-V263 HydrophobicContact CB-CG2 3.85Å; Q243-V263 HydrophobicContact CG-CG1 4.49Å; Q243-V263 HydrophobicContact CG-CG2 4.42Å
244	Q	85.9	Confident	86.8	Confident	85 Å²	85	49 Å²	49	40%	0.397	29%	0.289	S	S	.	.	H	α-helix	trans	-57.5	-35.6	178.7	-71.5	166.4	-16.1	0	0	112.2	T241 G248	T241-Q244 WeakPolarHBondContact O-CB 3.34Å; T241-Q244 PolarHBondContact O-N 3.46Å; T241-Q244 VanDerWaalsContact O-N 3.14Å; T241-Q244 VanDerWaalsContact OG1-CG 3.24Å; T241-Q244 WeakPolarHBondContact OG1-CG 3.37Å; T241-Q244 PolarHBondContact OG1-N 3.17Å; T241-Q244 PolarHBondContact OG1-OE1 2.9Å; Q244-G248 PolarHBondContact O-N 3.18Å
245	S	85.6	Confident	86.9	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-73.5	-37.8	176.9	-57.9	0	0	0	0	112.4	E205 Y234 T241 L242 Q243 E249	E205-S245 WeakPolarHBondContact OE1-CB 3.38Å; E205-S245 PolarHBondContact OE1-OG 2.9Å; Y234-S245 WeakPolarHBondContact OH-CB 3.33Å; Y234-S245 PolarHBondContact OH-OG 3.43Å; T241-S245 PolarHBondContact O-N 3.36Å; T241-S245 PolarHBondContact O-OG 3.5Å; L242-S245 PolarHBondContact O-N 2.74Å; Q243-S245 PolarHBondContact O-N 2.85Å; S245-E249 VanDerWaalsContact O-CB 3.3Å; S245-E249 WeakPolarHBondContact O-CB 3.36Å; S245-E249 VanDerWaalsContact O-CG 3.22Å; S245-E249 WeakPolarHBondContact O-CG 3.22Å; S245-E249 PolarHBondContact O-N 3.28Å
246	I	84.6	Confident	87	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-66.9	-49.4	174.7	-68.7	164.5	0	0	0	110.4	F215 L219 L242 Q243 G248 E249 M250 E255 L258 V259	F215-I246 HydrophobicContact CD1-CG1 4.31Å; F215-I246 HydrophobicContact CE1-CG1 4.24Å; L219-I246 HydrophobicContact CD1-CD1 4.17Å; L242-I246 HydrophobicContact CD2-CD1 4.25Å; L242-I246 HydrophobicContact CG-CD1 3.9Å; L242-I246 HydrophobicContact CG-CG1 4.33Å; L242-I246 WeakPolarHBondContact O-CG1 3.45Å; L242-I246 PolarHBondContact O-N 3.34Å; Q243-I246 PolarHBondContact O-N 3.46Å; I246-G248 PolarHBondContact O-N 2.92Å; I246-E249 PolarHBondContact O-N 2.94Å; I246-M250 HydrophobicContact CG2-CB 4.43Å; I246-M250 HydrophobicContact CG2-SD 4.22Å; I246-M250 WeakPolarHBondContact O-CB 3.4Å; I246-M250 PolarHBondContact O-N 2.88Å; I246-E255 HydrophobicContact CG2-CB 4.49Å; I246-E255 HydrophobicContact CG2-CG 3.88Å; I246-L258 HydrophobicContact CD1-CB 4.19Å; I246-L258 HydrophobicContact CG2-CB 4.33Å; I246-V259 HydrophobicContact CB-CG2 4.32Å; I246-V259 HydrophobicContact CG2-CG2 3.81Å
247	E	86.3	Confident	87.1	Confident	91 Å²	91	47.4 Å²	47.4	43%	0.425	28%	0.278	S	S	.	.	H	α-helix	trans	-65.4	-24	179.9	-65.1	176.6	166.8	0	0	112.7	Q243 E255 V259	Q243-E247 HydrophobicContact CG-CG 4.12Å; Q243-E247 WeakPolarHBondContact CG-OE1 3.17Å; Q243-E247 PolarHBondContact NE2-OE1 3.35Å; Q243-E247 WeakPolarHBondContact O-CB 3.38Å; Q243-E247 WeakPolarHBondContact O-CG 3.5Å; Q243-E247 PolarHBondContact O-N 3.41Å; E247-E255 WeakPolarHBondContact CG-OE1 3.32Å; E247-V259 HydrophobicContact CG-CG2 4.28Å
248	G	83.9	Confident	87	Confident	60 Å²	60	45 Å²	45	62%	0.619	27%	0.267	S	S	*	.	H	α-helix	trans	-84.8	-26.5	177.1	0	0	0	0	0	114.4	Q244 I246	Q244-G248 PolarHBondContact O-N 3.18Å; I246-G248 PolarHBondContact O-N 2.92Å
249	E	81.8	Confident	87.1	Confident	84 Å²	84	44.5 Å²	44.5	39%	0.393	26%	0.262	S	S	.	.	H	α-helix	trans	-113.8	-22.1	-170.1	-63.9	-66.1	146.6	0	0	113.8	T210 S245 I246	T210-E249 WeakPolarHBondContact OG1-CB 3.25Å; S245-E249 VanDerWaalsContact O-CB 3.3Å; S245-E249 WeakPolarHBondContact O-CB 3.36Å; S245-E249 VanDerWaalsContact O-CG 3.22Å; S245-E249 WeakPolarHBondContact O-CG 3.22Å; S245-E249 PolarHBondContact O-N 3.28Å; I246-E249 PolarHBondContact O-N 2.94Å
250	M	84.2	Confident	87.1	Confident	16 Å²	16	41.6 Å²	41.6	8%	0.079	23%	0.232	C	C	.	.			trans	-118.3	164.2	-177.9	-56.5	-175.3	-176.4	0	0	110.3	T210 E212 F215 I246 L254 E255 L258	T210-M250 HydrophobicContact CG2-CE 3.46Å; T210-M250 VanDerWaalsContact CG2-CE 3.46Å; E212-M250 HydrophobicContact CG-CE 4.26Å; F215-M250 HydrophobicContact CB-CE 3.99Å; F215-M250 HydrophobicContact CD1-CE 3.82Å; F215-M250 HydrophobicContact CD2-CE 4.18Å; F215-M250 HydrophobicContact CE1-CE 4.34Å; F215-M250 HydrophobicContact CG-CE 3.73Å; I246-M250 HydrophobicContact CG2-CB 4.43Å; I246-M250 HydrophobicContact CG2-SD 4.22Å; I246-M250 WeakPolarHBondContact O-CB 3.4Å; I246-M250 PolarHBondContact O-N 2.88Å; M250-L254 HydrophobicContact SD-CD2 4.14Å; M250-L254 HydrophobicContact SD-CG 4.34Å; M250-E255 HydrophobicContact CB-CB 4.09Å; M250-E255 HydrophobicContact CB-CG 4.42Å; M250-L258 HydrophobicContact CE-CD1 4.08Å; M250-L258 HydrophobicContact SD-CD1 3.52Å; M250-L258 VanDerWaalsContact SD-CD1 3.52Å
251	S	84.3	Confident	86.8	Confident	99 Å²	99	37.3 Å²	37.3	69%	0.692	21%	0.213	S	C	*	.			trans	-147	163.1	174.5	59.8	0	0	0	0	111.5	E255	S251-E255 VanDerWaalsContact CA-OE2 3.29Å; S251-E255 WeakPolarHBondContact CA-OE2 3.4Å
252	G	89.3	Confident	86.1	Confident	34 Å²	34	37 Å²	37	35%	0.351	21%	0.212	S	C	.	.	H	α-helix	trans	73.4	-150	173.8	0	0	0	0	0	113.4	L254 E255 E256	G252-L254 VanDerWaalsContact C-N 3.28Å; G252-L254 PolarHBondContact O-N 2.97Å; G252-E255 WeakPolarHBondContact O-CB 3.49Å; G252-E255 PolarHBondContact O-N 2.78Å; G252-E255 VanDerWaalsContact O-N 3.16Å; G252-E256 PolarHBondContact O-N 3.33Å; G252-E256 VanDerWaalsContact O-N 3.13Å
253	E	90.1	Very high	85.6	Confident	93 Å²	93	37 Å²	37	44%	0.435	21%	0.212	S	C	.	.	H	α-helix	trans	-67.5	-29.6	-168.1	-56	78.3	-169.3	0	0	112.7	D127 F169 L257	D127-E253 HydrophobicContact CB-CG 4.05Å; F169-E253 HydrophobicContact CB-CB 4.31Å; F169-E253 HydrophobicContact CD1-CB 4.01Å; F169-E253 HydrophobicContact CD2-CB 3.71Å; F169-E253 WeakPolarHBondContact CD2-O 3.39Å; F169-E253 HydrophobicContact CE1-CB 4.23Å; F169-E253 HydrophobicContact CE2-CB 3.96Å; F169-E253 HydrophobicContact CG-CB 3.74Å; F169-E253 HydrophobicContact CZ-CB 4.22Å; E253-L257 VanDerWaalsContact O-CB 3.27Å; E253-L257 WeakPolarHBondContact O-CB 3.44Å; E253-L257 PolarHBondContact O-N 2.88Å
254	L	89.4	Confident	85.4	Confident	17 Å²	17	37.4 Å²	37.4	9%	0.089	21%	0.213	C	C	.	.	H	α-helix	trans	-67.6	-43.7	175.2	178.8	64.7	0	0	0	111.5	D168 F169 A172 E212 I216 M250 G252 L257 L258	D168-L254 HydrophobicContact CB-CD1 4.43Å; D168-L254 HydrophobicContact CB-CD2 3.71Å; F169-L254 HydrophobicContact CB-CB 4.36Å; A172-L254 HydrophobicContact CB-CD1 4.05Å; E212-L254 HydrophobicContact CB-CD2 4Å; E212-L254 HydrophobicContact CG-CD2 3.79Å; I216-L254 HydrophobicContact CD1-CD1 3.95Å; I216-L254 HydrophobicContact CG1-CD1 4.17Å; M250-L254 HydrophobicContact SD-CD2 4.14Å; M250-L254 HydrophobicContact SD-CG 4.34Å; G252-L254 VanDerWaalsContact C-N 3.28Å; G252-L254 PolarHBondContact O-N 2.97Å; L254-L257 PolarHBondContact O-N 3.08Å; L254-L258 HydrophobicContact CD1-CD1 3.84Å; L254-L258 HydrophobicContact CD1-CG 3.91Å; L254-L258 HydrophobicContact CG-CD1 3.98Å; L254-L258 HydrophobicContact CG-CG 4.34Å; L254-L258 WeakPolarHBondContact O-CB 3.46Å; L254-L258 VanDerWaalsContact O-CG 3.31Å; L254-L258 WeakPolarHBondContact O-CG 3.38Å; L254-L258 PolarHBondContact O-N 3.44Å
255	E	91.6	Very high	85.3	Confident	47 Å²	47	34 Å²	34	22%	0.22	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-51.3	176.4	-174.6	-155.5	149.1	0	0	109.6	I246 E247 M250 S251 G252 L257 L258 V259	I246-E255 HydrophobicContact CG2-CB 4.49Å; I246-E255 HydrophobicContact CG2-CG 3.88Å; E247-E255 WeakPolarHBondContact CG-OE1 3.32Å; M250-E255 HydrophobicContact CB-CB 4.09Å; M250-E255 HydrophobicContact CB-CG 4.42Å; S251-E255 VanDerWaalsContact CA-OE2 3.29Å; S251-E255 WeakPolarHBondContact CA-OE2 3.4Å; G252-E255 WeakPolarHBondContact O-CB 3.49Å; G252-E255 PolarHBondContact O-N 2.78Å; G252-E255 VanDerWaalsContact O-N 3.16Å; E255-L257 VanDerWaalsContact C-N 3.33Å; E255-L257 PolarHBondContact O-N 2.68Å; E255-L258 PolarHBondContact O-N 3.22Å; E255-V259 HydrophobicContact CG-CG2 4.5Å; E255-V259 WeakPolarHBondContact O-CB 3.33Å; E255-V259 WeakPolarHBondContact O-CG2 3.5Å; E255-V259 PolarHBondContact O-N 2.87Å
256	E	91.3	Very high	85	Confident	109 Å²	109	33.9 Å²	33.9	51%	0.509	20%	0.198	S	C	.	.	H	α-helix	trans	-57.5	-45.2	179.4	-68.8	-171.1	178	0	0	112.1	I131 G252 A260	I131-E256 HydrophobicContact CD1-CB 3.91Å; G252-E256 PolarHBondContact O-N 3.33Å; G252-E256 VanDerWaalsContact O-N 3.13Å; E256-A260 VanDerWaalsContact O-CB 3.25Å; E256-A260 WeakPolarHBondContact O-CB 3.43Å; E256-A260 PolarHBondContact O-N 2.87Å
257	L	91.9	Very high	84.9	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.2	-47.9	178.3	-179.9	60.4	0	0	0	112	I131 F169 A172 L173 L176 E253 L254 E255 A260 V261	I131-L257 HydrophobicContact CB-CD1 4.23Å; I131-L257 HydrophobicContact CD1-CB 4.29Å; I131-L257 HydrophobicContact CG1-CB 4.01Å; I131-L257 HydrophobicContact CG1-CD1 3.95Å; I131-L257 HydrophobicContact CG2-CD1 4.01Å; F169-L257 HydrophobicContact CD2-CB 4.17Å; F169-L257 HydrophobicContact CD2-CD2 3.8Å; F169-L257 HydrophobicContact CE2-CB 4.11Å; F169-L257 HydrophobicContact CE2-CD2 3.84Å; F169-L257 HydrophobicContact CE2-CG 4.48Å; A172-L257 HydrophobicContact CB-CD2 3.51Å; L173-L257 HydrophobicContact CB-CD2 4.24Å; L173-L257 HydrophobicContact CD1-CD1 4.39Å; L173-L257 HydrophobicContact CD1-CD2 4.33Å; L176-L257 HydrophobicContact CD1-CD1 3.67Å; L176-L257 HydrophobicContact CD1-CD2 4.29Å; L176-L257 HydrophobicContact CD1-CG 4.26Å; E253-L257 VanDerWaalsContact O-CB 3.27Å; E253-L257 WeakPolarHBondContact O-CB 3.44Å; E253-L257 PolarHBondContact O-N 2.88Å; L254-L257 PolarHBondContact O-N 3.08Å; E255-L257 VanDerWaalsContact C-N 3.33Å; E255-L257 PolarHBondContact O-N 2.68Å; L257-A260 PolarHBondContact O-N 2.82Å; L257-V261 HydrophobicContact CD1-CG2 3.87Å; L257-V261 HydrophobicContact CG-CG2 4.33Å; L257-V261 WeakPolarHBondContact O-CB 3.42Å; L257-V261 WeakPolarHBondContact O-CG2 3.38Å; L257-V261 PolarHBondContact O-N 3.18Å
