A0A5K4FA56_SCHMA Loading...

MFS domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FA56, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 638 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	29.6	Very low	27	Very low	244 Å²	244	136.2 Å²	136.2	100%	1.202	82%	0.816	S	S	*	*				0	107.6	0	-72.8	178.3	176.3	0	0	108.7
2	P	30.6	Very low	26.7	Very low	113 Å²	113	141.4 Å²	141.4	73%	0.734	83%	0.826	S	S	*	*			trans	-114.5	110.7	151.5	22.1	-3.8	0	0	0	108.3
3	T	27.3	Very low	26.6	Very low	136 Å²	136	144 Å²	144	83%	0.834	83%	0.825	S	S	*	*				68.3	96	107.7	56.1	0	0	0	0	114
4	C	23.1	Very low	26.4	Very low	130 Å²	130	147.6 Å²	147.6	88%	0.878	83%	0.827	S	S	*	*			trans	-73.7	128.2	161.1	-68.6	0	0	0	0	110.5
5	V	30	Very low	26.2	Very low	139 Å²	139	150.9 Å²	150.9	84%	0.842	83%	0.833	S	S	*	*			trans	-173.9	145.4	147.6	170.2	0	0	0	0	104.1
6	P	31.2	Very low	26.2	Very low	108 Å²	108	150.3 Å²	150.3	70%	0.701	83%	0.827	S	S	*	*			cis	-128	-173.2	12.8	29.9	-4.1	0	0	0	111.8
7	L	26.2	Very low	26	Very low	154 Å²	154	147.7 Å²	147.7	81%	0.806	82%	0.822	S	S	*	*				-174.6	145	56.4	-121.4	152.1	0	0	0	109.2
8	T	21.2	Very low	26	Very low	112 Å²	112	146.5 Å²	146.5	69%	0.687	82%	0.82	S	S	*	*			trans	-64.1	141	171.3	45.8	0	0	0	0	113.8
9	N	26.6	Very low	26.1	Very low	146 Å²	146	144 Å²	144	78%	0.781	81%	0.813	S	S	*	*			trans	178.2	100.7	135.5	-90.5	-7.8	0	0	0	106.8
10	S	23.4	Very low	26.1	Very low	111 Å²	111	146 Å²	146	78%	0.776	82%	0.815	S	S	*	*				48.5	80	93.3	73	0	0	0	0	114.5
11	S	27.6	Very low	26	Very low	105 Å²	105	145.2 Å²	145.2	73%	0.734	81%	0.814	S	S	*	*			trans	-146.7	101.4	142.4	44.5	0	0	0	0	108.2	E13	S11-E13 PolarHBondContact O-N 3.18Å
12	Q	23.1	Very low	25.9	Very low	199 Å²	199	138.7 Å²	138.7	93%	0.93	79%	0.79	S	S	*	*			trans	-62.9	103.7	164.7	-72.5	172.6	-42.5	0	0	108.1
13	E	25.5	Very low	25.8	Very low	175 Å²	175	138.7 Å²	138.7	82%	0.818	79%	0.788	S	S	*	*			trans	-131.8	99.3	162.3	-81.6	-173.3	160.1	0	0	109.1	S11	S11-E13 PolarHBondContact O-N 3.18Å
14	F	24.5	Very low	25.8	Very low	194 Å²	194	141.6 Å²	141.6	85%	0.851	79%	0.792	S	S	*	*			trans	35.9	94.5	148.3	-99.6	-100.9	0	0	0	116.3	L16	F14-L16 PolarHBondContact O-N 2.81Å
15	E	23.5	Very low	26.1	Very low	198 Å²	198	142.9 Å²	142.9	93%	0.925	79%	0.785	S	S	*	*			trans	-59.7	85.8	151.3	-73.3	178.7	159.3	0	0	108.7	S17	E15-S17 VanDerWaalsContact C-N 3.25Å; E15-S17 PolarHBondContact O-N 3.05Å
16	L	25	Very low	26.3	Very low	141 Å²	141	140.5 Å²	140.5	74%	0.738	78%	0.775	S	S	*	*			trans	-71.3	95	156.9	-161.5	86.3	0	0	0	105.4	F14 T18	F14-L16 PolarHBondContact O-N 2.81Å; L16-T18 VanDerWaalsContact C-N 3.31Å; L16-T18 PolarHBondContact O-N 2.81Å
17	S	24.1	Very low	26.5	Very low	106 Å²	106	140.5 Å²	140.5	74%	0.741	77%	0.768	S	S	*	*			trans	-47.7	99.5	166.7	57.2	0	0	0	0	108.2	E15 S19	E15-S17 VanDerWaalsContact C-N 3.25Å; E15-S17 PolarHBondContact O-N 3.05Å; S17-S19 PolarHBondContact O-N 2.79Å
18	T	26	Very low	27.4	Very low	126 Å²	126	138.5 Å²	138.5	77%	0.773	76%	0.762	S	S	*	*			trans	-66.3	90.1	166.9	39.3	0	0	0	0	105.6	L16 E20	L16-T18 VanDerWaalsContact C-N 3.31Å; L16-T18 PolarHBondContact O-N 2.81Å; T18-E20 PolarHBondContact O-N 2.78Å
19	S	27.1	Very low	28.9	Very low	99 Å²	99	135.9 Å²	135.9	69%	0.692	74%	0.743	S	S	*	*			trans	-48.6	110.7	160.8	54.2	0	0	0	0	106	S17 V21	S17-S19 PolarHBondContact O-N 2.79Å; S19-V21 PolarHBondContact O-N 3.48Å
20	E	26	Very low	30.7	Very low	183 Å²	183	138.2 Å²	138.2	86%	0.855	75%	0.746	S	S	*	*			trans	-45.7	107.7	169.2	-69.2	175.2	155	0	0	107	T18 P22	T18-E20 PolarHBondContact O-N 2.78Å; E20-P22 WeakPolarHBondContact O-CD 3.49Å
21	V	25.4	Very low	33.2	Very low	130 Å²	130	134.4 Å²	134.4	79%	0.788	72%	0.717	S	S	*	*			trans	-61.6	110.9	167.5	176.5	0	0	0	0	103.7	S19 T23	S19-V21 PolarHBondContact O-N 3.48Å; V21-T23 PolarHBondContact O-N 2.86Å
22	P	27.3	Very low	36	Very low	107 Å²	107	131.6 Å²	131.6	70%	0.695	70%	0.698	S	S	*	*			trans	-60.9	117.5	179.9	-14.4	28.3	0	0	0	105.2	E20 Q24	E20-P22 WeakPolarHBondContact O-CD 3.49Å; P22-Q24 PolarHBondContact O-N 2.94Å; P22-Q24 VanDerWaalsContact O-N 3.14Å
23	T	28.1	Very low	39	Very low	113 Å²	113	122.6 Å²	122.6	69%	0.693	66%	0.656	S	S	*	*			trans	-37.8	125.1	166	35.4	0	0	0	0	107.2	V21 Q25	V21-T23 PolarHBondContact O-N 2.86Å; T23-Q25 PolarHBondContact O-N 3.36Å
24	Q	27	Very low	42	Very low	198 Å²	198	117 Å²	117	93%	0.925	63%	0.632	S	S	*	*			trans	-60	73	178.5	-92.2	162.1	-37.1	0	0	109.8	P22 S26	P22-Q24 PolarHBondContact O-N 2.94Å; P22-Q24 VanDerWaalsContact O-N 3.14Å; Q24-S26 VanDerWaalsContact C-N 3.25Å; Q24-S26 PolarHBondContact O-N 3.5Å