258	L	89.2	Confident	84.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-68.3	-37.2	-177.9	-69.7	-178.8	0	0	0	111.5	F215 I216 L219 I246 M250 L254 E255 A262	F215-L258 HydrophobicContact CB-CD1 4.32Å; I216-L258 HydrophobicContact CG1-CD2 4.32Å; L219-L258 HydrophobicContact CB-CD2 4.27Å; L219-L258 HydrophobicContact CD1-CB 4.48Å; L219-L258 HydrophobicContact CD1-CD2 4.1Å; I246-L258 HydrophobicContact CD1-CB 4.19Å; I246-L258 HydrophobicContact CG2-CB 4.33Å; M250-L258 HydrophobicContact CE-CD1 4.08Å; M250-L258 HydrophobicContact SD-CD1 3.52Å; M250-L258 VanDerWaalsContact SD-CD1 3.52Å; L254-L258 HydrophobicContact CD1-CD1 3.84Å; L254-L258 HydrophobicContact CD1-CG 3.91Å; L254-L258 HydrophobicContact CG-CD1 3.98Å; L254-L258 HydrophobicContact CG-CG 4.34Å; L254-L258 WeakPolarHBondContact O-CB 3.46Å; L254-L258 VanDerWaalsContact O-CG 3.31Å; L254-L258 WeakPolarHBondContact O-CG 3.38Å; L254-L258 PolarHBondContact O-N 3.44Å; E255-L258 PolarHBondContact O-N 3.22Å; L258-A262 WeakPolarHBondContact O-CA 3.19Å; L258-A262 WeakPolarHBondContact O-CB 3.3Å; L258-A262 PolarHBondContact O-N 2.92Å
259	V	88.5	Confident	85.1	Confident	10 Å²	10	29.9 Å²	29.9	6%	0.061	17%	0.166	C	C	.	.	H	α-helix	trans	-64.1	-45.9	171.9	171.8	0	0	0	0	110.5	Q243 I246 E247 E255 V261 V263 K264	Q243-V259 HydrophobicContact CG-CG1 4.34Å; Q243-V259 HydrophobicContact CG-CG2 4.38Å; I246-V259 HydrophobicContact CB-CG2 4.32Å; I246-V259 HydrophobicContact CG2-CG2 3.81Å; E247-V259 HydrophobicContact CG-CG2 4.28Å; E255-V259 HydrophobicContact CG-CG2 4.5Å; E255-V259 WeakPolarHBondContact O-CB 3.33Å; E255-V259 WeakPolarHBondContact O-CG2 3.5Å; E255-V259 PolarHBondContact O-N 2.87Å; V259-V261 PolarHBondContact O-N 3.3Å; V259-V263 HydrophobicContact CG1-CB 4.41Å; V259-V263 WeakPolarHBondContact O-CA 3.33Å; V259-V263 VanDerWaalsContact O-CB 3.28Å; V259-V263 WeakPolarHBondContact O-CB 3.38Å; V259-V263 PolarHBondContact O-N 3.2Å; V259-K264 HydrophobicContact CG1-CD 4.41Å; V259-K264 HydrophobicContact CG1-CG 4.27Å; V259-K264 PolarHBondContact O-N 3.2Å
260	A	87	Confident	85.6	Confident	4 Å²	4	26.2 Å²	26.2	3%	0.033	15%	0.15	C	C	.	.	I	π-helix	trans	-58.6	-47.2	177.8	0	0	0	0	0	111.7	I131 A135 E256 L257 C265 Y272	I131-A260 HydrophobicContact CG2-CB 3.68Å; A135-A260 HydrophobicContact CB-CB 4.16Å; E256-A260 VanDerWaalsContact O-CB 3.25Å; E256-A260 WeakPolarHBondContact O-CB 3.43Å; E256-A260 PolarHBondContact O-N 2.87Å; L257-A260 PolarHBondContact O-N 2.82Å; A260-C265 VanDerWaalsContact O-CB 3.29Å; A260-C265 WeakPolarHBondContact O-CB 3.42Å; A260-C265 PolarHBondContact O-N 3.42Å; A260-C265 PolarHBondContact O-SG 3.39Å; A260-Y272 HydrophobicContact CB-CE2 4Å
261	V	81.4	Confident	85.9	Confident	3 Å²	3	25.5 Å²	25.5	2%	0.018	15%	0.146	C	C	.	.	I	π-helix	trans	-72.3	-57.4	-178	172.2	0	0	0	0	111.9	A135 L176 L219 L257 V259 V266	A135-V261 HydrophobicContact CB-CG2 3.54Å; L176-V261 HydrophobicContact CD1-CG2 3.53Å; L176-V261 HydrophobicContact CD2-CG1 4.22Å; L176-V261 HydrophobicContact CD2-CG2 4.16Å; L176-V261 HydrophobicContact CG-CG2 4.49Å; L219-V261 WeakPolarHBondContact O-CG1 3.32Å; L257-V261 HydrophobicContact CD1-CG2 3.87Å; L257-V261 HydrophobicContact CG-CG2 4.33Å; L257-V261 WeakPolarHBondContact O-CB 3.42Å; L257-V261 WeakPolarHBondContact O-CG2 3.38Å; L257-V261 PolarHBondContact O-N 3.18Å; V259-V261 PolarHBondContact O-N 3.3Å; V261-V266 WeakPolarHBondContact O-CG2 3.23Å; V261-V266 PolarHBondContact O-N 3.03Å
262	A	71.1	Confident	86.3	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.008	12%	0.115	C	C	.	.	I	π-helix	trans	-82.5	-26.4	-166.2	0	0	0	0	0	113.5	L219 L231 L242 L258 V266	L219-A262 HydrophobicContact CB-CB 4.11Å; L219-A262 HydrophobicContact CD1-CB 3.71Å; L219-A262 HydrophobicContact CD2-CB 3.6Å; L219-A262 HydrophobicContact CG-CB 3.97Å; L231-A262 WeakPolarHBondContact CD1-O 3.26Å; L242-A262 HydrophobicContact CD2-CB 4.46Å; L258-A262 WeakPolarHBondContact O-CA 3.19Å; L258-A262 WeakPolarHBondContact O-CB 3.3Å; L258-A262 PolarHBondContact O-N 2.92Å; A262-V266 WeakPolarHBondContact O-CB 3.32Å
263	V	73.9	Confident	86.7	Confident	3 Å²	3	19.6 Å²	19.6	2%	0.018	10%	0.098	C	C	.	.	I	π-helix	trans	-109.8	-60.6	-174.6	-173.4	0	0	0	0	108.7	W5 Q243 V259 K267	W5-V263 HydrophobicContact CB-CG1 4Å; W5-V263 HydrophobicContact CE3-CG1 4.46Å; W5-V263 HydrophobicContact CG-CG1 4.45Å; Q243-V263 HydrophobicContact CB-CG1 4.1Å; Q243-V263 HydrophobicContact CB-CG2 3.85Å; Q243-V263 HydrophobicContact CG-CG1 4.49Å; Q243-V263 HydrophobicContact CG-CG2 4.42Å; V259-V263 HydrophobicContact CG1-CB 4.41Å; V259-V263 WeakPolarHBondContact O-CA 3.33Å; V259-V263 VanDerWaalsContact O-CB 3.28Å; V259-V263 WeakPolarHBondContact O-CB 3.38Å; V259-V263 PolarHBondContact O-N 3.2Å; V263-K267 HydrophobicContact CG1-CD 3.92Å; V263-K267 WeakPolarHBondContact O-CB 3Å; V263-K267 WeakPolarHBondContact O-CD 3.35Å; V263-K267 WeakPolarHBondContact O-CG 3.38Å; V263-K267 PolarHBondContact O-N 2.72Å
264	K	82.6	Confident	86.9	Confident	26 Å²	26	15.2 Å²	15.2	11%	0.113	8%	0.078	C	C	.	.	I	π-helix	trans	-74	-57	-168.1	-56	-169.6	177.9	-173.5	0	112.4	W5 V259 V266 K267 S268 Y272 E275	W5-K264 HydrophobicContact CD2-CG 4.18Å; W5-K264 HydrophobicContact CE3-CG 4.34Å; W5-K264 HydrophobicContact CH2-CB 3.76Å; W5-K264 HydrophobicContact CH2-CD 4.47Å; W5-K264 HydrophobicContact CH2-CG 3.96Å; W5-K264 HydrophobicContact CZ2-CB 4.09Å; W5-K264 HydrophobicContact CZ2-CD 3.94Å; W5-K264 HydrophobicContact CZ2-CG 3.81Å; W5-K264 HydrophobicContact CZ3-CB 4.06Å; W5-K264 HydrophobicContact CZ3-CG 4.24Å; V259-K264 HydrophobicContact CG1-CD 4.41Å; V259-K264 HydrophobicContact CG1-CG 4.27Å; V259-K264 PolarHBondContact O-N 3.2Å; K264-V266 PolarHBondContact O-N 2.91Å; K264-K267 PolarHBondContact O-N 3.35Å; K264-S268 CarbonylContact O-C 3.37Å; K264-S268 VanDerWaalsContact O-C 3.27Å; K264-S268 PolarHBondContact O-N 3.49Å; K264-S268 VanDerWaalsContact O-O 3.08Å; K264-Y272 HydrophobicContact CB-CD2 3.61Å; K264-Y272 HydrophobicContact CB-CE2 4.47Å; K264-Y272 HydrophobicContact CB-CG 4.03Å; K264-Y272 HydrophobicContact CD-CD2 3.64Å; K264-Y272 HydrophobicContact CD-CE2 4.16Å; K264-Y272 HydrophobicContact CG-CD2 4.26Å; K264-E275 WeakPolarHBondContact CE-OE2 3.35Å; K264-E275 IonicContact NZ-OE2 2.97Å; K264-E275 PolarHBondContact NZ-OE2 3Å
265	C	82.7	Confident	87.1	Confident	15 Å²	15	16 Å²	16	10%	0.101	8%	0.081	C	C	.	.	I	π-helix	trans	-66.6	-37.5	-178.2	-65.1	0	0	0	0	112.8	A260 L269	A260-C265 VanDerWaalsContact O-CB 3.29Å; A260-C265 WeakPolarHBondContact O-CB 3.42Å; A260-C265 PolarHBondContact O-N 3.42Å; A260-C265 PolarHBondContact O-SG 3.39Å; C265-L269 HydrophobicContact CB-CD1 3.91Å; C265-L269 VanDerWaalsContact SG-CD1 3.53Å
266	V	81	Confident	87.3	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65.8	-39.8	174.6	165.4	0	0	0	0	111.4	I224 L227 R228 L231 V261 A262 K264	I224-V266 HydrophobicContact CD1-CG2 3.61Å; I224-V266 HydrophobicContact CG2-CG1 4.36Å; L227-V266 HydrophobicContact CB-CG1 4.13Å; L227-V266 HydrophobicContact CB-CG2 4.21Å; L227-V266 HydrophobicContact CD1-CG2 3.81Å; R228-V266 HydrophobicContact CG-CG1 3.58Å; R228-V266 PolarHBondContact NE-O 3.27Å; R228-V266 PolarHBondContact NH2-O 3.46Å; R228-V266 VanDerWaalsContact NH2-O 3.11Å; L231-V266 HydrophobicContact CD1-CG1 4.04Å; V261-V266 WeakPolarHBondContact O-CG2 3.23Å; V261-V266 PolarHBondContact O-N 3.03Å; A262-V266 WeakPolarHBondContact O-CB 3.32Å; K264-V266 PolarHBondContact O-N 2.91Å
267	K	81.3	Confident	87.6	Confident	23 Å²	23	10 Å²	10	10%	0.1	5%	0.054	C	C	.	.	H	α-helix	trans	-74.7	-61.4	-179.3	-72.2	179.7	167.8	-130.6	0	111.8	W5 D7 L11 R228 V263 K264	W5-K267 VanDerWaalsContact C-NZ 3.32Å; W5-K267 HydrophobicContact CE3-CB 4.05Å; W5-K267 HydrophobicContact CE3-CD 3.73Å; W5-K267 HydrophobicContact CE3-CG 4.48Å; W5-K267 HydrophobicContact CZ3-CB 3.88Å; W5-K267 HydrophobicContact CZ3-CD 4.43Å; W5-K267 WeakPolarHBondContact O-CE 3.43Å; W5-K267 PolarHBondContact O-NZ 3.23Å; D7-K267 PolarHBondContact O-NZ 3.44Å; L11-K267 HydrophobicContact CD1-CD 3.96Å; L11-K267 VanDerWaalsContact CD1-CE 3.42Å; L11-K267 HydrophobicContact CD1-CG 3.64Å; L11-K267 HydrophobicContact CD2-CB 3.87Å; L11-K267 HydrophobicContact CD2-CG 3.54Å; L11-K267 HydrophobicContact CG-CG 4.11Å; R228-K267 PolarHBondContact NH2-O 2.92Å; V263-K267 HydrophobicContact CG1-CD 3.92Å; V263-K267 WeakPolarHBondContact O-CB 3Å; V263-K267 WeakPolarHBondContact O-CD 3.35Å; V263-K267 WeakPolarHBondContact O-CG 3.38Å; V263-K267 PolarHBondContact O-N 2.72Å; K264-K267 PolarHBondContact O-N 3.35Å
268	S	85	Confident	87.8	Confident	26 Å²	26	11.7 Å²	11.7	18%	0.182	6%	0.062	C	C	.	.			trans	-154.4	105.2	180	175.2	0	0	0	0	109.2	K264 P270 A271 Y272	K264-S268 CarbonylContact O-C 3.37Å; K264-S268 VanDerWaalsContact O-C 3.27Å; K264-S268 PolarHBondContact O-N 3.49Å; K264-S268 VanDerWaalsContact O-O 3.08Å; S268-P270 VanDerWaalsContact C-N 3.33Å; S268-P270 WeakPolarHBondContact OG-CD 3.5Å; S268-A271 PolarHBondContact O-N 3.33Å; S268-A271 WeakPolarHBondContact OG-CB 3.45Å; S268-A271 PolarHBondContact OG-N 3.1Å; S268-Y272 PolarHBondContact O-N 3.34Å
269	L	89.4	Confident	88	Confident	17 Å²	17	18 Å²	18	9%	0.089	9%	0.089	C	C	.	.	H	α-helix	trans	-59.1	-40.1	173.4	-169.7	67.3	0	0	0	112.2	S17 C265 A271 Y272 F273	S17-L269 WeakPolarHBondContact OG-CB 3.25Å; C265-L269 HydrophobicContact CB-CD1 3.91Å; C265-L269 VanDerWaalsContact SG-CD1 3.53Å; L269-A271 PolarHBondContact O-N 3.44Å; L269-Y272 HydrophobicContact CD1-CD1 4.29Å; L269-Y272 WeakPolarHBondContact O-CB 3.43Å; L269-Y272 PolarHBondContact O-N 3.42Å; L269-F273 HydrophobicContact CD1-CD2 4.4Å; L269-F273 HydrophobicContact CD1-CE2 3.85Å; L269-F273 HydrophobicContact CD2-CE2 4.24Å; L269-F273 HydrophobicContact CG-CD2 4.12Å; L269-F273 HydrophobicContact CG-CE2 3.76Å; L269-F273 WeakPolarHBondContact O-CD2 3.43Å; L269-F273 PolarHBondContact O-N 3.15Å
270	P	92.5	Very high	88.4	Confident	8 Å²	8	17.8 Å²	17.8	5%	0.052	9%	0.088	C	C	.	.	H	α-helix	trans	-61	-41.6	173.7	-26.7	36.7	0	0	0	113.9	S268 Y272 F273 A274 D305 I306 E309	S268-P270 VanDerWaalsContact C-N 3.33Å; S268-P270 WeakPolarHBondContact OG-CD 3.5Å; P270-Y272 VanDerWaalsContact C-N 3.33Å; P270-Y272 PolarHBondContact O-N 2.91Å; P270-F273 PolarHBondContact O-N 3.24Å; P270-A274 WeakPolarHBondContact O-CB 3.41Å; P270-A274 PolarHBondContact O-N 2.67Å; P270-D305 HydrophobicContact CB-CB 3.64Å; P270-D305 HydrophobicContact CG-CB 3.53Å; P270-I306 HydrophobicContact CB-CG1 3.96Å; P270-E309 HydrophobicContact CB-CG 4.18Å
271	A	91.1	Very high	88.8	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-66.7	-34.5	177.3	0	0	0	0	0	112.3	L4 W5 S268 L269 A274 E275 E309 L313	L4-A271 HydrophobicContact CD2-CB 3.95Å; W5-A271 HydrophobicContact CH2-CB 3.68Å; W5-A271 HydrophobicContact CZ2-CB 4.3Å; W5-A271 HydrophobicContact CZ3-CB 4.36Å; S268-A271 PolarHBondContact O-N 3.33Å; S268-A271 WeakPolarHBondContact OG-CB 3.45Å; S268-A271 PolarHBondContact OG-N 3.1Å; L269-A271 PolarHBondContact O-N 3.44Å; A271-A274 PolarHBondContact O-N 3.21Å; A271-E275 PolarHBondContact O-N 2.83Å; A271-E309 HydrophobicContact CB-CB 4.11Å; A271-E309 HydrophobicContact CB-CG 4.07Å; A271-L313 HydrophobicContact CB-CD1 4.25Å
272	Y	93	Very high	89.3	Confident	10 Å²	10	24.7 Å²	24.7	4%	0.039	12%	0.118	C	C	.	.	H	α-helix	trans	-58.5	-50.1	173.4	173.5	-119.7	0	0	0	111.6	E132 A260 K264 S268 L269 P270 A274 E275 L276	E132-Y272 WeakPolarHBondContact CA-OH 3.34Å; E132-Y272 HydrophobicContact CG-CE1 4.46Å; A260-Y272 HydrophobicContact CB-CE2 4Å; K264-Y272 HydrophobicContact CB-CD2 3.61Å; K264-Y272 HydrophobicContact CB-CE2 4.47Å; K264-Y272 HydrophobicContact CB-CG 4.03Å; K264-Y272 HydrophobicContact CD-CD2 3.64Å; K264-Y272 HydrophobicContact CD-CE2 4.16Å; K264-Y272 HydrophobicContact CG-CD2 4.26Å; S268-Y272 PolarHBondContact O-N 3.34Å; L269-Y272 HydrophobicContact CD1-CD1 4.29Å; L269-Y272 WeakPolarHBondContact O-CB 3.43Å; L269-Y272 PolarHBondContact O-N 3.42Å; P270-Y272 VanDerWaalsContact C-N 3.33Å; P270-Y272 PolarHBondContact O-N 2.91Å; Y272-A274 VanDerWaalsContact C-N 3.34Å; Y272-A274 PolarHBondContact O-N 3.04Å; Y272-E275 PolarHBondContact O-N 3.5Å; Y272-L276 HydrophobicContact CD1-CD1 4.36Å; Y272-L276 HydrophobicContact CE1-CD1 3.74Å; Y272-L276 HydrophobicContact CE2-CD1 4.07Å; Y272-L276 HydrophobicContact CE2-CD2 4.36Å; Y272-L276 HydrophobicContact CE2-CG 4.15Å; Y272-L276 PolarHBondContact O-N 2.85Å; Y272-L276 VanDerWaalsContact O-N 3.13Å
273	F	95.9	Very high	90.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-67.1	-34.5	177.4	-74.4	-62.6	0	0	0	112.6	E132 L269 P270 E275 L276 L277 I294 R298 I306	E132-F273 HydrophobicContact CG-CE1 3.93Å; L269-F273 HydrophobicContact CD1-CD2 4.4Å; L269-F273 HydrophobicContact CD1-CE2 3.85Å; L269-F273 HydrophobicContact CD2-CE2 4.24Å; L269-F273 HydrophobicContact CG-CD2 4.12Å; L269-F273 HydrophobicContact CG-CE2 3.76Å; L269-F273 WeakPolarHBondContact O-CD2 3.43Å; L269-F273 PolarHBondContact O-N 3.15Å; P270-F273 PolarHBondContact O-N 3.24Å; F273-E275 VanDerWaalsContact C-N 3.33Å; F273-E275 PolarHBondContact O-N 3.2Å; F273-L276 HydrophobicContact CD1-CD1 4.28Å; F273-L276 PolarHBondContact O-N 3.28Å; F273-L277 WeakPolarHBondContact O-CB 3.27Å; F273-L277 WeakPolarHBondContact O-CG 3.4Å; F273-L277 PolarHBondContact O-N 2.95Å; F273-I294 HydrophobicContact CB-CG2 4.07Å; F273-I294 HydrophobicContact CD1-CB 4.47Å; F273-I294 HydrophobicContact CD1-CD1 4.1Å; F273-I294 HydrophobicContact CD1-CG1 3.92Å; F273-I294 HydrophobicContact CD1-CG2 3.8Å; F273-I294 HydrophobicContact CE1-CG1 4.32Å; F273-I294 HydrophobicContact CG-CG2 4.19Å; F273-R298 HydrophobicContact CD1-CG 4.4Å; F273-R298 HydrophobicContact CD2-CG 4.18Å; F273-R298 HydrophobicContact CE1-CG 4.45Å; F273-R298 HydrophobicContact CE2-CG 4.24Å; F273-R298 VanDerWaalsContact CE2-CZ 3.45Å; F273-R298 HydrophobicContact CG-CG 4.27Å; F273-R298 HydrophobicContact CZ-CG 4.38Å; F273-I306 HydrophobicContact CB-CD1 3.67Å; F273-I306 HydrophobicContact CB-CG1 3.98Å; F273-I306 HydrophobicContact CB-CG2 4.28Å; F273-I306 HydrophobicContact CD2-CD1 4.09Å; F273-I306 HydrophobicContact CG-CD1 4.12Å
274	A	95.5	Very high	90.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59.6	-42.8	174	0	0	0	0	0	111.9	P270 A271 Y272 L277 H278 I306 E309 F310 L313	P270-A274 WeakPolarHBondContact O-CB 3.41Å; P270-A274 PolarHBondContact O-N 2.67Å; A271-A274 PolarHBondContact O-N 3.21Å; Y272-A274 VanDerWaalsContact C-N 3.34Å; Y272-A274 PolarHBondContact O-N 3.04Å; A274-L277 PolarHBondContact O-N 3.39Å; A274-H278 PolarHBondContact O-N 2.98Å; A274-I306 HydrophobicContact CB-CG2 4.27Å; A274-E309 HydrophobicContact CB-CB 4.33Å; A274-F310 HydrophobicContact CB-CB 3.89Å; A274-F310 HydrophobicContact CB-CD2 4.11Å; A274-F310 HydrophobicContact CB-CG 4.47Å; A274-F310 WeakPolarHBondContact O-CD2 3.36Å; A274-L313 HydrophobicContact CB-CD1 4.35Å
275	E	94.3	Very high	91	Very high	33 Å²	33	35.3 Å²	35.3	15%	0.154	21%	0.213	C	C	.	.	H	α-helix	trans	-65.1	-40.2	174.5	-71.7	-167	158.2	0	0	113.2	W5 K264 A271 Y272 F273 H278 K279 L313 F314	W5-E275 HydrophobicContact CZ2-CG 4.25Å; W5-E275 VanDerWaalsContact NE1-CD 3.35Å; W5-E275 PolarHBondContact NE1-OE1 3.47Å; W5-E275 PolarHBondContact NE1-OE2 3.26Å; K264-E275 WeakPolarHBondContact CE-OE2 3.35Å; K264-E275 IonicContact NZ-OE2 2.97Å; K264-E275 PolarHBondContact NZ-OE2 3Å; A271-E275 PolarHBondContact O-N 2.83Å; Y272-E275 PolarHBondContact O-N 3.5Å; F273-E275 VanDerWaalsContact C-N 3.33Å; F273-E275 PolarHBondContact O-N 3.2Å; E275-H278 PolarHBondContact O-N 3.44Å; E275-K279 WeakPolarHBondContact O-CB 3.47Å; E275-K279 VanDerWaalsContact O-CG 3.29Å; E275-K279 WeakPolarHBondContact O-CG 3.45Å; E275-K279 PolarHBondContact O-N 2.94Å; E275-L313 HydrophobicContact CG-CD1 4.45Å; E275-F314 HydrophobicContact CG-CZ 4.3Å
276	L	95.3	Very high	91.5	Very high	31 Å²	31	35.8 Å²	35.8	16%	0.162	22%	0.216	C	C	.	.	H	α-helix	trans	-65	-42.2	177	-69.5	-177.8	0	0	0	111.6	E132 Y272 F273 H278 K279 S280 I294	E132-L276 HydrophobicContact CB-CD1 4.38Å; E132-L276 HydrophobicContact CG-CD1 3.74Å; Y272-L276 HydrophobicContact CD1-CD1 4.36Å; Y272-L276 HydrophobicContact CE1-CD1 3.74Å; Y272-L276 HydrophobicContact CE2-CD1 4.07Å; Y272-L276 HydrophobicContact CE2-CD2 4.36Å; Y272-L276 HydrophobicContact CE2-CG 4.15Å; Y272-L276 PolarHBondContact O-N 2.85Å; Y272-L276 VanDerWaalsContact O-N 3.13Å; F273-L276 HydrophobicContact CD1-CD1 4.28Å; F273-L276 PolarHBondContact O-N 3.28Å; L276-H278 VanDerWaalsContact C-N 3.35Å; L276-H278 PolarHBondContact O-N 2.64Å; L276-K279 PolarHBondContact O-N 3.2Å; L276-S280 PolarHBondContact O-N 3.46Å; L276-S280 PolarHBondContact O-OG 3.28Å; L276-I294 HydrophobicContact CB-CD1 3.45Å; L276-I294 VanDerWaalsContact CB-CD1 3.45Å; L276-I294 HydrophobicContact CD1-CD1 4.05Å; L276-I294 HydrophobicContact CG-CD1 4.43Å
277	L	96.8	Very high	92.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60.5	-44.6	174.4	-74.4	168.8	0	0	0	111.5	F273 A274 K279 S280 M281 L291 I294 M295 I306 F310 L318	F273-L277 WeakPolarHBondContact O-CB 3.27Å; F273-L277 WeakPolarHBondContact O-CG 3.4Å; F273-L277 PolarHBondContact O-N 2.95Å; A274-L277 PolarHBondContact O-N 3.39Å; L277-K279 PolarHBondContact O-N 2.96Å; L277-S280 WeakPolarHBondContact CA-OG 3.49Å; L277-S280 PolarHBondContact O-N 3.5Å; L277-S280 PolarHBondContact O-OG 2.81Å; L277-M281 HydrophobicContact CB-CE 4.33Å; L277-M281 VanDerWaalsContact O-CE 3.3Å; L277-M281 WeakPolarHBondContact O-CE 3.46Å; L277-M281 PolarHBondContact O-N 2.88Å; L277-L291 HydrophobicContact CD2-CD1 3.56Å; L277-I294 HydrophobicContact CD1-CG2 3.94Å; L277-I294 HydrophobicContact CD2-CB 3.92Å; L277-I294 HydrophobicContact CD2-CD1 4.3Å; L277-I294 HydrophobicContact CD2-CG2 3.83Å; L277-I294 HydrophobicContact CG-CB 4.34Å; L277-I294 HydrophobicContact CG-CD1 4.23Å; L277-I294 HydrophobicContact CG-CG2 3.8Å; L277-M295 HydrophobicContact CD1-SD 4.43Å; L277-M295 HydrophobicContact CD2-CG 4.15Å; L277-M295 HydrophobicContact CD2-SD 4.12Å; L277-I306 HydrophobicContact CD1-CG2 3.6Å; L277-F310 HydrophobicContact CB-CD2 4.28Å; L277-F310 HydrophobicContact CB-CE2 4.05Å; L277-L318 HydrophobicContact CB-CD1 4.22Å; L277-L318 HydrophobicContact CD1-CD1 3.96Å; L277-L318 HydrophobicContact CD1-CD2 3.87Å
278	H	95.7	Very high	93	Very high	35 Å²	35	41 Å²	41	16%	0.162	24%	0.242	C	C	.	.	H	α-helix	trans	-63.1	-44.7	176.7	179.3	67.5	0	0	0	110.9	A274 E275 L276 S280 M281 K282 F310 F314	A274-H278 PolarHBondContact O-N 2.98Å; E275-H278 PolarHBondContact O-N 3.44Å; L276-H278 VanDerWaalsContact C-N 3.35Å; L276-H278 PolarHBondContact O-N 2.64Å; H278-S280 VanDerWaalsContact C-N 3.3Å; H278-S280 PolarHBondContact O-N 2.74Å; H278-M281 CarbonylContact O-C 3.57Å; H278-M281 PolarHBondContact O-N 3.38Å; H278-K282 WeakPolarHBondContact O-CB 3.09Å; H278-K282 PolarHBondContact O-N 2.92Å; H278-F310 HydrophobicContact CB-CE2 3.78Å; H278-F310 HydrophobicContact CB-CZ 4.18Å; H278-F314 HydrophobicContact CB-CD1 4.38Å; H278-F314 HydrophobicContact CB-CD2 3.94Å; H278-F314 HydrophobicContact CB-CE1 3.92Å; H278-F314 HydrophobicContact CB-CE2 3.42Å; H278-F314 VanDerWaalsContact CB-CE2 3.42Å; H278-F314 HydrophobicContact CB-CG 4.4Å; H278-F314 HydrophobicContact CB-CZ 3.42Å; H278-F314 VanDerWaalsContact CB-CZ 3.42Å; H278-F314 AromaticContact CD2-CD1 3.79Å; H278-F314 AromaticContact CD2-CE1 3.37Å; H278-F314 WeakPolarHBondContact CD2-CE1 3.41Å; H278-F314 AromaticContact CD2-CZ 3.79Å; H278-F314 AromaticContact CE1-CD1 3.96Å; H278-F314 AromaticContact CG-CD1 3.75Å; H278-F314 AromaticContact CG-CE1 3.53Å; H278-F314 AromaticContact CG-CE2 3.88Å; H278-F314 AromaticContact CG-CZ 3.6Å; H278-F314 AromaticContact ND1-CD1 3.86Å; H278-F314 AromaticContact ND1-CG 3.95Å; H278-F314 AromaticContact NE2-CD1 3.94Å; H278-F314 AromaticContact NE2-CE1 3.92Å