25	Q	29.8	Very low	45	Very low	157 Å²	157	112.7 Å²	112.7	73%	0.734	61%	0.614	S	S	*	*			trans	-57.8	104.1	150.6	-75.1	-178.1	-9.5	0	0	103.3	T23 I27	T23-Q25 PolarHBondContact O-N 3.36Å; Q25-I27 PolarHBondContact O-N 3.24Å
26	S	34.5	Very low	48.1	Very low	89 Å²	89	103.5 Å²	103.5	62%	0.622	57%	0.571	S	S	*	*			trans	-56.7	90.6	162.2	43.9	0	0	0	0	106.1	Q24 T28	Q24-S26 VanDerWaalsContact C-N 3.25Å; Q24-S26 PolarHBondContact O-N 3.5Å; S26-T28 PolarHBondContact O-N 3.36Å; S26-T28 PolarHBondContact O-OG1 3.21Å
27	I	35	Very low	51.2	Low	108 Å²	108	96.8 Å²	96.8	55%	0.554	54%	0.536	S	S	*	.			trans	-66	84	171.6	-60.9	169.7	0	0	0	104.3	Q25 I29 I371	Q25-I27 PolarHBondContact O-N 3.24Å; I27-I29 VanDerWaalsContact C-N 3.35Å; I27-I29 HydrophobicContact CG2-CG1 4.49Å; I27-I29 PolarHBondContact O-N 2.87Å; I27-I371 HydrophobicContact CB-CD1 4.37Å
28	T	44.2	Very low	54.3	Low	111 Å²	111	96.3 Å²	96.3	68%	0.681	53%	0.525	S	S	*	.			trans	-70.3	103.3	173.2	-37.1	0	0	0	0	103.1	S26 K30	S26-T28 PolarHBondContact O-N 3.36Å; S26-T28 PolarHBondContact O-OG1 3.21Å; T28-K30 PolarHBondContact O-N 3.36Å
29	I	52.9	Low	57.3	Low	58 Å²	58	95.7 Å²	95.7	30%	0.297	51%	0.512	S	S	.	.			trans	-63	94.2	177.2	-61.1	172.7	0	0	0	106.4	I27 L31 L364 K367 E368	I27-I29 VanDerWaalsContact C-N 3.35Å; I27-I29 HydrophobicContact CG2-CG1 4.49Å; I27-I29 PolarHBondContact O-N 2.87Å; I29-L31 PolarHBondContact O-N 2.68Å; I29-L364 HydrophobicContact CG2-CD2 3.64Å; I29-K367 HydrophobicContact CD1-CB 4Å; I29-E368 HydrophobicContact CD1-CG 4.02Å
30	K	64.2	Low	60.3	Low	194 Å²	194	92.8 Å²	92.8	84%	0.843	49%	0.486	S	S	*	.			trans	-77.9	92	-176.5	-165.8	172.7	-177.5	177.3	0	107.7	T28 S32	T28-K30 PolarHBondContact O-N 3.36Å; K30-S32 PolarHBondContact O-N 3.16Å
31	L	77	Confident	63.3	Low	31 Å²	31	84.1 Å²	84.1	16%	0.162	45%	0.445	C	S	.	.			trans	-64.1	100.3	176.7	-164.6	77.3	0	0	0	109.7	I29 V33 I36 L325 V330 I334 F360 L364	I29-L31 PolarHBondContact O-N 2.68Å; L31-V33 PolarHBondContact O-N 3.17Å; L31-I36 HydrophobicContact CD1-CD1 3.62Å; L31-I36 HydrophobicContact CD2-CD1 4.07Å; L31-I36 HydrophobicContact CG-CD1 3.69Å; L31-L325 HydrophobicContact CD2-CD1 4.18Å; L31-L325 HydrophobicContact CD2-CD2 3.86Å; L31-V330 HydrophobicContact CD2-CG1 4.35Å; L31-I334 HydrophobicContact CD2-CG1 4.33Å; L31-F360 HydrophobicContact CD1-CE1 4.34Å; L31-F360 HydrophobicContact CD1-CZ 4.42Å; L31-L364 HydrophobicContact CD1-CD1 3.72Å
32	S	85.7	Confident	66.3	Low	47 Å²	47	78.8 Å²	78.8	33%	0.329	42%	0.417	S	S	.	.			trans	-81.3	110.8	175.6	-179.7	0	0	0	0	110.1	K30 D34 E35 I36	K30-S32 PolarHBondContact O-N 3.16Å; S32-D34 PolarHBondContact O-N 3.17Å; S32-E35 PolarHBondContact O-N 3.3Å; S32-I36 PolarHBondContact O-N 3.02Å
33	V	86.5	Confident	69.2	Low	9 Å²	9	75.5 Å²	75.5	6%	0.055	39%	0.392	C	S	.	.	H	α-helix	trans	-57.8	-38.5	176.1	179.6	0	0	0	0	110.9	L31 E35 I36 L37 P321 R322 L325 L337	L31-V33 PolarHBondContact O-N 3.17Å; V33-E35 VanDerWaalsContact C-N 3.35Å; V33-E35 PolarHBondContact O-N 3.37Å; V33-I36 PolarHBondContact O-N 3.36Å; V33-L37 HydrophobicContact CG1-CD1 3.88Å; V33-L37 HydrophobicContact CG1-CG 4.14Å; V33-L37 WeakPolarHBondContact O-CB 3.28Å; V33-L37 VanDerWaalsContact O-CG 3.31Å; V33-L37 WeakPolarHBondContact O-CG 3.12Å; V33-L37 PolarHBondContact O-N 2.8Å; V33-P321 HydrophobicContact CG1-CB 4.38Å; V33-P321 HydrophobicContact CG2-CB 4.44Å; V33-R322 HydrophobicContact CB-CG 4.18Å; V33-R322 HydrophobicContact CG1-CG 4.26Å; V33-R322 HydrophobicContact CG2-CG 3.96Å; V33-L325 HydrophobicContact CG2-CD1 3.35Å; V33-L337 HydrophobicContact CG1-CD2 4.36Å
34	D	87.6	Confident	72.1	Confident	59 Å²	59	76.3 Å²	76.3	32%	0.316	38%	0.384	S	S	.	.	H	α-helix	trans	-67.9	-36.1	-175.6	-66.3	0	0	0	0	111.8	S32 N38 N263 R322	S32-D34 PolarHBondContact O-N 3.17Å; D34-N38 VanDerWaalsContact O-CB 3.31Å; D34-N38 WeakPolarHBondContact O-CB 3.26Å; D34-N38 PolarHBondContact O-N 3.42Å; D34-N263 WeakPolarHBondContact CA-OD1 3.34Å; D34-N263 PolarHBondContact O-ND2 2.69Å; D34-R322 IonicContact OD1-CZ 3.88Å; D34-R322 IonicContact OD1-NE 3.78Å; D34-R322 IonicContact OD1-NH2 3.45Å; D34-R322 PolarHBondContact OD1-NH2 2.95Å; D34-R322 IonicContact OD2-NH2 3.03Å
35	E	87.6	Confident	75.1	Confident	103 Å²	103	67.5 Å²	67.5	48%	0.481	35%	0.346	S	S	.	.	H	α-helix	trans	-66.4	-40.8	173.2	-75.1	-166.4	-142.7	0	0	112.2	S32 V33 N38 K39	S32-E35 PolarHBondContact O-N 3.3Å; V33-E35 VanDerWaalsContact C-N 3.35Å; V33-E35 PolarHBondContact O-N 3.37Å; E35-N38 PolarHBondContact O-N 2.87Å; E35-K39 WeakPolarHBondContact O-CB 3.5Å; E35-K39 WeakPolarHBondContact O-CG 3.45Å; E35-K39 PolarHBondContact O-N 3.31Å; E35-K39 IonicContact OE2-NZ 2.76Å; E35-K39 PolarHBondContact OE2-NZ 3.49Å