279	K	94.8	Very high	93.5	Very high	132 Å²	132	42 Å²	42	57%	0.574	25%	0.25	S	S	*	.	H	α-helix	trans	-60.6	-38.1	176.1	-75.5	177.7	179.2	-168.7	0	112.3	E275 L276 L277 M281 K282	E275-K279 WeakPolarHBondContact O-CB 3.47Å; E275-K279 VanDerWaalsContact O-CG 3.29Å; E275-K279 WeakPolarHBondContact O-CG 3.45Å; E275-K279 PolarHBondContact O-N 2.94Å; L276-K279 PolarHBondContact O-N 3.2Å; L277-K279 PolarHBondContact O-N 2.96Å; K279-M281 VanDerWaalsContact C-N 3.27Å; K279-M281 PolarHBondContact O-N 2.89Å; K279-K282 PolarHBondContact O-N 2.84Å
280	S	95.6	Very high	93.8	Very high	7 Å²	7	41.9 Å²	41.9	5%	0.049	25%	0.25	C	C	.	.	H	α-helix	trans	-68.7	-23.5	178.9	59.5	0	0	0	0	113.8	L276 L277 H278 T286 D287	L276-S280 PolarHBondContact O-N 3.46Å; L276-S280 PolarHBondContact O-OG 3.28Å; L277-S280 WeakPolarHBondContact CA-OG 3.49Å; L277-S280 PolarHBondContact O-N 3.5Å; L277-S280 PolarHBondContact O-OG 2.81Å; H278-S280 VanDerWaalsContact C-N 3.3Å; H278-S280 PolarHBondContact O-N 2.74Å; S280-T286 CarbonylContact O-C 3.57Å; S280-T286 WeakPolarHBondContact O-CA 3.28Å; S280-D287 PolarHBondContact O-N 3.38Å
281	M	95.2	Very high	94.1	Very high	6 Å²	6	41.5 Å²	41.5	3%	0.03	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	8	-179.8	-63.6	-179.6	-71.6	0	0	112.9	L277 H278 K279 T286 L291 F310 L318 N321 I322 D325	L277-M281 HydrophobicContact CB-CE 4.33Å; L277-M281 VanDerWaalsContact O-CE 3.3Å; L277-M281 WeakPolarHBondContact O-CE 3.46Å; L277-M281 PolarHBondContact O-N 2.88Å; H278-M281 CarbonylContact O-C 3.57Å; H278-M281 PolarHBondContact O-N 3.38Å; K279-M281 VanDerWaalsContact C-N 3.27Å; K279-M281 PolarHBondContact O-N 2.89Å; M281-T286 HydrophobicContact CG-CG2 4.16Å; M281-L291 HydrophobicContact CE-CD1 4.48Å; M281-L291 HydrophobicContact CG-CD2 4.23Å; M281-L291 HydrophobicContact SD-CD1 4.16Å; M281-L291 HydrophobicContact SD-CD2 4.25Å; M281-F310 HydrophobicContact CE-CE2 4.28Å; M281-F310 HydrophobicContact CE-CZ 4.26Å; M281-L318 HydrophobicContact CE-CD1 3.73Å; M281-N321 HydrophobicContact CE-CB 4.11Å; M281-N321 VanDerWaalsContact CE-OD1 3.29Å; M281-N321 WeakPolarHBondContact CE-OD1 3.38Å; M281-N321 HydrophobicContact SD-CB 4.43Å; M281-I322 HydrophobicContact CE-CG1 4.37Å; M281-I322 HydrophobicContact SD-CG1 3.83Å; M281-D325 VanDerWaalsContact CA-OD2 3.28Å; M281-D325 WeakPolarHBondContact CA-OD2 3.34Å; M281-D325 HydrophobicContact CB-CB 4.2Å; M281-D325 VanDerWaalsContact CB-OD2 3.3Å; M281-D325 WeakPolarHBondContact CB-OD2 3.24Å; M281-D325 HydrophobicContact CG-CB 4.33Å; M281-D325 WeakPolarHBondContact CG-OD2 3.38Å; M281-D325 HydrophobicContact SD-CB 4.46Å
282	K	91.9	Very high	94.4	Very high	146 Å²	146	41.8 Å²	41.8	64%	0.635	25%	0.249	S	C	*	.	S	Bend	trans	-96.8	119.5	-176.5	-177.7	-178.3	-172.5	169.4	0	110.7	H278 K279	H278-K282 WeakPolarHBondContact O-CB 3.09Å; H278-K282 PolarHBondContact O-N 2.92Å; K279-K282 PolarHBondContact O-N 2.84Å
283	G	88.3	Confident	94.6	Very high	63 Å²	63	41.4 Å²	41.4	65%	0.649	25%	0.247	S	C	*	.	S	Bend	trans	117.2	-147.6	169.9	0	0	0	0	0	111.6
284	S	85.7	Confident	94.7	Very high	138 Å²	138	41.4 Å²	41.4	97%	0.965	25%	0.247	S	C	*	.	S	Bend	trans	-93.8	111.8	175.4	-178.8	0	0	0	0	109.1
285	G	89.8	Confident	94.9	Very high	52 Å²	52	41.4 Å²	41.4	54%	0.536	25%	0.247	S	C	.	.	S	Bend	trans	88.4	176	-176.3	0	0	0	0	0	112.7
286	T	94.4	Very high	95	Very high	25 Å²	25	40.4 Å²	40.4	15%	0.153	24%	0.244	C	C	.	.			trans	-123.5	148.1	-173.3	-45.7	0	0	0	0	109.3	S280 M281 E288 L291 D325 V326	S280-T286 CarbonylContact O-C 3.57Å; S280-T286 WeakPolarHBondContact O-CA 3.28Å; M281-T286 HydrophobicContact CG-CG2 4.16Å; T286-E288 HydrophobicContact CG2-CG 4.35Å; T286-E288 PolarHBondContact O-N 3.31Å; T286-L291 HydrophobicContact CG2-CD2 3.88Å; T286-D325 WeakPolarHBondContact CB-OD2 3.29Å; T286-D325 VanDerWaalsContact CG2-OD2 3.27Å; T286-D325 WeakPolarHBondContact CG2-OD2 3.48Å; T286-D325 PolarHBondContact OG1-OD2 3.46Å; T286-V326 HydrophobicContact CG2-CG1 4.04Å
287	D	96	Very high	95.1	Very high	72 Å²	72	40 Å²	40	39%	0.385	24%	0.243	S	C	.	.			trans	-91.4	84	161.9	177.6	-0.6	0	0	0	108.5	S280 S289 T290 L291	S280-D287 PolarHBondContact O-N 3.38Å; D287-S289 PolarHBondContact O-N 3.28Å; D287-S289 WeakPolarHBondContact OD1-CB 3.29Å; D287-S289 PolarHBondContact OD1-N 3.32Å; D287-T290 VanDerWaalsContact CG-OG1 3.31Å; D287-T290 PolarHBondContact O-N 3.06Å; D287-T290 PolarHBondContact OD1-N 3.07Å; D287-T290 VanDerWaalsContact OD2-CB 3.22Å; D287-T290 WeakPolarHBondContact OD2-CB 3.34Å; D287-T290 PolarHBondContact OD2-OG1 3.12Å; D287-L291 WeakPolarHBondContact O-CB 3.46Å; D287-L291 PolarHBondContact O-N 3.21Å
288	E	96.3	Very high	95.1	Very high	59 Å²	59	40.2 Å²	40.2	28%	0.276	24%	0.244	S	C	.	.	H	α-helix	trans	-63.4	-24.1	-177.6	-59.8	84.3	177.1	0	0	111.9	D96 T286 T292 Y330	D96-E288 HydrophobicContact CB-CB 4.08Å; D96-E288 HydrophobicContact CB-CG 4.26Å; T286-E288 HydrophobicContact CG2-CG 4.35Å; T286-E288 PolarHBondContact O-N 3.31Å; E288-T292 WeakPolarHBondContact O-CB 3.38Å; E288-T292 PolarHBondContact O-N 3.46Å; E288-T292 PolarHBondContact O-OG1 3.01Å; E288-Y330 HydrophobicContact CB-CE1 4.18Å; E288-Y330 HydrophobicContact CG-CE1 3.87Å; E288-Y330 PolarHBondContact O-OH 3.31Å
289	S	95.6	Very high	95.2	Very high	49 Å²	49	38.7 Å²	38.7	34%	0.343	24%	0.237	S	C	.	.	H	α-helix	trans	-68	-49.1	176.8	-179.4	0	0	0	0	110.8	D287 R293	D287-S289 PolarHBondContact O-N 3.28Å; D287-S289 WeakPolarHBondContact OD1-CB 3.29Å; D287-S289 PolarHBondContact OD1-N 3.32Å; S289-R293 VanDerWaalsContact O-CB 3.28Å; S289-R293 WeakPolarHBondContact O-CB 3.47Å; S289-R293 PolarHBondContact O-N 3.3Å
290	T	96.9	Very high	95.2	Very high	13 Å²	13	34.7 Å²	34.7	8%	0.08	22%	0.221	C	C	.	.	H	α-helix	trans	-68.4	-43.1	177.1	-63.3	0	0	0	0	111.6	D287 T292 R293 I294	D287-T290 VanDerWaalsContact CG-OG1 3.31Å; D287-T290 PolarHBondContact O-N 3.06Å; D287-T290 PolarHBondContact OD1-N 3.07Å; D287-T290 VanDerWaalsContact OD2-CB 3.22Å; D287-T290 WeakPolarHBondContact OD2-CB 3.34Å; D287-T290 PolarHBondContact OD2-OG1 3.12Å; T290-T292 PolarHBondContact O-N 2.81Å; T290-R293 PolarHBondContact O-N 2.71Å; T290-R293 PolarHBondContact OG1-NH2 3.15Å; T290-I294 HydrophobicContact CG2-CD1 3.64Å; T290-I294 HydrophobicContact CG2-CG1 4.37Å; T290-I294 WeakPolarHBondContact O-CG1 3.44Å; T290-I294 PolarHBondContact O-N 3.45Å
291	L	97.6	Very high	95.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.3	-49.9	176.7	-179.4	57.3	0	0	0	111.3	L277 M281 T286 D287 M295 V326 Y330 L334	L277-L291 HydrophobicContact CD2-CD1 3.56Å; M281-L291 HydrophobicContact CE-CD1 4.48Å; M281-L291 HydrophobicContact CG-CD2 4.23Å; M281-L291 HydrophobicContact SD-CD1 4.16Å; M281-L291 HydrophobicContact SD-CD2 4.25Å; T286-L291 HydrophobicContact CG2-CD2 3.88Å; D287-L291 WeakPolarHBondContact O-CB 3.46Å; D287-L291 PolarHBondContact O-N 3.21Å; L291-M295 HydrophobicContact CD1-CG 3.78Å; L291-M295 HydrophobicContact CG-CG 4.42Å; L291-M295 VanDerWaalsContact O-CB 3.26Å; L291-M295 WeakPolarHBondContact O-CB 3.39Å; L291-M295 WeakPolarHBondContact O-CG 3.38Å; L291-M295 PolarHBondContact O-N 2.91Å; L291-V326 HydrophobicContact CD2-CG1 3.93Å; L291-Y330 HydrophobicContact CD2-CE1 4.16Å; L291-L334 HydrophobicContact CD2-CD1 3.61Å; L291-L334 HydrophobicContact CG-CD1 3.92Å
292	T	98.1	Very high	95.1	Very high	6 Å²	6	36.1 Å²	36.1	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-59.8	-49.2	177	-61.2	0	0	0	0	111.7	L100 A103 E288 T290 I294 M295 V296 Y330	L100-T292 HydrophobicContact CB-CG2 4.22Å; L100-T292 HydrophobicContact CD1-CG2 3.77Å; A103-T292 HydrophobicContact CB-CG2 4.07Å; E288-T292 WeakPolarHBondContact O-CB 3.38Å; E288-T292 PolarHBondContact O-N 3.46Å; E288-T292 PolarHBondContact O-OG1 3.01Å; T290-T292 PolarHBondContact O-N 2.81Å; T292-I294 PolarHBondContact O-N 3.16Å; T292-M295 PolarHBondContact O-N 3.4Å; T292-V296 HydrophobicContact CG2-CG2 4.3Å; T292-V296 WeakPolarHBondContact O-CB 3.48Å; T292-V296 WeakPolarHBondContact O-CG2 3.3Å; T292-V296 PolarHBondContact O-N 3.17Å; T292-Y330 WeakPolarHBondContact OG1-CE2 3.42Å; T292-Y330 PolarHBondContact OG1-OH 3.32Å
293	R	98.2	Very high	95.3	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-46	-176.7	179.7	176.4	55.8	-97.8	-5.4	111.6	Y111 E115 E132 S289 T290 S297	Y111-R293 HydrophobicContact CE1-CB 4.47Å; Y111-R293 HydrophobicContact CE1-CG 4.21Å; Y111-R293 WeakPolarHBondContact OH-CA 3.47Å; E115-R293 HydrophobicContact CG-CG 4.26Å; E115-R293 WeakPolarHBondContact OE2-CD 3.24Å; E115-R293 IonicContact OE2-CZ 2.68Å; E115-R293 IonicContact OE2-NH1 3.65Å; E115-R293 PolarHBondContact OE2-NH1 3.13Å; E132-R293 VanDerWaalsContact CD-NE 3.29Å; E132-R293 IonicContact OE1-CZ 2.93Å; E132-R293 IonicContact OE1-NE 2.66Å; E132-R293 PolarHBondContact OE1-NE 3.05Å; E132-R293 IonicContact OE2-CZ 2.94Å; E132-R293 IonicContact OE2-NE 3.76Å; E132-R293 PolarHBondContact OE2-NE 3.3Å; E132-R293 VanDerWaalsContact OE2-NE 3.08Å; E132-R293 IonicContact OE2-NH2 2.71Å; E132-R293 PolarHBondContact OE2-NH2 2.6Å; S289-R293 VanDerWaalsContact O-CB 3.28Å; S289-R293 WeakPolarHBondContact O-CB 3.47Å; S289-R293 PolarHBondContact O-N 3.3Å; T290-R293 PolarHBondContact O-N 2.71Å; T290-R293 PolarHBondContact OG1-NH2 3.15Å; R293-S297 WeakPolarHBondContact O-CB 3.36Å; R293-S297 PolarHBondContact O-N 2.96Å; R293-S297 PolarHBondContact O-OG 3.44Å