36	I	89.2	Confident	78.1	Confident	4 Å²	4	63.7 Å²	63.7	2%	0.021	33%	0.333	C	S	.	.	H	α-helix	trans	-66.9	-41.1	178.5	-66.8	169.5	0	0	0	110.7	L31 S32 V33 Y40 V41 L337 F357 F360	L31-I36 HydrophobicContact CD1-CD1 3.62Å; L31-I36 HydrophobicContact CD2-CD1 4.07Å; L31-I36 HydrophobicContact CG-CD1 3.69Å; S32-I36 PolarHBondContact O-N 3.02Å; V33-I36 PolarHBondContact O-N 3.36Å; I36-Y40 HydrophobicContact CG2-CD2 4.39Å; I36-Y40 PolarHBondContact O-N 2.92Å; I36-V41 HydrophobicContact CG2-CG2 3.81Å; I36-V41 PolarHBondContact O-N 3.26Å; I36-L337 HydrophobicContact CD1-CD1 4.13Å; I36-L337 HydrophobicContact CG2-CB 4.45Å; I36-L337 HydrophobicContact CG2-CD1 4.09Å; I36-F357 HydrophobicContact CG2-CD2 4.26Å; I36-F357 HydrophobicContact CG2-CE2 3.46Å; I36-F357 VanDerWaalsContact CG2-CE2 3.46Å; I36-F357 HydrophobicContact CG2-CZ 4.07Å; I36-F360 HydrophobicContact CD1-CE1 4.2Å; I36-F360 HydrophobicContact CG1-CE1 4.15Å
37	L	89.8	Confident	80.9	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	31%	0.305	C	S	.	.	I	π-helix	trans	-61.9	-45.3	174.9	-72.3	175.8	0	0	0	111.4	V33 V41 G42 N263 L337	V33-L37 HydrophobicContact CG1-CD1 3.88Å; V33-L37 HydrophobicContact CG1-CG 4.14Å; V33-L37 WeakPolarHBondContact O-CB 3.28Å; V33-L37 VanDerWaalsContact O-CG 3.31Å; V33-L37 WeakPolarHBondContact O-CG 3.12Å; V33-L37 PolarHBondContact O-N 2.8Å; L37-V41 HydrophobicContact CD2-CB 3.97Å; L37-V41 HydrophobicContact CD2-CG1 3.91Å; L37-V41 HydrophobicContact CD2-CG2 4.44Å; L37-G42 CarbonylContact O-C 3.59Å; L37-G42 VanDerWaalsContact O-C 3.27Å; L37-G42 VanDerWaalsContact O-CA 3.24Å; L37-G42 WeakPolarHBondContact O-CA 3.48Å; L37-G42 PolarHBondContact O-N 3.49Å; L37-N263 WeakPolarHBondContact CD1-OD1 3.29Å; L37-L337 HydrophobicContact CD2-CD2 4.15Å
38	N	89.7	Confident	83.7	Confident	96 Å²	96	54.8 Å²	54.8	51%	0.513	28%	0.279	S	S	.	.	I	π-helix	trans	-68.6	-50.7	-179.5	-169.9	-1.7	0	0	0	112.3	D34 E35 E43	D34-N38 VanDerWaalsContact O-CB 3.31Å; D34-N38 WeakPolarHBondContact O-CB 3.26Å; D34-N38 PolarHBondContact O-N 3.42Å; E35-N38 PolarHBondContact O-N 2.87Å; N38-E43 HydrophobicContact CB-CG 4.34Å
39	K	88.8	Confident	86.1	Confident	112 Å²	112	54.1 Å²	54.1	49%	0.487	26%	0.264	S	S	.	.	I	π-helix	trans	-74.6	-47.5	-174.1	-67.7	174	-179.6	162.8	0	112.5	E35 K353	E35-K39 WeakPolarHBondContact O-CB 3.5Å; E35-K39 WeakPolarHBondContact O-CG 3.45Å; E35-K39 PolarHBondContact O-N 3.31Å; E35-K39 IonicContact OE2-NZ 2.76Å; E35-K39 PolarHBondContact OE2-NZ 3.49Å; K39-K353 PolarHBondContact O-NZ 2.8Å
40	Y	89.6	Confident	88.1	Confident	39 Å²	39	54 Å²	54	15%	0.153	27%	0.269	C	S	.	.	I	π-helix	trans	-113.6	-54.4	-164.8	-52.6	-71.4	0	0	0	114.3	I36 H345 Q356 F357 F360	I36-Y40 HydrophobicContact CG2-CD2 4.39Å; I36-Y40 PolarHBondContact O-N 2.92Å; Y40-H345 PolarHBondContact O-NE2 3.16Å; Y40-Q356 HydrophobicContact CD1-CB 4.21Å; Y40-Q356 HydrophobicContact CE1-CB 4.1Å; Y40-F357 HydrophobicContact CD1-CB 4.22Å; Y40-F357 HydrophobicContact CD1-CD2 4.42Å; Y40-F357 AromaticContact CD2-CD2 3.74Å; Y40-F357 HydrophobicContact CD2-CD2 3.74Å; Y40-F357 HydrophobicContact CD2-CE2 4.33Å; Y40-F357 HydrophobicContact CE2-CD2 4.46Å; Y40-F357 HydrophobicContact CG-CB 4.2Å; Y40-F357 AromaticContact CG-CD2 3.71Å; Y40-F357 HydrophobicContact CG-CD2 3.71Å; Y40-F357 HydrophobicContact CG-CG 4.39Å; Y40-F360 HydrophobicContact CE1-CB 4.5Å; Y40-F360 HydrophobicContact CE2-CB 4.32Å; Y40-F360 HydrophobicContact CE2-CD1 4.02Å; Y40-F360 HydrophobicContact CE2-CD2 4.36Å; Y40-F360 HydrophobicContact CE2-CE1 4.42Å; Y40-F360 AromaticContact CE2-CG 3.97Å; Y40-F360 HydrophobicContact CE2-CG 3.97Å; Y40-F360 AromaticContact CZ-CG 4Å
41	V	88.8	Confident	89.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.23	C	C	.	.	I	π-helix	trans	-77.8	-37	-168.6	177.8	0	0	0	0	112.9	I36 L37 W47 L337 C341 N344	I36-V41 HydrophobicContact CG2-CG2 3.81Å; I36-V41 PolarHBondContact O-N 3.26Å; L37-V41 HydrophobicContact CD2-CB 3.97Å; L37-V41 HydrophobicContact CD2-CG1 3.91Å; L37-V41 HydrophobicContact CD2-CG2 4.44Å; V41-W47 HydrophobicContact CG1-CZ3 4.42Å; V41-L337 HydrophobicContact CG2-CB 4.33Å; V41-L337 HydrophobicContact CG2-CD2 4.37Å; V41-C341 HydrophobicContact CB-CB 4.42Å; V41-C341 HydrophobicContact CG2-CB 4.04Å; V41-N344 WeakPolarHBondContact O-CB 3.32Å; V41-N344 PolarHBondContact O-ND2 3.12Å
42	G	89	Confident	90.3	Very high	19 Å²	19	43.4 Å²	43.4	20%	0.196	22%	0.222	C	C	.	.			trans	98.9	131	-168.5	0	0	0	0	0	112	L37 Q48	L37-G42 CarbonylContact O-C 3.59Å; L37-G42 VanDerWaalsContact O-C 3.27Å; L37-G42 VanDerWaalsContact O-CA 3.24Å; L37-G42 WeakPolarHBondContact O-CA 3.48Å; L37-G42 PolarHBondContact O-N 3.49Å; G42-Q48 PolarHBondContact O-NE2 3.35Å
43	E	87.8	Confident	90.6	Very high	37 Å²	37	46 Å²	46	17%	0.173	23%	0.231	C	C	.	.	S	Bend	trans	-73.6	-33.3	-174.3	-51.3	-179.8	117.4	0	0	112.8	N38 T262 N263 Y266	N38-E43 HydrophobicContact CB-CG 4.34Å; E43-T262 PolarHBondContact O-OG1 2.9Å; E43-N263 HydrophobicContact CB-CB 4.38Å; E43-N263 HydrophobicContact CG-CB 4.43Å; E43-N263 WeakPolarHBondContact CG-ND2 3.46Å; E43-N263 PolarHBondContact OE1-ND2 3.26Å; E43-Y266 HydrophobicContact CB-CD2 3.93Å; E43-Y266 HydrophobicContact CB-CE2 3.95Å; E43-Y266 VanDerWaalsContact OE2-CE2 3.31Å; E43-Y266 WeakPolarHBondContact OE2-CE2 3.32Å
44	Y	89.1	Confident	90.9	Very high	130 Å²	130	46.3 Å²	46.3	51%	0.51	23%	0.232	S	C	.	.	S	Bend	trans	-140.5	86.3	179.3	63.5	-78.8	0	0	0	109.7	Y266	Y44-Y266 AromaticContact CD1-CD1 3.95Å; Y44-Y266 HydrophobicContact CD1-CD1 3.95Å; Y44-Y266 AromaticContact CD1-CD2 3.98Å; Y44-Y266 HydrophobicContact CD1-CD2 3.98Å; Y44-Y266 AromaticContact CD1-CE1 3.57Å; Y44-Y266 HydrophobicContact CD1-CE1 3.57Å; Y44-Y266 AromaticContact CD1-CE2 3.62Å; Y44-Y266 HydrophobicContact CD1-CE2 3.62Å; Y44-Y266 HydrophobicContact CD1-CG 4.14Å; Y44-Y266 AromaticContact CD1-CZ 3.39Å; Y44-Y266 AromaticContact CE1-CE1 3.82Å; Y44-Y266 HydrophobicContact CE1-CE1 3.82Å; Y44-Y266 HydrophobicContact CE1-CE2 4.03Å; Y44-Y266 AromaticContact CE1-CZ 3.47Å; Y44-Y266 VanDerWaalsContact CE1-CZ 3.47Å; Y44-Y266 WeakPolarHBondContact CE1-OH 3.35Å; Y44-Y266 HydrophobicContact CG-CD1 4.18Å; Y44-Y266 HydrophobicContact CG-CE1 4.12Å; Y44-Y266 HydrophobicContact CG-CG 4.47Å
45	G	90.8	Very high	91.2	Very high	14 Å²	14	43.6 Å²	43.6	14%	0.144	22%	0.218	C	C	.	.			trans	-114	-179.3	179.9	0	0	0	0	0	113.5	W47 Q48 W49 N344	G45-W47 PolarHBondContact O-N 2.99Å; G45-Q48 PolarHBondContact O-N 2.87Å; G45-W49 PolarHBondContact O-N 2.74Å; G45-N344 VanDerWaalsContact C-OD1 3.3Å; G45-N344 VanDerWaalsContact CA-OD1 3.27Å; G45-N344 WeakPolarHBondContact CA-OD1 3.3Å
46	V	92	Very high	91.4	Very high	76 Å²	76	39.5 Å²	39.5	46%	0.461	20%	0.2	S	C	.	.	H	α-helix	trans	-61.2	-32.1	177.8	176.4	0	0	0	0	111.5	S50 N344 L347	V46-S50 WeakPolarHBondContact O-CB 3.21Å; V46-S50 PolarHBondContact O-N 2.96Å; V46-S50 PolarHBondContact O-OG 3.39Å; V46-N344 PolarHBondContact N-OD1 2.87Å; V46-N344 VanDerWaalsContact N-OD1 3.11Å; V46-L347 HydrophobicContact CB-CD1 4.43Å; V46-L347 HydrophobicContact CG1-CD1 4.46Å; V46-L347 HydrophobicContact CG2-CD1 3.69Å
47	W	93.5	Very high	91.5	Very high	7 Å²	7	43.7 Å²	43.7	3%	0.027	22%	0.222	C	C	.	.	H	α-helix	trans	-60.7	-52.8	174.5	176.2	58	0	0	0	111.7	V41 G45 W49 S50 I51 L261 P318 I336 I343 N344	V41-W47 HydrophobicContact CG1-CZ3 4.42Å; G45-W47 PolarHBondContact O-N 2.99Å; W47-W49 PolarHBondContact O-N 2.88Å; W47-S50 PolarHBondContact O-N 3.49Å; W47-S50 PolarHBondContact O-OG 3.01Å; W47-I51 HydrophobicContact CD2-CD1 4.25Å; W47-I51 HydrophobicContact CG-CD1 4.46Å; W47-I51 HydrophobicContact CZ2-CD1 4.2Å; W47-I51 WeakPolarHBondContact O-CG1 3.28Å; W47-I51 PolarHBondContact O-N 3.48Å; W47-L261 HydrophobicContact CH2-CD1 4.47Å; W47-L261 HydrophobicContact CH2-CD2 3.63Å; W47-L261 HydrophobicContact CH2-CG 4.43Å; W47-L261 HydrophobicContact CZ2-CD2 4.16Å; W47-L261 HydrophobicContact CZ3-CB 4.5Å; W47-L261 HydrophobicContact CZ3-CD2 4.37Å; W47-P318 HydrophobicContact CZ2-CB 4.06Å; W47-P318 HydrophobicContact CZ2-CG 3.79Å; W47-I336 HydrophobicContact CH2-CG2 4.2Å; W47-I336 HydrophobicContact CZ2-CG2 3.99Å; W47-I343 HydrophobicContact CB-CB 4.04Å; W47-I343 HydrophobicContact CB-CG2 3.77Å; W47-I343 HydrophobicContact CG-CB 4.48Å; W47-I343 HydrophobicContact CG-CD1 4.45Å; W47-I343 HydrophobicContact CG-CG2 4.49Å; W47-N344 WeakPolarHBondContact CB-OD1 3.46Å; W47-N344 PolarHBondContact N-OD1 3.26Å
48	Q	94.6	Very high	91.5	Very high	3 Å²	3	43.7 Å²	43.7	1%	0.014	22%	0.222	C	C	.	.	H	α-helix	trans	-63.5	-44.5	178.8	-66.5	94.2	-24.5	0	0	111.9	G42 G45 S50 I51 V52 L261 F270 N344	G42-Q48 PolarHBondContact O-NE2 3.35Å; G45-Q48 PolarHBondContact O-N 2.87Å; Q48-S50 VanDerWaalsContact C-N 3.32Å; Q48-S50 PolarHBondContact O-N 3.25Å; Q48-I51 PolarHBondContact O-N 3.37Å; Q48-V52 WeakPolarHBondContact O-CG2 3.46Å; Q48-V52 PolarHBondContact O-N 2.93Å; Q48-L261 HydrophobicContact CG-CB 4.37Å; Q48-L261 PolarHBondContact NE2-O 3Å; Q48-F270 HydrophobicContact CB-CE1 4.35Å; Q48-F270 HydrophobicContact CB-CE2 4.18Å; Q48-F270 HydrophobicContact CB-CZ 3.66Å; Q48-N344 PolarHBondContact OE1-ND2 3.38Å; Q48-N344 PolarHBondContact OE1-OD1 3.3Å