294	I	97.9	Very high	95.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-70	-49.8	-179.7	-62.9	171	0	0	0	110.3	F273 L276 L277 T290 T292 V296 S297 R298	F273-I294 HydrophobicContact CB-CG2 4.07Å; F273-I294 HydrophobicContact CD1-CB 4.47Å; F273-I294 HydrophobicContact CD1-CD1 4.1Å; F273-I294 HydrophobicContact CD1-CG1 3.92Å; F273-I294 HydrophobicContact CD1-CG2 3.8Å; F273-I294 HydrophobicContact CE1-CG1 4.32Å; F273-I294 HydrophobicContact CG-CG2 4.19Å; L276-I294 HydrophobicContact CB-CD1 3.45Å; L276-I294 VanDerWaalsContact CB-CD1 3.45Å; L276-I294 HydrophobicContact CD1-CD1 4.05Å; L276-I294 HydrophobicContact CG-CD1 4.43Å; L277-I294 HydrophobicContact CD1-CG2 3.94Å; L277-I294 HydrophobicContact CD2-CB 3.92Å; L277-I294 HydrophobicContact CD2-CD1 4.3Å; L277-I294 HydrophobicContact CD2-CG2 3.83Å; L277-I294 HydrophobicContact CG-CB 4.34Å; L277-I294 HydrophobicContact CG-CD1 4.23Å; L277-I294 HydrophobicContact CG-CG2 3.8Å; T290-I294 HydrophobicContact CG2-CD1 3.64Å; T290-I294 HydrophobicContact CG2-CG1 4.37Å; T290-I294 WeakPolarHBondContact O-CG1 3.44Å; T290-I294 PolarHBondContact O-N 3.45Å; T292-I294 PolarHBondContact O-N 3.16Å; I294-V296 VanDerWaalsContact C-N 3.3Å; I294-V296 PolarHBondContact O-N 3Å; I294-S297 PolarHBondContact O-N 3.03Å; I294-R298 HydrophobicContact CG2-CG 4Å; I294-R298 VanDerWaalsContact O-CB 3.31Å; I294-R298 WeakPolarHBondContact O-CB 3.48Å; I294-R298 VanDerWaalsContact O-CG 3.27Å; I294-R298 WeakPolarHBondContact O-CG 3.36Å; I294-R298 PolarHBondContact O-N 3.34Å
295	M	98	Very high	96	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58.8	-41.9	-177.5	-69.4	-62.8	-69.3	0	0	111.8	L277 L291 T292 S299 L303 L318 I322 L334 I337 C338	L277-M295 HydrophobicContact CD1-SD 4.43Å; L277-M295 HydrophobicContact CD2-CG 4.15Å; L277-M295 HydrophobicContact CD2-SD 4.12Å; L291-M295 HydrophobicContact CD1-CG 3.78Å; L291-M295 HydrophobicContact CG-CG 4.42Å; L291-M295 VanDerWaalsContact O-CB 3.26Å; L291-M295 WeakPolarHBondContact O-CB 3.39Å; L291-M295 WeakPolarHBondContact O-CG 3.38Å; L291-M295 PolarHBondContact O-N 2.91Å; T292-M295 PolarHBondContact O-N 3.4Å; M295-S299 VanDerWaalsContact O-CB 3.23Å; M295-S299 WeakPolarHBondContact O-CB 3.48Å; M295-S299 PolarHBondContact O-N 2.94Å; M295-L303 HydrophobicContact CE-CD2 3.98Å; M295-L303 HydrophobicContact SD-CD1 4.04Å; M295-L303 HydrophobicContact SD-CD2 4.27Å; M295-L318 HydrophobicContact SD-CD2 4.06Å; M295-I322 HydrophobicContact CE-CD1 3.8Å; M295-I322 HydrophobicContact SD-CD1 4.3Å; M295-L334 HydrophobicContact CB-CD2 3.9Å; M295-L334 HydrophobicContact CG-CD2 3.97Å; M295-I337 HydrophobicContact CB-CG2 4.25Å; M295-I337 HydrophobicContact CE-CB 4.45Å; M295-I337 HydrophobicContact CE-CG2 4.16Å; M295-I337 WeakPolarHBondContact O-CG2 3.39Å; M295-C338 HydrophobicContact CE-CB 3.58Å
296	V	97.9	Very high	96.3	Very high	12 Å²	12	21.1 Å²	21.1	7%	0.073	12%	0.116	C	C	.	.	H	α-helix	trans	-73.3	-53.3	177.6	175.5	0	0	0	0	111.5	L100 A103 L104 Y111 T292 I294 R298 S299	L100-V296 HydrophobicContact CD1-CG2 3.53Å; A103-V296 HydrophobicContact CB-CB 4.39Å; A103-V296 HydrophobicContact CB-CG1 4.16Å; A103-V296 HydrophobicContact CB-CG2 3.98Å; L104-V296 HydrophobicContact CD2-CG1 4.37Å; L104-V296 HydrophobicContact CD2-CG2 3.98Å; L104-V296 HydrophobicContact CG-CG2 4.22Å; Y111-V296 HydrophobicContact CE1-CB 4.46Å; Y111-V296 HydrophobicContact CE1-CG1 4.41Å; T292-V296 HydrophobicContact CG2-CG2 4.3Å; T292-V296 WeakPolarHBondContact O-CB 3.48Å; T292-V296 WeakPolarHBondContact O-CG2 3.3Å; T292-V296 PolarHBondContact O-N 3.17Å; I294-V296 VanDerWaalsContact C-N 3.3Å; I294-V296 PolarHBondContact O-N 3Å; V296-R298 PolarHBondContact O-N 3.23Å; V296-S299 PolarHBondContact O-N 2.92Å; V296-S299 PolarHBondContact O-OG 3.04Å
297	S	97.1	Very high	96.3	Very high	22 Å²	22	20.7 Å²	20.7	15%	0.154	11%	0.112	C	C	.	.	H	α-helix	trans	-65.7	-25	-172.7	66.7	0	0	0	0	113.6	R137 R293 I294 I301	R137-S297 PolarHBondContact NH2-OG 3.37Å; R293-S297 WeakPolarHBondContact O-CB 3.36Å; R293-S297 PolarHBondContact O-N 2.96Å; R293-S297 PolarHBondContact O-OG 3.44Å; I294-S297 PolarHBondContact O-N 3.03Å; S297-I301 WeakPolarHBondContact O-CD1 3.38Å
298	R	96.8	Very high	96.2	Very high	5 Å²	5	19.7 Å²	19.7	2%	0.019	11%	0.113	C	C	.	.	H	α-helix	trans	-100.9	-11.3	-179.2	-50.8	-47	-62.6	-169.7	-6.9	114.1	F273 I294 V296 E300 I301 D302 L303 I306	F273-R298 HydrophobicContact CD1-CG 4.4Å; F273-R298 HydrophobicContact CD2-CG 4.18Å; F273-R298 HydrophobicContact CE1-CG 4.45Å; F273-R298 HydrophobicContact CE2-CG 4.24Å; F273-R298 VanDerWaalsContact CE2-CZ 3.45Å; F273-R298 HydrophobicContact CG-CG 4.27Å; F273-R298 HydrophobicContact CZ-CG 4.38Å; I294-R298 HydrophobicContact CG2-CG 4Å; I294-R298 VanDerWaalsContact O-CB 3.31Å; I294-R298 WeakPolarHBondContact O-CB 3.48Å; I294-R298 VanDerWaalsContact O-CG 3.27Å; I294-R298 WeakPolarHBondContact O-CG 3.36Å; I294-R298 PolarHBondContact O-N 3.34Å; V296-R298 PolarHBondContact O-N 3.23Å; R298-E300 PolarHBondContact O-N 3.33Å; R298-E300 VanDerWaalsContact O-N 3.09Å; R298-I301 PolarHBondContact O-N 2.84Å; R298-D302 IonicContact CZ-OD1 2.6Å; R298-D302 IonicContact CZ-OD2 2.78Å; R298-D302 IonicContact NE-OD1 3.18Å; R298-D302 PolarHBondContact NE-OD1 3.06Å; R298-D302 IonicContact NE-OD2 3.97Å; R298-D302 IonicContact NH2-OD1 2.9Å; R298-D302 PolarHBondContact NH2-OD1 3.44Å; R298-D302 VanDerWaalsContact NH2-OD1 3.09Å; R298-D302 IonicContact NH2-OD2 2.68Å; R298-D302 PolarHBondContact NH2-OD2 2.94Å; R298-D302 PolarHBondContact O-N 2.8Å; R298-L303 WeakPolarHBondContact O-CB 3.34Å; R298-L303 PolarHBondContact O-N 2.9Å; R298-I306 HydrophobicContact CB-CD1 3.58Å; R298-I306 HydrophobicContact CG-CD1 3.71Å
299	S	96.9	Very high	96	Very high	3 Å²	3	19 Å²	19	2%	0.021	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-32.2	-175.3	58.6	0	0	0	0	115.2	G26 T27 I28 M295 V296	G26-S299 CarbonylContact C-O 3.27Å; G26-S299 WeakPolarHBondContact CA-O 3.42Å; T27-S299 PolarHBondContact N-O 3.48Å; T27-S299 PolarHBondContact OG1-O 2.94Å; I28-S299 PolarHBondContact N-O 3.42Å; I28-S299 VanDerWaalsContact N-O 3.09Å; M295-S299 VanDerWaalsContact O-CB 3.23Å; M295-S299 WeakPolarHBondContact O-CB 3.48Å; M295-S299 PolarHBondContact O-N 2.94Å; V296-S299 PolarHBondContact O-N 2.92Å; V296-S299 PolarHBondContact O-OG 3.04Å
300	E	96.1	Very high	96	Very high	49 Å²	49	16.6 Å²	16.6	23%	0.229	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	6.9	-178.7	-66.4	-179.8	-137.6	0	0	113.1	G23 I28 S66 N67 R298	G23-E300 PolarHBondContact N-O 3.03Å; I28-E300 HydrophobicContact CB-CG 3.94Å; I28-E300 HydrophobicContact CG2-CG 4.16Å; S66-E300 WeakPolarHBondContact CA-OE1 3.39Å; S66-E300 WeakPolarHBondContact CB-OE2 3.36Å; N67-E300 WeakPolarHBondContact CB-OE1 3.48Å; N67-E300 PolarHBondContact N-OE1 2.91Å; N67-E300 PolarHBondContact N-OE2 3.25Å; R298-E300 PolarHBondContact O-N 3.33Å; R298-E300 VanDerWaalsContact O-N 3.09Å
301	I	94.1	Very high	95.8	Very high	38 Å²	38	20 Å²	20	20%	0.195	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-74.7	-175.3	-53.7	179.1	0	0	0	110.2	R25 G26 S297 R298	R25-I301 CarbonylContact C-O 3.58Å; R25-I301 VanDerWaalsContact C-O 3.32Å; R25-I301 WeakPolarHBondContact CB-O 3.38Å; G26-I301 PolarHBondContact N-O 2.88Å; S297-I301 WeakPolarHBondContact O-CD1 3.38Å; R298-I301 PolarHBondContact O-N 2.84Å
302	D	94.2	Very high	95.5	Very high	5 Å²	5	26.4 Å²	26.4	3%	0.027	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-145.5	20.5	-165.9	60.3	-9.6	0	0	0	113.3	R25 R298 L304 D305 I306	R25-D302 CarbonylContact O-C 3.6Å; R298-D302 IonicContact CZ-OD1 2.6Å; R298-D302 IonicContact CZ-OD2 2.78Å; R298-D302 IonicContact NE-OD1 3.18Å; R298-D302 PolarHBondContact NE-OD1 3.06Å; R298-D302 IonicContact NE-OD2 3.97Å; R298-D302 IonicContact NH2-OD1 2.9Å; R298-D302 PolarHBondContact NH2-OD1 3.44Å; R298-D302 VanDerWaalsContact NH2-OD1 3.09Å; R298-D302 IonicContact NH2-OD2 2.68Å; R298-D302 PolarHBondContact NH2-OD2 2.94Å; R298-D302 PolarHBondContact O-N 2.8Å; D302-L304 PolarHBondContact O-N 3.29Å; D302-L304 VanDerWaalsContact O-N 3.11Å; D302-D305 HydrophobicContact CB-CB 4.32Å; D302-D305 WeakPolarHBondContact O-CA 3.47Å; D302-D305 WeakPolarHBondContact O-CB 3.44Å; D302-D305 PolarHBondContact O-N 3.26Å; D302-I306 WeakPolarHBondContact O-CG1 3.41Å; D302-I306 PolarHBondContact O-N 3.4Å
303	L	96	Very high	95.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.1	-24.8	-178.6	-168.5	56.1	0	0	0	113.4	R25 T27 M295 R298 I306 R307 L318 I337	R25-L303 PolarHBondContact O-N 3.16Å; T27-L303 HydrophobicContact CG2-CB 3.91Å; T27-L303 HydrophobicContact CG2-CD2 4.13Å; T27-L303 HydrophobicContact CG2-CG 3.95Å; T27-L303 WeakPolarHBondContact OG1-CD2 3.27Å; M295-L303 HydrophobicContact CE-CD2 3.98Å; M295-L303 HydrophobicContact SD-CD1 4.04Å; M295-L303 HydrophobicContact SD-CD2 4.27Å; R298-L303 WeakPolarHBondContact O-CB 3.34Å; R298-L303 PolarHBondContact O-N 2.9Å; L303-I306 HydrophobicContact CD1-CB 4.2Å; L303-I306 HydrophobicContact CD1-CD1 4.22Å; L303-I306 HydrophobicContact CD1-CG2 4.27Å; L303-R307 WeakPolarHBondContact O-CB 3.45Å; L303-R307 VanDerWaalsContact O-CG 3.24Å; L303-R307 WeakPolarHBondContact O-CG 3.36Å; L303-R307 PolarHBondContact O-N 3.2Å; L303-L318 HydrophobicContact CD1-CD2 4.29Å; L303-I337 HydrophobicContact CD2-CG2 4.13Å; L303-I337 WeakPolarHBondContact CD2-O 3.02Å
304	L	95.2	Very high	94.9	Very high	40 Å²	40	30.4 Å²	30.4	21%	0.209	15%	0.154	C	C	.	.	H	α-helix	trans	-70.6	-34.6	170.3	-66	173.7	0	0	0	113.2	R25 T27 D302 A308	R25-L304 VanDerWaalsContact O-CB 3.24Å; R25-L304 WeakPolarHBondContact O-CB 3.22Å; R25-L304 WeakPolarHBondContact O-CG 3.39Å; R25-L304 PolarHBondContact O-N 2.8Å; T27-L304 HydrophobicContact CG2-CD2 3.73Å; T27-L304 HydrophobicContact CG2-CG 3.98Å; D302-L304 PolarHBondContact O-N 3.29Å; D302-L304 VanDerWaalsContact O-N 3.11Å; L304-A308 PolarHBondContact O-N 3.39Å