49	W	94.4	Very high	91.4	Very high	97 Å²	97	39.7 Å²	39.7	37%	0.367	20%	0.202	S	C	.	.	H	α-helix	trans	-63.3	-35.6	176.8	-82.9	110.4	0	0	0	112.9	G45 W47 I51 V52 L53 F270 F273	G45-W49 PolarHBondContact O-N 2.74Å; W47-W49 PolarHBondContact O-N 2.88Å; W49-I51 VanDerWaalsContact C-N 3.31Å; W49-I51 PolarHBondContact O-N 2.96Å; W49-V52 HydrophobicContact CE3-CB 4.41Å; W49-V52 HydrophobicContact CE3-CG1 4.19Å; W49-V52 HydrophobicContact CZ3-CG1 4.19Å; W49-V52 PolarHBondContact O-N 3.12Å; W49-L53 WeakPolarHBondContact O-CB 3.21Å; W49-L53 PolarHBondContact O-N 3.44Å; W49-F270 AromaticContact CD1-CE1 3.97Å; W49-F270 HydrophobicContact CD2-CD1 4.09Å; W49-F270 AromaticContact CD2-CE1 3.54Å; W49-F270 HydrophobicContact CD2-CE1 3.54Å; W49-F270 AromaticContact CE2-CE1 3.4Å; W49-F270 HydrophobicContact CE3-CD1 4.07Å; W49-F270 AromaticContact CE3-CE1 3.98Å; W49-F270 HydrophobicContact CE3-CE1 3.98Å; W49-F270 AromaticContact CG-CE1 3.91Å; W49-F270 HydrophobicContact CG-CE1 3.91Å; W49-F270 AromaticContact CH2-CD1 3.92Å; W49-F270 HydrophobicContact CH2-CD1 3.92Å; W49-F270 HydrophobicContact CH2-CE1 4.16Å; W49-F270 AromaticContact CZ2-CD1 3.94Å; W49-F270 HydrophobicContact CZ2-CD1 3.94Å; W49-F270 AromaticContact CZ2-CE1 3.74Å; W49-F270 HydrophobicContact CZ2-CE1 3.74Å; W49-F270 AromaticContact CZ3-CD1 3.98Å; W49-F270 HydrophobicContact CZ3-CD1 3.98Å; W49-F270 HydrophobicContact CZ3-CE1 4.26Å; W49-F270 AromaticContact NE1-CE1 3.68Å; W49-F273 HydrophobicContact CH2-CB 4.25Å; W49-F273 HydrophobicContact CH2-CG 4.4Å; W49-F273 HydrophobicContact CZ3-CB 3.9Å; W49-F273 HydrophobicContact CZ3-CD1 4.05Å; W49-F273 AromaticContact CZ3-CD2 3.99Å; W49-F273 HydrophobicContact CZ3-CD2 3.99Å; W49-F273 AromaticContact CZ3-CG 3.71Å; W49-F273 HydrophobicContact CZ3-CG 3.71Å
50	S	93.5	Very high	91.3	Very high	56 Å²	56	34.8 Å²	34.8	39%	0.392	18%	0.181	S	C	.	.	H	α-helix	trans	-64.3	-36	175.7	72.9	0	0	0	0	112.3	V46 W47 Q48 L54	V46-S50 WeakPolarHBondContact O-CB 3.21Å; V46-S50 PolarHBondContact O-N 2.96Å; V46-S50 PolarHBondContact O-OG 3.39Å; W47-S50 PolarHBondContact O-N 3.49Å; W47-S50 PolarHBondContact O-OG 3.01Å; Q48-S50 VanDerWaalsContact C-N 3.32Å; Q48-S50 PolarHBondContact O-N 3.25Å; S50-L54 VanDerWaalsContact O-CB 3.32Å; S50-L54 WeakPolarHBondContact O-CB 3.5Å; S50-L54 PolarHBondContact O-N 2.93Å
51	I	93.8	Very high	91	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.015	18%	0.183	C	C	.	.	H	α-helix	trans	-70.6	-42.9	176.2	-65.1	163.5	0	0	0	110.2	W47 Q48 W49 L53 L54 I55 L257 L261 L317 P318	W47-I51 HydrophobicContact CD2-CD1 4.25Å; W47-I51 HydrophobicContact CG-CD1 4.46Å; W47-I51 HydrophobicContact CZ2-CD1 4.2Å; W47-I51 WeakPolarHBondContact O-CG1 3.28Å; W47-I51 PolarHBondContact O-N 3.48Å; Q48-I51 PolarHBondContact O-N 3.37Å; W49-I51 VanDerWaalsContact C-N 3.31Å; W49-I51 PolarHBondContact O-N 2.96Å; I51-L53 VanDerWaalsContact C-N 3.35Å; I51-L53 PolarHBondContact O-N 3.16Å; I51-L54 WeakPolarHBondContact O-CB 3.31Å; I51-L54 PolarHBondContact O-N 3.15Å; I51-I55 HydrophobicContact CG2-CD1 3.9Å; I51-I55 VanDerWaalsContact O-CG1 3.26Å; I51-I55 WeakPolarHBondContact O-CG1 3.33Å; I51-I55 PolarHBondContact O-N 3.09Å; I51-L257 HydrophobicContact CG2-CD2 4.21Å; I51-L261 HydrophobicContact CD1-CD1 3.46Å; I51-L261 VanDerWaalsContact CD1-CD1 3.46Å; I51-L261 HydrophobicContact CG2-CD1 4.33Å; I51-L317 HydrophobicContact CG2-CD1 4.15Å; I51-P318 HydrophobicContact CD1-CG 3.47Å; I51-P318 VanDerWaalsContact CD1-CG 3.47Å; I51-P318 HydrophobicContact CG1-CG 4.44Å
52	V	93.7	Very high	91	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.5	-44.9	175.3	167.1	0	0	0	0	111.3	Q48 W49 L54 I55 V56 P258 F270 F273 I274	Q48-V52 WeakPolarHBondContact O-CG2 3.46Å; Q48-V52 PolarHBondContact O-N 2.93Å; W49-V52 HydrophobicContact CE3-CB 4.41Å; W49-V52 HydrophobicContact CE3-CG1 4.19Å; W49-V52 HydrophobicContact CZ3-CG1 4.19Å; W49-V52 PolarHBondContact O-N 3.12Å; V52-L54 PolarHBondContact O-N 3.14Å; V52-I55 PolarHBondContact O-N 2.71Å; V52-V56 WeakPolarHBondContact O-CG2 3.35Å; V52-V56 PolarHBondContact O-N 2.85Å; V52-P258 HydrophobicContact CG2-CB 3.75Å; V52-P258 HydrophobicContact CG2-CG 3.85Å; V52-F270 HydrophobicContact CB-CD1 4.42Å; V52-F270 HydrophobicContact CG2-CB 4Å; V52-F270 HydrophobicContact CG2-CD1 3.63Å; V52-F270 HydrophobicContact CG2-CE1 4.24Å; V52-F270 HydrophobicContact CG2-CG 3.91Å; V52-F273 HydrophobicContact CG1-CB 4.42Å; V52-F273 HydrophobicContact CG1-CD1 3.51Å; V52-F273 HydrophobicContact CG1-CE1 4.2Å; V52-F273 HydrophobicContact CG1-CG 4.33Å; V52-I274 HydrophobicContact CG1-CD1 4.47Å; V52-I274 HydrophobicContact CG1-CG1 3.88Å; V52-I274 HydrophobicContact CG2-CD1 4.47Å