305	D	93.9	Very high	94.6	Very high	44 Å²	44	39.3 Å²	39.3	24%	0.235	20%	0.196	C	C	.	.	H	α-helix	trans	-70.3	-41.8	173.5	-66.2	-65.8	0	0	0	110.6	R25 P270 D302 R307 A308 E309	R25-D305 VanDerWaalsContact CB-OD2 3.24Å; R25-D305 WeakPolarHBondContact CB-OD2 3.39Å; R25-D305 WeakPolarHBondContact CG-OD2 3.24Å; R25-D305 IonicContact CZ-OD1 2.77Å; R25-D305 IonicContact CZ-OD2 2.65Å; R25-D305 IonicContact NE-OD1 3.3Å; R25-D305 PolarHBondContact NE-OD1 2.93Å; R25-D305 IonicContact NE-OD2 3.31Å; R25-D305 PolarHBondContact NE-OD2 2.82Å; R25-D305 IonicContact NH2-OD1 2.82Å; R25-D305 PolarHBondContact NH2-OD1 3.2Å; R25-D305 IonicContact NH2-OD2 3.15Å; P270-D305 HydrophobicContact CB-CB 3.64Å; P270-D305 HydrophobicContact CG-CB 3.53Å; D302-D305 HydrophobicContact CB-CB 4.32Å; D302-D305 WeakPolarHBondContact O-CA 3.47Å; D302-D305 WeakPolarHBondContact O-CB 3.44Å; D302-D305 PolarHBondContact O-N 3.26Å; D305-R307 VanDerWaalsContact C-N 3.3Å; D305-R307 PolarHBondContact O-N 3.08Å; D305-A308 PolarHBondContact O-N 2.85Å; D305-E309 PolarHBondContact O-N 3.03Å
306	I	95.5	Very high	94.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.7	-45	178.4	-67.2	168.9	0	0	0	109.9	P270 F273 A274 L277 R298 D302 L303 A308 E309 F310	P270-I306 HydrophobicContact CB-CG1 3.96Å; F273-I306 HydrophobicContact CB-CD1 3.67Å; F273-I306 HydrophobicContact CB-CG1 3.98Å; F273-I306 HydrophobicContact CB-CG2 4.28Å; F273-I306 HydrophobicContact CD2-CD1 4.09Å; F273-I306 HydrophobicContact CG-CD1 4.12Å; A274-I306 HydrophobicContact CB-CG2 4.27Å; L277-I306 HydrophobicContact CD1-CG2 3.6Å; R298-I306 HydrophobicContact CB-CD1 3.58Å; R298-I306 HydrophobicContact CG-CD1 3.71Å; D302-I306 WeakPolarHBondContact O-CG1 3.41Å; D302-I306 PolarHBondContact O-N 3.4Å; L303-I306 HydrophobicContact CD1-CB 4.2Å; L303-I306 HydrophobicContact CD1-CD1 4.22Å; L303-I306 HydrophobicContact CD1-CG2 4.27Å; I306-A308 PolarHBondContact O-N 3.24Å; I306-E309 PolarHBondContact O-N 2.94Å; I306-F310 VanDerWaalsContact O-CB 3.25Å; I306-F310 WeakPolarHBondContact O-CB 3.49Å; I306-F310 PolarHBondContact O-N 3.13Å
307	R	94.8	Very high	94.2	Very high	15 Å²	15	42.1 Å²	42.1	6%	0.057	21%	0.209	C	C	.	.	H	α-helix	trans	-57.1	-46.4	175.2	-83.3	170.8	56.6	-175	-5.5	113.2	L303 D305 F310 K311 L318 C338 G340 D342	L303-R307 WeakPolarHBondContact O-CB 3.45Å; L303-R307 VanDerWaalsContact O-CG 3.24Å; L303-R307 WeakPolarHBondContact O-CG 3.36Å; L303-R307 PolarHBondContact O-N 3.2Å; D305-R307 VanDerWaalsContact C-N 3.3Å; D305-R307 PolarHBondContact O-N 3.08Å; R307-F310 PolarHBondContact O-N 3.35Å; R307-K311 PolarHBondContact O-N 3.13Å; R307-L318 HydrophobicContact CG-CB 4.21Å; R307-L318 HydrophobicContact CG-CD2 3.88Å; R307-C338 VanDerWaalsContact CD-O 3.25Å; R307-C338 WeakPolarHBondContact CD-O 3.29Å; R307-C338 PolarHBondContact NH1-O 3.32Å; R307-G340 PolarHBondContact NH2-O 2.88Å; R307-D342 WeakPolarHBondContact CB-OD2 3.32Å; R307-D342 IonicContact CZ-OD1 2.92Å; R307-D342 IonicContact CZ-OD2 2.62Å; R307-D342 VanDerWaalsContact CZ-OD2 3.31Å; R307-D342 IonicContact NE-OD1 3.21Å; R307-D342 PolarHBondContact NE-OD1 3.01Å; R307-D342 IonicContact NE-OD2 2.74Å; R307-D342 PolarHBondContact NE-OD2 3.09Å; R307-D342 IonicContact NH2-OD1 3.76Å; R307-D342 PolarHBondContact NH2-OD1 2.9Å; R307-D342 IonicContact NH2-OD2 3.71Å; R307-D342 PolarHBondContact NH2-OD2 3.18Å; R307-D342 VanDerWaalsContact NH2-OD2 3.16Å
308	A	93.1	Very high	94.2	Very high	51 Å²	51	41 Å²	41	42%	0.421	20%	0.201	S	C	.	.	H	α-helix	trans	-63.6	-45.2	178.9	0	0	0	0	0	111.9	L304 D305 I306 K312	L304-A308 PolarHBondContact O-N 3.39Å; D305-A308 PolarHBondContact O-N 2.85Å; I306-A308 PolarHBondContact O-N 3.24Å; A308-K312 WeakPolarHBondContact O-CB 3.47Å; A308-K312 PolarHBondContact O-N 3.38Å
309	E	92.4	Very high	94.1	Very high	44 Å²	44	41.6 Å²	41.6	21%	0.206	21%	0.205	C	C	.	.	H	α-helix	trans	-66.7	-37.9	175.4	-70.5	-62.3	156.9	0	0	111.8	P270 A271 A274 D305 I306 K312 L313	P270-E309 HydrophobicContact CB-CG 4.18Å; A271-E309 HydrophobicContact CB-CB 4.11Å; A271-E309 HydrophobicContact CB-CG 4.07Å; A274-E309 HydrophobicContact CB-CB 4.33Å; D305-E309 PolarHBondContact O-N 3.03Å; I306-E309 PolarHBondContact O-N 2.94Å; E309-K312 PolarHBondContact O-N 3.37Å; E309-K312 IonicContact OE1-NZ 3.72Å; E309-K312 IonicContact OE2-NZ 3.28Å; E309-K312 PolarHBondContact OE2-NZ 3Å; E309-L313 WeakPolarHBondContact O-CB 3.42Å; E309-L313 WeakPolarHBondContact O-CG 3.4Å; E309-L313 PolarHBondContact O-N 3.02Å
310	F	94.5	Very high	94	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.7	-51	175.7	-168.3	-77	0	0	0	111.4	A274 L277 H278 M281 I306 R307 K312 L313 F314 H316 L318 N321	A274-F310 HydrophobicContact CB-CB 3.89Å; A274-F310 HydrophobicContact CB-CD2 4.11Å; A274-F310 HydrophobicContact CB-CG 4.47Å; A274-F310 WeakPolarHBondContact O-CD2 3.36Å; L277-F310 HydrophobicContact CB-CD2 4.28Å; L277-F310 HydrophobicContact CB-CE2 4.05Å; H278-F310 HydrophobicContact CB-CE2 3.78Å; H278-F310 HydrophobicContact CB-CZ 4.18Å; M281-F310 HydrophobicContact CE-CE2 4.28Å; M281-F310 HydrophobicContact CE-CZ 4.26Å; I306-F310 VanDerWaalsContact O-CB 3.25Å; I306-F310 WeakPolarHBondContact O-CB 3.49Å; I306-F310 PolarHBondContact O-N 3.13Å; R307-F310 PolarHBondContact O-N 3.35Å; F310-K312 VanDerWaalsContact C-N 3.31Å; F310-K312 PolarHBondContact O-N 2.97Å; F310-L313 PolarHBondContact O-N 2.66Å; F310-L313 VanDerWaalsContact O-N 3.16Å; F310-F314 AromaticContact CD1-CD2 3.9Å; F310-F314 HydrophobicContact CD1-CD2 3.9Å; F310-F314 AromaticContact CD2-CD2 3.83Å; F310-F314 HydrophobicContact CD2-CD2 3.83Å; F310-F314 AromaticContact CD2-CE2 3.95Å; F310-F314 HydrophobicContact CD2-CE2 3.95Å; F310-F314 HydrophobicContact CE1-CB 4.29Å; F310-F314 AromaticContact CE1-CD2 3.9Å; F310-F314 HydrophobicContact CE1-CD2 3.9Å; F310-F314 HydrophobicContact CE1-CG 4.49Å; F310-F314 AromaticContact CE2-CD2 3.85Å; F310-F314 HydrophobicContact CE2-CD2 3.85Å; F310-F314 HydrophobicContact CE2-CE2 4.05Å; F310-F314 AromaticContact CG-CD2 3.85Å; F310-F314 HydrophobicContact CG-CD2 3.85Å; F310-F314 HydrophobicContact CG-CE2 4.33Å; F310-F314 AromaticContact CZ-CD2 3.88Å; F310-F314 HydrophobicContact CZ-CD2 3.88Å; F310-F314 HydrophobicContact CZ-CE2 4.49Å; F310-F314 VanDerWaalsContact O-CD2 3.31Å; F310-F314 WeakPolarHBondContact O-CD2 3.23Å; F310-F314 PolarHBondContact O-N 3.43Å; F310-H316 WeakPolarHBondContact CD1-O 3.5Å; F310-H316 AromaticContact CE1-CD2 3.95Å; F310-H316 AromaticContact CE1-NE2 3.7Å; F310-L318 HydrophobicContact CB-CB 4.4Å; F310-L318 HydrophobicContact CD1-CB 4.02Å; F310-L318 HydrophobicContact CD2-CB 4.48Å; F310-L318 HydrophobicContact CD2-CD1 3.9Å; F310-L318 HydrophobicContact CE1-CB 4.46Å; F310-L318 HydrophobicContact CE2-CD1 3.8Å; F310-L318 HydrophobicContact CG-CB 4.05Å; F310-L318 HydrophobicContact CG-CD1 4.31Å; F310-L318 HydrophobicContact CZ-CD1 4.15Å; F310-N321 HydrophobicContact CE1-CB 4.25Å; F310-N321 HydrophobicContact CZ-CB 4.14Å; F310-N321 WeakPolarHBondContact CZ-OD1 3.46Å
311	K	93.7	Very high	93.9	Very high	85 Å²	85	42 Å²	42	37%	0.37	21%	0.212	S	C	.	.	H	α-helix	trans	-60.9	-40.4	178	-178.1	172.3	174.5	174.6	0	112.1	R307 L313 E315 H316 D342	R307-K311 PolarHBondContact O-N 3.13Å; K311-L313 VanDerWaalsContact C-N 3.34Å; K311-E315 WeakPolarHBondContact O-CA 3.26Å; K311-E315 PolarHBondContact O-N 3.47Å; K311-H316 WeakPolarHBondContact CA-O 3.47Å; K311-D342 HydrophobicContact CD-CB 3.99Å; K311-D342 PolarHBondContact NZ-O 2.76Å; K311-D342 PolarHBondContact NZ-OXT 3.34Å
312	K	91.8	Very high	93.9	Very high	133 Å²	133	40.2 Å²	40.2	58%	0.578	20%	0.203	S	C	*	.	H	α-helix	trans	-64.5	-37	176.3	177.2	-176.7	163.9	-159.2	0	112.6	A308 E309 F310	A308-K312 WeakPolarHBondContact O-CB 3.47Å; A308-K312 PolarHBondContact O-N 3.38Å; E309-K312 PolarHBondContact O-N 3.37Å; E309-K312 IonicContact OE1-NZ 3.72Å; E309-K312 IonicContact OE2-NZ 3.28Å; E309-K312 PolarHBondContact OE2-NZ 3Å; F310-K312 VanDerWaalsContact C-N 3.31Å; F310-K312 PolarHBondContact O-N 2.97Å
313	L	90.2	Very high	93.9	Very high	44 Å²	44	45.2 Å²	45.2	23%	0.23	23%	0.226	C	C	.	.	H	α-helix	trans	-84.1	-34.8	-175	-70.5	170.5	0	0	0	114	L4 A271 A274 E275 E309 F310 K311	L4-L313 HydrophobicContact CB-CD2 3.85Å; L4-L313 HydrophobicContact CD1-CD2 3.9Å; L4-L313 HydrophobicContact CD2-CD1 4Å; L4-L313 HydrophobicContact CD2-CD2 3.41Å; L4-L313 VanDerWaalsContact CD2-CD2 3.41Å; L4-L313 HydrophobicContact CD2-CG 4.23Å; L4-L313 HydrophobicContact CG-CD2 3.87Å; A271-L313 HydrophobicContact CB-CD1 4.25Å; A274-L313 HydrophobicContact CB-CD1 4.35Å; E275-L313 HydrophobicContact CG-CD1 4.45Å; E309-L313 WeakPolarHBondContact O-CB 3.42Å; E309-L313 WeakPolarHBondContact O-CG 3.4Å; E309-L313 PolarHBondContact O-N 3.02Å; F310-L313 PolarHBondContact O-N 2.66Å; F310-L313 VanDerWaalsContact O-N 3.16Å; K311-L313 VanDerWaalsContact C-N 3.34Å
314	F	92.3	Very high	93.7	Very high	49 Å²	49	49.6 Å²	49.6	22%	0.215	26%	0.256	C	S	.	.	H	α-helix	trans	-117	0.3	-170	-52.9	-63.3	0	0	0	113.9	E275 H278 F310 H316	E275-F314 HydrophobicContact CG-CZ 4.3Å; H278-F314 HydrophobicContact CB-CD1 4.38Å; H278-F314 HydrophobicContact CB-CD2 3.94Å; H278-F314 HydrophobicContact CB-CE1 3.92Å; H278-F314 HydrophobicContact CB-CE2 3.42Å; H278-F314 VanDerWaalsContact CB-CE2 3.42Å; H278-F314 HydrophobicContact CB-CG 4.4Å; H278-F314 HydrophobicContact CB-CZ 3.42Å; H278-F314 VanDerWaalsContact CB-CZ 3.42Å; H278-F314 AromaticContact CD2-CD1 3.79Å; H278-F314 AromaticContact CD2-CE1 3.37Å; H278-F314 WeakPolarHBondContact CD2-CE1 3.41Å; H278-F314 AromaticContact CD2-CZ 3.79Å; H278-F314 AromaticContact CE1-CD1 3.96Å; H278-F314 AromaticContact CG-CD1 3.75Å; H278-F314 AromaticContact CG-CE1 3.53Å; H278-F314 AromaticContact CG-CE2 3.88Å; H278-F314 AromaticContact CG-CZ 3.6Å; H278-F314 AromaticContact ND1-CD1 3.86Å; H278-F314 AromaticContact ND1-CG 3.95Å; H278-F314 AromaticContact NE2-CD1 3.94Å; H278-F314 AromaticContact NE2-CE1 3.92Å; F310-F314 AromaticContact CD1-CD2 3.9Å; F310-F314 HydrophobicContact CD1-CD2 3.9Å; F310-F314 AromaticContact CD2-CD2 3.83Å; F310-F314 HydrophobicContact CD2-CD2 3.83Å; F310-F314 AromaticContact CD2-CE2 3.95Å; F310-F314 HydrophobicContact CD2-CE2 3.95Å; F310-F314 HydrophobicContact CE1-CB 4.29Å; F310-F314 AromaticContact CE1-CD2 3.9Å; F310-F314 HydrophobicContact CE1-CD2 3.9Å; F310-F314 HydrophobicContact CE1-CG 4.49Å; F310-F314 AromaticContact CE2-CD2 3.85Å; F310-F314 HydrophobicContact CE2-CD2 3.85Å; F310-F314 HydrophobicContact CE2-CE2 4.05Å; F310-F314 AromaticContact CG-CD2 3.85Å; F310-F314 HydrophobicContact CG-CD2 3.85Å; F310-F314 HydrophobicContact CG-CE2 4.33Å; F310-F314 AromaticContact CZ-CD2 3.88Å; F310-F314 HydrophobicContact CZ-CD2 3.88Å; F310-F314 HydrophobicContact CZ-CE2 4.49Å; F310-F314 VanDerWaalsContact O-CD2 3.31Å; F310-F314 WeakPolarHBondContact O-CD2 3.23Å; F310-F314 PolarHBondContact O-N 3.43Å; F314-H316 PolarHBondContact O-CE1 2.93Å; F314-H316 PolarHBondContact O-N 3.25Å; F314-H316 VanDerWaalsContact O-N 3.13Å; F314-H316 PolarHBondContact O-ND1 2.93Å
315	E	92	Very high	93.5	Very high	186 Å²	186	49.8 Å²	49.8	87%	0.869	26%	0.258	S	S	*	.	S	Bend	trans	62.8	14.4	175.9	-53.2	-177.4	161.5	0	0	114.8	K311	K311-E315 WeakPolarHBondContact O-CA 3.26Å; K311-E315 PolarHBondContact O-N 3.47Å
316	H	92.5	Very high	93.5	Very high	63 Å²	63	48.5 Å²	48.5	29%	0.292	25%	0.251	S	S	.	.	S	Bend	trans	-143.6	157.9	171.8	61.1	-82.7	0	0	0	110	F310 K311 F314	F310-H316 WeakPolarHBondContact CD1-O 3.5Å; F310-H316 AromaticContact CE1-CD2 3.95Å; F310-H316 AromaticContact CE1-NE2 3.7Å; K311-H316 WeakPolarHBondContact CA-O 3.47Å; F314-H316 PolarHBondContact O-CE1 2.93Å; F314-H316 PolarHBondContact O-N 3.25Å; F314-H316 VanDerWaalsContact O-N 3.13Å; F314-H316 PolarHBondContact O-ND1 2.93Å
317	S	95.4	Very high	93.3	Very high	8 Å²	8	53.6 Å²	53.6	6%	0.056	29%	0.287	C	S	.	.			trans	-77.1	151.3	-175.6	72	0	0	0	0	111.9	L319 S320 N321 D341	S317-L319 PolarHBondContact O-N 3.03Å; S317-S320 PolarHBondContact N-OG 3.03Å; S317-S320 PolarHBondContact O-N 3.18Å; S317-S320 PolarHBondContact O-OG 3.15Å; S317-S320 WeakPolarHBondContact OG-CB 3.44Å; S317-S320 PolarHBondContact OG-N 3.15Å; S317-S320 VanDerWaalsContact OG-N 3.07Å; S317-S320 PolarHBondContact OG-OG 2.98Å; S317-N321 PolarHBondContact O-N 3.47Å; S317-N321 VanDerWaalsContact O-N 3.08Å; S317-D341 WeakPolarHBondContact CB-OD1 3.44Å; S317-D341 PolarHBondContact OG-OD1 3.43Å
318	L	95.9	Very high	93.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-56.8	-39.9	173.9	177	61.1	0	0	0	111.2	L277 M281 M295 L303 R307 F310 N321 I322	L277-L318 HydrophobicContact CB-CD1 4.22Å; L277-L318 HydrophobicContact CD1-CD1 3.96Å; L277-L318 HydrophobicContact CD1-CD2 3.87Å; M281-L318 HydrophobicContact CE-CD1 3.73Å; M295-L318 HydrophobicContact SD-CD2 4.06Å; L303-L318 HydrophobicContact CD1-CD2 4.29Å; R307-L318 HydrophobicContact CG-CB 4.21Å; R307-L318 HydrophobicContact CG-CD2 3.88Å; F310-L318 HydrophobicContact CB-CB 4.4Å; F310-L318 HydrophobicContact CD1-CB 4.02Å; F310-L318 HydrophobicContact CD2-CB 4.48Å; F310-L318 HydrophobicContact CD2-CD1 3.9Å; F310-L318 HydrophobicContact CE1-CB 4.46Å; F310-L318 HydrophobicContact CE2-CD1 3.8Å; F310-L318 HydrophobicContact CG-CB 4.05Å; F310-L318 HydrophobicContact CG-CD1 4.31Å; F310-L318 HydrophobicContact CZ-CD1 4.15Å; L318-N321 PolarHBondContact O-N 3.35Å; L318-I322 HydrophobicContact CD1-CD1 4.16Å; L318-I322 HydrophobicContact CD1-CG1 4.35Å; L318-I322 HydrophobicContact CG-CD1 3.95Å; L318-I322 WeakPolarHBondContact O-CG1 3.34Å; L318-I322 PolarHBondContact O-N 3.29Å
319	L	95.2	Very high	93.3	Very high	17 Å²	17	56.8 Å²	56.8	9%	0.089	31%	0.307	C	S	.	.	H	α-helix	trans	-61.5	-48.7	177.6	-178	62.3	0	0	0	111.2	S317 N321 I322 E323 K335 C338 D341	S317-L319 PolarHBondContact O-N 3.03Å; L319-N321 PolarHBondContact O-N 2.81Å; L319-I322 PolarHBondContact O-N 3.23Å; L319-E323 HydrophobicContact CD1-CG 4.38Å; L319-E323 WeakPolarHBondContact O-CG 3.17Å; L319-E323 PolarHBondContact O-N 3.02Å; L319-K335 HydrophobicContact CD1-CB 4.22Å; L319-K335 HydrophobicContact CD1-CG 4.01Å; L319-C338 HydrophobicContact CD1-CB 4.33Å; L319-D341 HydrophobicContact CD2-CB 4.13Å
320	S	94.4	Very high	93.4	Very high	45 Å²	45	55.5 Å²	55.5	32%	0.315	30%	0.3	S	S	.	.	H	α-helix	trans	-60.5	-34.7	178	70.9	0	0	0	0	112.6	S317 S324	S317-S320 PolarHBondContact N-OG 3.03Å; S317-S320 PolarHBondContact O-N 3.18Å; S317-S320 PolarHBondContact O-OG 3.15Å; S317-S320 WeakPolarHBondContact OG-CB 3.44Å; S317-S320 PolarHBondContact OG-N 3.15Å; S317-S320 VanDerWaalsContact OG-N 3.07Å; S317-S320 PolarHBondContact OG-OG 2.98Å; S320-S324 PolarHBondContact O-N 2.89Å; S320-S324 VanDerWaalsContact O-N 3.16Å; S320-S324 PolarHBondContact O-OG 2.96Å
321	N	94	Very high	93.5	Very high	16 Å²	16	55.6 Å²	55.6	9%	0.086	30%	0.301	C	S	.	.	H	α-helix	trans	-69.8	-44.5	176.7	-164.3	-168.4	0	0	0	111.4	M281 F310 S317 L318 L319 E323 S324 D325	M281-N321 HydrophobicContact CE-CB 4.11Å; M281-N321 VanDerWaalsContact CE-OD1 3.29Å; M281-N321 WeakPolarHBondContact CE-OD1 3.38Å; M281-N321 HydrophobicContact SD-CB 4.43Å; F310-N321 HydrophobicContact CE1-CB 4.25Å; F310-N321 HydrophobicContact CZ-CB 4.14Å; F310-N321 WeakPolarHBondContact CZ-OD1 3.46Å; S317-N321 PolarHBondContact O-N 3.47Å; S317-N321 VanDerWaalsContact O-N 3.08Å; L318-N321 PolarHBondContact O-N 3.35Å; L319-N321 PolarHBondContact O-N 2.81Å; N321-E323 VanDerWaalsContact C-N 3.34Å; N321-E323 PolarHBondContact O-N 3.49Å; N321-S324 PolarHBondContact O-N 2.59Å; N321-S324 PolarHBondContact O-OG 3.39Å; N321-D325 WeakPolarHBondContact O-CB 3.37Å; N321-D325 PolarHBondContact O-N 3.11Å
322	I	94.8	Very high	93.5	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-57.3	-48.2	174.5	-69.7	168.8	0	0	0	110	M281 M295 L318 L319 S324 D325 V326 L334 C338	M281-I322 HydrophobicContact CE-CG1 4.37Å; M281-I322 HydrophobicContact SD-CG1 3.83Å; M295-I322 HydrophobicContact CE-CD1 3.8Å; M295-I322 HydrophobicContact SD-CD1 4.3Å; L318-I322 HydrophobicContact CD1-CD1 4.16Å; L318-I322 HydrophobicContact CD1-CG1 4.35Å; L318-I322 HydrophobicContact CG-CD1 3.95Å; L318-I322 WeakPolarHBondContact O-CG1 3.34Å; L318-I322 PolarHBondContact O-N 3.29Å; L319-I322 PolarHBondContact O-N 3.23Å; I322-S324 PolarHBondContact O-N 2.88Å; I322-D325 PolarHBondContact O-N 3.03Å; I322-V326 HydrophobicContact CB-CG2 4.45Å; I322-V326 HydrophobicContact CG2-CG2 3.5Å; I322-V326 VanDerWaalsContact CG2-CG2 3.5Å; I322-V326 WeakPolarHBondContact O-CG2 3.49Å; I322-V326 PolarHBondContact O-N 3.16Å; I322-L334 HydrophobicContact CG2-CB 3.96Å; I322-L334 HydrophobicContact CG2-CD1 4.31Å; I322-C338 HydrophobicContact CD1-CB 4.04Å
323	E	93.5	Very high	93.7	Very high	110 Å²	110	48.9 Å²	48.9	51%	0.514	28%	0.275	S	S	.	.	H	α-helix	trans	-62.1	-28.9	-180	-70.7	-173.7	149.9	0	0	113.8	L319 N321 K335	L319-E323 HydrophobicContact CD1-CG 4.38Å; L319-E323 WeakPolarHBondContact O-CG 3.17Å; L319-E323 PolarHBondContact O-N 3.02Å; N321-E323 VanDerWaalsContact C-N 3.34Å; N321-E323 PolarHBondContact O-N 3.49Å; E323-K335 HydrophobicContact CG-CG 4.49Å
324	S	92.1	Very high	94	Very high	92 Å²	92	46.8 Å²	46.8	64%	0.643	26%	0.264	S	S	*	.	H	α-helix	trans	-80.9	-29.7	177.3	69.7	0	0	0	0	113.8	S320 N321 I322	S320-S324 PolarHBondContact O-N 2.89Å; S320-S324 VanDerWaalsContact O-N 3.16Å; S320-S324 PolarHBondContact O-OG 2.96Å; N321-S324 PolarHBondContact O-N 2.59Å; N321-S324 PolarHBondContact O-OG 3.39Å; I322-S324 PolarHBondContact O-N 2.88Å
325	D	92.3	Very high	94.2	Very high	44 Å²	44	47.6 Å²	47.6	24%	0.235	27%	0.268	C	S	.	.	H	α-helix	trans	-103	-33.4	-166.4	-158.5	58.1	0	0	0	112.7	M281 T286 N321 I322	M281-D325 VanDerWaalsContact CA-OD2 3.28Å; M281-D325 WeakPolarHBondContact CA-OD2 3.34Å; M281-D325 HydrophobicContact CB-CB 4.2Å; M281-D325 VanDerWaalsContact CB-OD2 3.3Å; M281-D325 WeakPolarHBondContact CB-OD2 3.24Å; M281-D325 HydrophobicContact CG-CB 4.33Å; M281-D325 WeakPolarHBondContact CG-OD2 3.38Å; M281-D325 HydrophobicContact SD-CB 4.46Å; T286-D325 WeakPolarHBondContact CB-OD2 3.29Å; T286-D325 VanDerWaalsContact CG2-OD2 3.27Å; T286-D325 WeakPolarHBondContact CG2-OD2 3.48Å; T286-D325 PolarHBondContact OG1-OD2 3.46Å; N321-D325 WeakPolarHBondContact O-CB 3.37Å; N321-D325 PolarHBondContact O-N 3.11Å; I322-D325 PolarHBondContact O-N 3.03Å
326	V	92.7	Very high	94.3	Very high	17 Å²	17	40.4 Å²	40.4	10%	0.103	24%	0.237	C	C	.	.			trans	-117.1	152.7	-178.6	-60	0	0	0	0	112.3	T286 L291 I322 Y330 L334	T286-V326 HydrophobicContact CG2-CG1 4.04Å; L291-V326 HydrophobicContact CD2-CG1 3.93Å; I322-V326 HydrophobicContact CB-CG2 4.45Å; I322-V326 HydrophobicContact CG2-CG2 3.5Å; I322-V326 VanDerWaalsContact CG2-CG2 3.5Å; I322-V326 WeakPolarHBondContact O-CG2 3.49Å; I322-V326 PolarHBondContact O-N 3.16Å; V326-Y330 HydrophobicContact CB-CD1 4.07Å; V326-Y330 HydrophobicContact CB-CE1 4.33Å; V326-Y330 HydrophobicContact CG1-CD1 4.05Å; V326-Y330 HydrophobicContact CG1-CE1 3.84Å; V326-L334 HydrophobicContact CG2-CD1 4.08Å
327	S	92	Very high	94.5	Very high	106 Å²	106	37.4 Å²	37.4	74%	0.741	22%	0.223	S	C	*	.			trans	-140.6	177.8	-178.8	65.2	0	0	0	0	112	G331	S327-G331 PolarHBondContact O-N 3.25Å
328	G	93.4	Very high	94.5	Very high	49 Å²	49	37 Å²	37	51%	0.505	22%	0.22	S	C	.	.	H	α-helix	trans	65.5	-159.3	-179.5	0	0	0	0	0	113.6	Y330 G331 D332	G328-Y330 PolarHBondContact O-N 2.73Å; G328-G331 PolarHBondContact O-N 3.26Å; G328-G331 VanDerWaalsContact O-N 3.14Å; G328-D332 PolarHBondContact O-N 3.03Å
329	E	93.6	Very high	94	Very high	84 Å²	84	38.3 Å²	38.3	39%	0.393	23%	0.234	S	C	.	.	H	α-helix	trans	-62.6	-31.9	-175.4	-62.9	142.4	168.4	0	0	112.4	E55 F97 D332 C333	E55-E329 HydrophobicContact CB-CG 4.28Å; E55-E329 HydrophobicContact CG-CG 4.19Å; F97-E329 HydrophobicContact CB-CB 4.22Å; F97-E329 HydrophobicContact CD1-CB 3.83Å; F97-E329 HydrophobicContact CD1-CG 4.49Å; F97-E329 HydrophobicContact CD2-CB 3.65Å; F97-E329 WeakPolarHBondContact CD2-O 3.39Å; F97-E329 HydrophobicContact CE1-CB 4.04Å; F97-E329 HydrophobicContact CE1-CG 4.48Å; F97-E329 HydrophobicContact CE2-CB 3.88Å; F97-E329 HydrophobicContact CG-CB 3.63Å; F97-E329 HydrophobicContact CZ-CB 4.05Å; E329-D332 PolarHBondContact O-N 3.43Å; E329-C333 VanDerWaalsContact O-CB 3.23Å; E329-C333 WeakPolarHBondContact O-CB 3.32Å; E329-C333 PolarHBondContact O-N 3Å