53	L	93.3	Very high	91	Very high	100 Å²	100	34.5 Å²	34.5	52%	0.524	18%	0.178	S	C	.	.	H	α-helix	trans	-62.1	-43	175.9	-178.1	64.1	0	0	0	111.6	W49 I51 I55 V56 L57	W49-L53 WeakPolarHBondContact O-CB 3.21Å; W49-L53 PolarHBondContact O-N 3.44Å; I51-L53 VanDerWaalsContact C-N 3.35Å; I51-L53 PolarHBondContact O-N 3.16Å; L53-I55 VanDerWaalsContact C-N 3.35Å; L53-I55 PolarHBondContact O-N 3.41Å; L53-V56 PolarHBondContact O-N 2.9Å; L53-L57 WeakPolarHBondContact O-CB 3.46Å; L53-L57 PolarHBondContact O-N 3.12Å
54	L	93.3	Very high	91.2	Very high	16 Å²	16	33.1 Å²	33.1	8%	0.084	17%	0.172	C	C	.	.	H	α-helix	trans	-60.6	-43.2	175.5	178.5	61.4	0	0	0	111.5	S50 I51 V52 L57 S58 M312 Y313 L316	S50-L54 VanDerWaalsContact O-CB 3.32Å; S50-L54 WeakPolarHBondContact O-CB 3.5Å; S50-L54 PolarHBondContact O-N 2.93Å; I51-L54 WeakPolarHBondContact O-CB 3.31Å; I51-L54 PolarHBondContact O-N 3.15Å; V52-L54 PolarHBondContact O-N 3.14Å; L54-L57 PolarHBondContact O-N 3.5Å; L54-S58 VanDerWaalsContact O-CB 3.23Å; L54-S58 WeakPolarHBondContact O-CB 3.3Å; L54-S58 PolarHBondContact O-N 2.81Å; L54-S58 PolarHBondContact O-OG 3.28Å; L54-M312 HydrophobicContact CD1-CB 3.99Å; L54-Y313 HydrophobicContact CD1-CD1 4.26Å; L54-Y313 HydrophobicContact CD1-CE1 4.12Å; L54-Y313 HydrophobicContact CD2-CD1 3.9Å; L54-Y313 HydrophobicContact CD2-CE1 4.2Å; L54-Y313 HydrophobicContact CG-CD1 4.06Å; L54-Y313 HydrophobicContact CG-CE1 3.86Å; L54-L316 HydrophobicContact CD2-CB 3.85Å; L54-L316 HydrophobicContact CD2-CD1 4.34Å
55	I	92.6	Very high	91.5	Very high	2 Å²	2	27 Å²	27	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-62.6	-44.7	176.7	-69.8	163.8	0	0	0	111.2	I51 V52 L53 S58 S59 L254 P258 I274	I51-I55 HydrophobicContact CG2-CD1 3.9Å; I51-I55 VanDerWaalsContact O-CG1 3.26Å; I51-I55 WeakPolarHBondContact O-CG1 3.33Å; I51-I55 PolarHBondContact O-N 3.09Å; V52-I55 PolarHBondContact O-N 2.71Å; L53-I55 VanDerWaalsContact C-N 3.35Å; L53-I55 PolarHBondContact O-N 3.41Å; I55-S58 WeakPolarHBondContact CA-OG 3.36Å; I55-S58 PolarHBondContact O-N 2.93Å; I55-S58 PolarHBondContact O-OG 3.14Å; I55-S58 VanDerWaalsContact O-OG 3.1Å; I55-S59 WeakPolarHBondContact O-CB 3.46Å; I55-S59 PolarHBondContact O-N 2.93Å; I55-S59 PolarHBondContact O-OG 3.26Å; I55-L254 HydrophobicContact CD1-CB 4.35Å; I55-L254 WeakPolarHBondContact CD1-O 3.34Å; I55-L254 HydrophobicContact CG1-CB 4.17Å; I55-L254 HydrophobicContact CG1-CD1 4.38Å; I55-L254 HydrophobicContact CG1-CD2 4.13Å; I55-L254 HydrophobicContact CG1-CG 4.48Å; I55-L254 HydrophobicContact CG2-CB 4.11Å; I55-P258 HydrophobicContact CD1-CG 3.38Å; I55-I274 HydrophobicContact CG2-CG2 4.33Å
56	V	92.2	Very high	91.6	Very high	18 Å²	18	26.4 Å²	26.4	11%	0.109	14%	0.142	C	C	.	.	H	α-helix	trans	-60.8	-51.3	176.8	167	0	0	0	0	110.4	V52 L53 S58 S59 F273 I274 H282	V52-V56 WeakPolarHBondContact O-CG2 3.35Å; V52-V56 PolarHBondContact O-N 2.85Å; L53-V56 PolarHBondContact O-N 2.9Å; V56-S58 PolarHBondContact O-N 2.82Å; V56-S59 PolarHBondContact O-N 3.04Å; V56-F273 HydrophobicContact CG2-CD1 3.99Å; V56-F273 HydrophobicContact CG2-CE1 4.06Å; V56-I274 HydrophobicContact CG2-CB 4.47Å; V56-I274 HydrophobicContact CG2-CG1 4.32Å; V56-H282 PolarHBondContact O-CD2 2.82Å; V56-H282 PolarHBondContact O-NE2 2.7Å
57	L	90.8	Very high	91.7	Very high	92 Å²	92	22.9 Å²	22.9	48%	0.482	12%	0.121	S	C	.	.	H	α-helix	trans	-63	-33.3	-177.2	-173.5	61.4	0	0	0	111.8	L53 L54 P306 T309	L53-L57 WeakPolarHBondContact O-CB 3.46Å; L53-L57 PolarHBondContact O-N 3.12Å; L54-L57 PolarHBondContact O-N 3.5Å; L57-P306 WeakPolarHBondContact O-CB 3.45Å; L57-T309 HydrophobicContact CD2-CG2 3.87Å; L57-T309 HydrophobicContact CG-CG2 3.99Å
58	S	90.8	Very high	91.7	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.007	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.2	-173.8	55.5	0	0	0	0	116.3	L54 I55 V56 P60 K250 P306 T309 Y313	L54-S58 VanDerWaalsContact O-CB 3.23Å; L54-S58 WeakPolarHBondContact O-CB 3.3Å; L54-S58 PolarHBondContact O-N 2.81Å; L54-S58 PolarHBondContact O-OG 3.28Å; I55-S58 WeakPolarHBondContact CA-OG 3.36Å; I55-S58 PolarHBondContact O-N 2.93Å; I55-S58 PolarHBondContact O-OG 3.14Å; I55-S58 VanDerWaalsContact O-OG 3.1Å; V56-S58 PolarHBondContact O-N 2.82Å; S58-P60 VanDerWaalsContact C-CD 3.47Å; S58-P60 WeakPolarHBondContact O-CD 3.31Å; S58-K250 PolarHBondContact O-NZ 2.92Å; S58-P306 WeakPolarHBondContact CA-O 3.38Å; S58-T309 WeakPolarHBondContact CA-OG1 3.47Å; S58-T309 WeakPolarHBondContact CB-OG1 3.47Å; S58-Y313 WeakPolarHBondContact CB-OH 3.46Å; S58-Y313 PolarHBondContact OG-OH 2.65Å
59	S	87.2	Confident	91.6	Very high	12 Å²	12	22.5 Å²	22.5	8%	0.084	12%	0.119	C	C	.	.			trans	-115.9	72.8	-170.1	-59.6	0	0	0	0	113.2	I55 V56 H282	I55-S59 WeakPolarHBondContact O-CB 3.46Å; I55-S59 PolarHBondContact O-N 2.93Å; I55-S59 PolarHBondContact O-OG 3.26Å; V56-S59 PolarHBondContact O-N 3.04Å; S59-H282 PolarHBondContact O-CD2 3.15Å; S59-H282 PolarHBondContact O-NE2 3.33Å
60	P	86.8	Confident	91.5	Very high	8 Å²	8	18 Å²	18	5%	0.052	10%	0.102	C	C	.	.			trans	-64.6	148.5	175.5	28.8	-34	0	0	0	111.4	S58 S303 M304 C307	S58-P60 VanDerWaalsContact C-CD 3.47Å; S58-P60 WeakPolarHBondContact O-CD 3.31Å; P60-S303 VanDerWaalsContact CB-O 3.25Å; P60-S303 WeakPolarHBondContact CB-O 3.39Å; P60-M304 HydrophobicContact CB-CE 3.82Å; P60-M304 HydrophobicContact CG-CE 3.35Å; P60-C307 VanDerWaalsContact CD-SG 3.52Å; P60-C307 WeakPolarHBondContact CG-SG 3.35Å
61	L	84.2	Confident	91.3	Very high	36 Å²	36	15.3 Å²	15.3	19%	0.188	8%	0.084	C	C	.	.			trans	-105.8	87.1	-174.4	-170.9	62.2	0	0	0	111.6	V63 T64 V278 H282 R283	L61-V63 VanDerWaalsContact C-N 3.31Å; L61-V63 HydrophobicContact CD1-CG1 3.87Å; L61-V63 HydrophobicContact CD2-CG1 4.36Å; L61-V63 HydrophobicContact CG-CG1 3.88Å; L61-V63 PolarHBondContact O-N 3.46Å; L61-T64 PolarHBondContact O-OG1 3.13Å; L61-V278 HydrophobicContact CB-CG1 4.46Å; L61-V278 HydrophobicContact CD1-CG1 4.44Å; L61-H282 HydrophobicContact CB-CB 4.29Å; L61-R283 HydrophobicContact CD2-CG 3.68Å
62	M	87.4	Confident	91.1	Very high	6 Å²	6	16.8 Å²	16.8	3%	0.03	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-80.8	-3.4	-173.6	-64.1	-54.6	-91.6	0	0	116.3	T64 L65 F189 R240 V243 N300 M304	M62-T64 PolarHBondContact O-N 2.67Å; M62-L65 HydrophobicContact CE-CD2 3.91Å; M62-L65 PolarHBondContact O-N 2.88Å; M62-F189 HydrophobicContact CB-CE2 4.17Å; M62-F189 HydrophobicContact CB-CZ 4.14Å; M62-R240 PolarHBondContact O-NH2 3.19Å; M62-V243 HydrophobicContact CB-CG1 4.16Å; M62-V243 HydrophobicContact CG-CG1 4.2Å; M62-N300 WeakPolarHBondContact CE-OD1 3.4Å; M62-M304 HydrophobicContact CE-CE 3.69Å; M62-M304 HydrophobicContact CE-CG 4.09Å; M62-M304 HydrophobicContact CE-SD 4.44Å; M62-M304 HydrophobicContact CG-CE 3.12Å; M62-M304 HydrophobicContact CG-SD 4.47Å; M62-M304 HydrophobicContact SD-CE 3.36Å; M62-M304 WeakPolarHBondContact SD-CE 3.46Å
63	V	90.4	Very high	91	Very high	10 Å²	10	16.8 Å²	16.8	6%	0.061	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-64.8	-24.2	176.3	74.3	0	0	0	0	112.1	L61 P66 F189 M193 L422	L61-V63 VanDerWaalsContact C-N 3.31Å; L61-V63 HydrophobicContact CD1-CG1 3.87Å; L61-V63 HydrophobicContact CD2-CG1 4.36Å; L61-V63 HydrophobicContact CG-CG1 3.88Å; L61-V63 PolarHBondContact O-N 3.46Å; V63-P66 VanDerWaalsContact O-CD 3.23Å; V63-P66 WeakPolarHBondContact O-CD 3.49Å; V63-F189 HydrophobicContact CB-CE1 3.87Å; V63-F189 HydrophobicContact CB-CZ 4.43Å; V63-F189 HydrophobicContact CG2-CE1 3.95Å; V63-M193 HydrophobicContact CG2-SD 4.1Å; V63-L422 HydrophobicContact CG2-CD2 3.94Å
64	T	91.3	Very high	90.8	Very high	8 Å²	8	14.3 Å²	14.3	5%	0.049	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-88.9	-12.8	-179	42.3	0	0	0	0	114.2	L61 M62 V67 R283 M286 T425	L61-T64 PolarHBondContact O-OG1 3.13Å; M62-T64 PolarHBondContact O-N 2.67Å; T64-V67 VanDerWaalsContact O-CB 3.31Å; T64-V67 WeakPolarHBondContact O-CB 3.43Å; T64-V67 WeakPolarHBondContact O-CG2 3.23Å; T64-V67 PolarHBondContact O-N 3.48Å; T64-R283 HydrophobicContact CG2-CG 4.09Å; T64-M286 VanDerWaalsContact CB-CE 3.42Å; T64-M286 WeakPolarHBondContact OG1-CE 3.41Å; T64-T425 HydrophobicContact CG2-CG2 3.92Å
65	L	94.2	Very high	90.8	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-51.7	-42.7	177.9	-174.9	69.5	0	0	0	114.1	M62 V67 F68 V69 L299 N300	M62-L65 HydrophobicContact CE-CD2 3.91Å; M62-L65 PolarHBondContact O-N 2.88Å; L65-V67 PolarHBondContact O-N 3.42Å; L65-V67 VanDerWaalsContact O-N 3.07Å; L65-F68 PolarHBondContact O-N 2.91Å; L65-F68 VanDerWaalsContact O-N 3.13Å; L65-V69 HydrophobicContact CD1-CG1 3.77Å; L65-V69 HydrophobicContact CG-CG1 3.97Å; L65-V69 HydrophobicContact CG-CG2 4Å; L65-V69 PolarHBondContact O-N 2.78Å; L65-V69 VanDerWaalsContact O-N 3.12Å; L65-L299 HydrophobicContact CD1-CD2 4.21Å; L65-L299 HydrophobicContact CD1-CG 4.23Å; L65-N300 HydrophobicContact CD2-CB 4.33Å; L65-N300 WeakPolarHBondContact CD2-OD1 3.22Å
66	P	94	Very high	90.9	Very high	3 Å²	3	15.2 Å²	15.2	2%	0.019	8%	0.083	C	C	.	.	H	α-helix	trans	-58.5	-21	178.6	-20.8	32.4	0	0	0	114.6	V63 F68 N70 T186 L426	V63-P66 VanDerWaalsContact O-CD 3.23Å; V63-P66 WeakPolarHBondContact O-CD 3.49Å; P66-F68 VanDerWaalsContact C-N 3.27Å; P66-F68 PolarHBondContact O-N 3.35Å; P66-N70 HydrophobicContact CB-CB 4.29Å; P66-N70 WeakPolarHBondContact O-CA 3.39Å; P66-N70 VanDerWaalsContact O-CB 3.28Å; P66-N70 WeakPolarHBondContact O-CB 3.22Å; P66-N70 PolarHBondContact O-N 3.07Å; P66-T186 HydrophobicContact CB-CG2 4.23Å; P66-T186 HydrophobicContact CG-CG2 3.98Å; P66-L426 HydrophobicContact CB-CD2 4.16Å; P66-L426 HydrophobicContact CG-CD2 4.29Å