330	Y	95.6	Very high	93.2	Very high	18 Å²	18	39.6 Å²	39.6	7%	0.071	25%	0.252	C	S	.	.	H	α-helix	trans	-61	-50.4	174.1	-178.8	-112.7	0	0	0	111.3	D96 L100 E288 L291 T292 V326 G328 C333 L334	D96-Y330 HydrophobicContact CB-CD2 3.84Å; D96-Y330 HydrophobicContact CB-CE2 4Å; D96-Y330 HydrophobicContact CB-CG 4.17Å; D96-Y330 WeakPolarHBondContact O-CD2 2.77Å; L100-Y330 HydrophobicContact CB-CD2 4.09Å; L100-Y330 HydrophobicContact CB-CE2 3.98Å; L100-Y330 HydrophobicContact CD2-CD2 3.75Å; L100-Y330 HydrophobicContact CD2-CE2 3.8Å; L100-Y330 HydrophobicContact CG-CE2 4.4Å; E288-Y330 HydrophobicContact CB-CE1 4.18Å; E288-Y330 HydrophobicContact CG-CE1 3.87Å; E288-Y330 PolarHBondContact O-OH 3.31Å; L291-Y330 HydrophobicContact CD2-CE1 4.16Å; T292-Y330 WeakPolarHBondContact OG1-CE2 3.42Å; T292-Y330 PolarHBondContact OG1-OH 3.32Å; V326-Y330 HydrophobicContact CB-CD1 4.07Å; V326-Y330 HydrophobicContact CB-CE1 4.33Å; V326-Y330 HydrophobicContact CG1-CD1 4.05Å; V326-Y330 HydrophobicContact CG1-CE1 3.84Å; G328-Y330 PolarHBondContact O-N 2.73Å; Y330-C333 PolarHBondContact O-N 2.69Å; Y330-L334 HydrophobicContact CD1-CD1 4.01Å; Y330-L334 HydrophobicContact CE1-CD1 3.44Å; Y330-L334 VanDerWaalsContact CE1-CD1 3.44Å; Y330-L334 HydrophobicContact CE1-CG 4.38Å; Y330-L334 HydrophobicContact CE2-CD1 4.2Å; Y330-L334 HydrophobicContact CE2-CG 4.36Å; Y330-L334 WeakPolarHBondContact O-CG 3.43Å; Y330-L334 PolarHBondContact O-N 3.24Å
331	G	95.3	Very high	92	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-62.9	-42	175	0	0	0	0	0	112.6	S327 G328 C333 L334 K335	S327-G331 PolarHBondContact O-N 3.25Å; G328-G331 PolarHBondContact O-N 3.26Å; G328-G331 VanDerWaalsContact O-N 3.14Å; G331-C333 PolarHBondContact O-N 3.11Å; G331-L334 PolarHBondContact O-N 3.41Å; G331-K335 VanDerWaalsContact O-CG 3.31Å; G331-K335 WeakPolarHBondContact O-CG 3.46Å; G331-K335 PolarHBondContact O-N 2.96Å; G331-K335 VanDerWaalsContact O-N 3.09Å
332	D	95.1	Very high	90.5	Very high	78 Å²	78	46.3 Å²	46.3	42%	0.417	28%	0.284	S	S	.	.	H	α-helix	trans	-65.7	-26.1	178	-72	-17.9	0	0	0	113.2	I59 G328 E329 K335 P336	I59-D332 HydrophobicContact CD1-CB 4.05Å; G328-D332 PolarHBondContact O-N 3.03Å; E329-D332 PolarHBondContact O-N 3.43Å; D332-K335 IonicContact OD1-NZ 3.43Å; D332-K335 PolarHBondContact OD1-NZ 2.93Å; D332-P336 WeakPolarHBondContact O-CD 3.28Å
333	C	95.5	Very high	90.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-81.1	-37.1	173	-167.1	0	0	0	0	112.5	I59 T63 F97 L100 E329 Y330 G331 P336 I337	I59-C333 HydrophobicContact CD1-CB 4.27Å; I59-C333 HydrophobicContact CG1-CB 3.96Å; I59-C333 HydrophobicContact CG2-CB 4.48Å; T63-C333 VanDerWaalsContact CG2-SG 3.58Å; F97-C333 HydrophobicContact CD2-CB 4.22Å; F97-C333 HydrophobicContact CE2-CB 4.01Å; L100-C333 HydrophobicContact CD2-CB 3.55Å; L100-C333 WeakPolarHBondContact CD2-SG 3.07Å; E329-C333 VanDerWaalsContact O-CB 3.23Å; E329-C333 WeakPolarHBondContact O-CB 3.32Å; E329-C333 PolarHBondContact O-N 3Å; Y330-C333 PolarHBondContact O-N 2.69Å; G331-C333 PolarHBondContact O-N 3.11Å; C333-P336 VanDerWaalsContact O-CD 3.29Å; C333-P336 WeakPolarHBondContact O-CD 3.25Å; C333-P336 VanDerWaalsContact O-CG 3.3Å; C333-P336 WeakPolarHBondContact O-CG 3.47Å; C333-I337 WeakPolarHBondContact O-CD1 3.4Å; C333-I337 WeakPolarHBondContact O-CG1 3.47Å
334	L	96.9	Very high	90.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-68.3	-36.7	178.2	-76.4	179.1	0	0	0	113.5	L100 L291 M295 I322 V326 Y330 G331 I337 C338	L100-L334 HydrophobicContact CD1-CD2 4.16Å; L100-L334 HydrophobicContact CD2-CD2 3.9Å; L100-L334 HydrophobicContact CD2-CG 3.95Å; L291-L334 HydrophobicContact CD2-CD1 3.61Å; L291-L334 HydrophobicContact CG-CD1 3.92Å; M295-L334 HydrophobicContact CB-CD2 3.9Å; M295-L334 HydrophobicContact CG-CD2 3.97Å; I322-L334 HydrophobicContact CG2-CB 3.96Å; I322-L334 HydrophobicContact CG2-CD1 4.31Å; V326-L334 HydrophobicContact CG2-CD1 4.08Å; Y330-L334 HydrophobicContact CD1-CD1 4.01Å; Y330-L334 HydrophobicContact CE1-CD1 3.44Å; Y330-L334 VanDerWaalsContact CE1-CD1 3.44Å; Y330-L334 HydrophobicContact CE1-CG 4.38Å; Y330-L334 HydrophobicContact CE2-CD1 4.2Å; Y330-L334 HydrophobicContact CE2-CG 4.36Å; Y330-L334 WeakPolarHBondContact O-CG 3.43Å; Y330-L334 PolarHBondContact O-N 3.24Å; G331-L334 PolarHBondContact O-N 3.41Å; L334-I337 HydrophobicContact CD2-CD1 4.41Å; L334-I337 WeakPolarHBondContact O-CB 3.48Å; L334-I337 PolarHBondContact O-N 3.41Å; L334-I337 VanDerWaalsContact O-N 3.17Å; L334-C338 WeakPolarHBondContact O-CB 3.32Å; L334-C338 PolarHBondContact O-N 3.28Å
335	K	95.6	Very high	90	Very high	66 Å²	66	42.8 Å²	42.8	29%	0.287	27%	0.267	S	S	.	.	H	α-helix	trans	-52.5	-56.9	178.7	-70.5	165	-167.2	165.8	0	113	L319 E323 G331 D332 I337 C338 G339	L319-K335 HydrophobicContact CD1-CB 4.22Å; L319-K335 HydrophobicContact CD1-CG 4.01Å; E323-K335 HydrophobicContact CG-CG 4.49Å; G331-K335 VanDerWaalsContact O-CG 3.31Å; G331-K335 WeakPolarHBondContact O-CG 3.46Å; G331-K335 PolarHBondContact O-N 2.96Å; G331-K335 VanDerWaalsContact O-N 3.09Å; D332-K335 IonicContact OD1-NZ 3.43Å; D332-K335 PolarHBondContact OD1-NZ 2.93Å; K335-I337 VanDerWaalsContact C-N 3.27Å; K335-I337 PolarHBondContact O-N 3.11Å; K335-C338 WeakPolarHBondContact O-CB 3.43Å; K335-C338 PolarHBondContact O-N 2.98Å; K335-C338 VanDerWaalsContact O-N 3.16Å; K335-G339 PolarHBondContact O-N 3.5Å
336	P	95.2	Very high	89.8	Confident	34 Å²	34	42.7 Å²	42.7	22%	0.221	27%	0.269	C	S	.	.	H	α-helix	trans	-66.5	-25	179	26	-35.4	0	0	0	113.8	I59 T63 D332 C333 G339	I59-P336 HydrophobicContact CG2-CG 3.97Å; T63-P336 HydrophobicContact CG2-CG 3.89Å; T63-P336 WeakPolarHBondContact OG1-CB 3.49Å; T63-P336 WeakPolarHBondContact OG1-CG 3.34Å; D332-P336 WeakPolarHBondContact O-CD 3.28Å; C333-P336 VanDerWaalsContact O-CD 3.29Å; C333-P336 WeakPolarHBondContact O-CD 3.25Å; C333-P336 VanDerWaalsContact O-CG 3.3Å; C333-P336 WeakPolarHBondContact O-CG 3.47Å; P336-G339 PolarHBondContact O-N 3.34Å
337	I	96.8	Very high	89.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-69.5	-45.4	171.6	-60.2	167.1	0	0	0	110.1	T27 I28 T63 L100 L104 M295 L303 C333 L334 K335 G339	T27-I337 VanDerWaalsContact CB-O 3.28Å; T27-I337 WeakPolarHBondContact CB-O 3.28Å; T27-I337 PolarHBondContact OG1-O 3.25Å; I28-I337 HydrophobicContact CD1-CG1 4.24Å; I28-I337 HydrophobicContact CD1-CG2 4.27Å; T63-I337 HydrophobicContact CG2-CD1 4.21Å; T63-I337 HydrophobicContact CG2-CG1 3.81Å; L100-I337 HydrophobicContact CD1-CD1 3.88Å; L100-I337 HydrophobicContact CD2-CD1 4.34Å; L100-I337 HydrophobicContact CG-CD1 4.41Å; L104-I337 HydrophobicContact CD1-CD1 4.16Å; L104-I337 HydrophobicContact CD2-CD1 3.92Å; L104-I337 HydrophobicContact CD2-CG1 4.39Å; L104-I337 HydrophobicContact CG-CD1 4.45Å; M295-I337 HydrophobicContact CB-CG2 4.25Å; M295-I337 HydrophobicContact CE-CB 4.45Å; M295-I337 HydrophobicContact CE-CG2 4.16Å; M295-I337 WeakPolarHBondContact O-CG2 3.39Å; L303-I337 HydrophobicContact CD2-CG2 4.13Å; L303-I337 WeakPolarHBondContact CD2-O 3.02Å; C333-I337 WeakPolarHBondContact O-CD1 3.4Å; C333-I337 WeakPolarHBondContact O-CG1 3.47Å; L334-I337 HydrophobicContact CD2-CD1 4.41Å; L334-I337 WeakPolarHBondContact O-CB 3.48Å; L334-I337 PolarHBondContact O-N 3.41Å; L334-I337 VanDerWaalsContact O-N 3.17Å; K335-I337 VanDerWaalsContact C-N 3.27Å; K335-I337 PolarHBondContact O-N 3.11Å; I337-G339 PolarHBondContact O-N 2.98Å
338	C	95.1	Very high	89.5	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-35.6	173.1	-168	0	0	0	0	111.1	T27 M295 R307 L319 I322 L334 K335	T27-C338 VanDerWaalsContact CG2-O 3.29Å; T27-C338 WeakPolarHBondContact CG2-O 3.48Å; M295-C338 HydrophobicContact CE-CB 3.58Å; R307-C338 VanDerWaalsContact CD-O 3.25Å; R307-C338 WeakPolarHBondContact CD-O 3.29Å; R307-C338 PolarHBondContact NH1-O 3.32Å; L319-C338 HydrophobicContact CD1-CB 4.33Å; I322-C338 HydrophobicContact CD1-CB 4.04Å; L334-C338 WeakPolarHBondContact O-CB 3.32Å; L334-C338 PolarHBondContact O-N 3.28Å; K335-C338 WeakPolarHBondContact O-CB 3.43Å; K335-C338 PolarHBondContact O-N 2.98Å; K335-C338 VanDerWaalsContact O-N 3.16Å
339	G	85.4	Confident	89.2	Confident	27 Å²	27	39.6 Å²	39.6	28%	0.278	23%	0.23	S	C	.	.			trans	91.7	-144.8	-175.2	0	0	0	0	0	111.3	K335 P336 I337	K335-G339 PolarHBondContact O-N 3.5Å; P336-G339 PolarHBondContact O-N 3.34Å; I337-G339 PolarHBondContact O-N 2.98Å
340	G	78.5	Confident	88.9	Confident	45 Å²	45	36.2 Å²	36.2	46%	0.464	22%	0.217	S	C	.	.	S	Bend	trans	-86.2	179.9	177.9	0	0	0	0	0	113.9	R307	R307-G340 PolarHBondContact NH2-O 2.88Å
341	D	67.9	Low	88.3	Confident	110 Å²	110	37.7 Å²	37.7	59%	0.588	23%	0.229	S	C	*	.			trans	-73.7	157.8	172.2	-150.9	7.4	0	0	0	111.4	S317 L319	S317-D341 WeakPolarHBondContact CB-OD1 3.44Å; S317-D341 PolarHBondContact OG-OD1 3.43Å; L319-D341 HydrophobicContact CD2-CB 4.13Å
342	D	62.5	Low	87.7	Confident	91 Å²	91	41 Å²	41	49%	0.487	25%	0.249	S	C	.	.			trans	-113.8	0	-179.7	-65.5	-65.1	0	0	0	112.9	R307 K311	R307-D342 WeakPolarHBondContact CB-OD2 3.32Å; R307-D342 IonicContact CZ-OD1 2.92Å; R307-D342 IonicContact CZ-OD2 2.62Å; R307-D342 VanDerWaalsContact CZ-OD2 3.31Å; R307-D342 IonicContact NE-OD1 3.21Å; R307-D342 PolarHBondContact NE-OD1 3.01Å; R307-D342 IonicContact NE-OD2 2.74Å; R307-D342 PolarHBondContact NE-OD2 3.09Å; R307-D342 IonicContact NH2-OD1 3.76Å; R307-D342 PolarHBondContact NH2-OD1 2.9Å; R307-D342 IonicContact NH2-OD2 3.71Å; R307-D342 PolarHBondContact NH2-OD2 3.18Å; R307-D342 VanDerWaalsContact NH2-OD2 3.16Å; K311-D342 HydrophobicContact CD-CB 3.99Å; K311-D342 PolarHBondContact NZ-O 2.76Å; K311-D342 PolarHBondContact NZ-OXT 3.34Å

Retrieved 342 of 342 residues in 1071.5 ms (Link to these results)

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