67	V	93.3	Very high	91	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.012	8%	0.078	C	C	.	.	H	α-helix	trans	-60.1	-44.2	177.5	178.7	0	0	0	0	109.7	T64 L65 L426 K429 I435 T439	T64-V67 VanDerWaalsContact O-CB 3.31Å; T64-V67 WeakPolarHBondContact O-CB 3.43Å; T64-V67 WeakPolarHBondContact O-CG2 3.23Å; T64-V67 PolarHBondContact O-N 3.48Å; L65-V67 PolarHBondContact O-N 3.42Å; L65-V67 VanDerWaalsContact O-N 3.07Å; V67-L426 HydrophobicContact CG2-CD2 4.14Å; V67-K429 HydrophobicContact CG1-CB 4.24Å; V67-K429 WeakPolarHBondContact O-CB 2.98Å; V67-I435 HydrophobicContact CG1-CD1 4.01Å; V67-I435 HydrophobicContact CG1-CG1 4.11Å; V67-I435 VanDerWaalsContact O-CD1 3.26Å; V67-I435 WeakPolarHBondContact O-CD1 3.29Å; V67-T439 HydrophobicContact CB-CG2 4.37Å; V67-T439 HydrophobicContact CG1-CG2 3.45Å; V67-T439 VanDerWaalsContact CG1-CG2 3.45Å
68	F	93.8	Very high	91.1	Very high	1 Å²	1	15.2 Å²	15.2	0%	0.004	8%	0.075	C	C	.	.	H	α-helix	trans	-81.2	-53.4	177.5	-59.4	-82.9	0	0	0	111.8	L65 P66 N70 Y164 M286 T287 A290 L299 I435 Y436 T439	L65-F68 PolarHBondContact O-N 2.91Å; L65-F68 VanDerWaalsContact O-N 3.13Å; P66-F68 VanDerWaalsContact C-N 3.27Å; P66-F68 PolarHBondContact O-N 3.35Å; F68-N70 PolarHBondContact O-N 2.76Å; F68-Y164 HydrophobicContact CB-CD1 4.24Å; F68-Y164 HydrophobicContact CB-CD2 4.4Å; F68-Y164 HydrophobicContact CB-CG 4Å; F68-Y164 HydrophobicContact CD1-CD2 4.21Å; F68-Y164 HydrophobicContact CD1-CG 4.41Å; F68-M286 HydrophobicContact CD2-CE 3.91Å; F68-M286 HydrophobicContact CE2-CE 3.49Å; F68-M286 VanDerWaalsContact CE2-CE 3.49Å; F68-T287 HydrophobicContact CZ-CG2 4.39Å; F68-A290 HydrophobicContact CD1-CB 3.8Å; F68-A290 HydrophobicContact CE1-CB 3.73Å; F68-A290 HydrophobicContact CG-CB 4.22Å; F68-A290 HydrophobicContact CZ-CB 4.12Å; F68-L299 HydrophobicContact CB-CD2 4.16Å; F68-L299 HydrophobicContact CG-CD2 4.44Å; F68-I435 HydrophobicContact CD1-CD1 4.12Å; F68-I435 HydrophobicContact CD1-CG1 4.38Å; F68-I435 HydrophobicContact CD1-CG2 4.45Å; F68-I435 HydrophobicContact CE1-CG1 4.28Å; F68-I435 HydrophobicContact CE1-CG2 4.37Å; F68-Y436 HydrophobicContact CD1-CE1 4.36Å; F68-Y436 AromaticContact CE1-CD1 3.86Å; F68-Y436 HydrophobicContact CE1-CD1 3.86Å; F68-Y436 HydrophobicContact CE1-CE1 4.06Å; F68-T439 HydrophobicContact CE1-CG2 4.39Å; F68-T439 HydrophobicContact CE2-CG2 4.11Å; F68-T439 HydrophobicContact CZ-CG2 3.75Å; F68-T439 WeakPolarHBondContact CZ-OG1 3.34Å
69	V	93.3	Very high	91.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-84.2	-16.4	-164.5	-48.5	0	0	0	0	114.3	L65 T167 V168 W296 L299	L65-V69 HydrophobicContact CD1-CG1 3.77Å; L65-V69 HydrophobicContact CG-CG1 3.97Å; L65-V69 HydrophobicContact CG-CG2 4Å; L65-V69 PolarHBondContact O-N 2.78Å; L65-V69 VanDerWaalsContact O-N 3.12Å; V69-T167 WeakPolarHBondContact O-CB 3.32Å; V69-V168 HydrophobicContact CB-CB 4.49Å; V69-V168 HydrophobicContact CB-CG2 3.87Å; V69-V168 HydrophobicContact CG2-CG2 3.95Å; V69-V168 PolarHBondContact O-N 3.48Å; V69-W296 HydrophobicContact CB-CB 4.2Å; V69-W296 HydrophobicContact CG1-CB 3.61Å; V69-L299 HydrophobicContact CG1-CD2 4.42Å
70	N	92.5	Very high	91.4	Very high	2 Å²	2	17.3 Å²	17.3	1%	0.011	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	20.9	176	-63.8	-1	0	0	0	112.2	P66 F68 V169 T186 K429	P66-N70 HydrophobicContact CB-CB 4.29Å; P66-N70 WeakPolarHBondContact O-CA 3.39Å; P66-N70 VanDerWaalsContact O-CB 3.28Å; P66-N70 WeakPolarHBondContact O-CB 3.22Å; P66-N70 PolarHBondContact O-N 3.07Å; F68-N70 PolarHBondContact O-N 2.76Å; N70-V169 HydrophobicContact CB-CG2 4.48Å; N70-T186 PolarHBondContact ND2-OG1 3.05Å; N70-K429 PolarHBondContact O-NZ 3.23Å
71	A	88.9	Confident	91.5	Very high	1 Å²	1	22 Å²	22	1%	0.008	11%	0.107	C	C	.	.			trans	-64.4	137.4	163.3	0	0	0	0	0	108.7	P73 T167	A71-P73 VanDerWaalsContact O-CD 3.29Å; A71-P73 WeakPolarHBondContact O-CD 3.2Å; A71-T167 HydrophobicContact CB-CG2 4.27Å
72	V	89.2	Confident	91.7	Very high	33 Å²	33	24.1 Å²	24.1	20%	0.2	12%	0.124	C	C	.	.			trans	-93.5	111.2	177.6	-177.9	0	0	0	0	107.2	Q163 V169 V175 I179	V72-Q163 PolarHBondContact O-NE2 3.23Å; V72-V169 HydrophobicContact CG2-CG1 4.5Å; V72-V175 HydrophobicContact CG1-CG1 4.44Å; V72-I179 HydrophobicContact CG2-CD1 4.39Å
73	P	90.7	Very high	91.8	Very high	1 Å²	1	24 Å²	24	1%	0.006	12%	0.123	C	C	.	.			trans	-73.7	161.7	172.8	30.9	-34.2	0	0	0	110.9	A71 H75 Y157 A170	A71-P73 VanDerWaalsContact O-CD 3.29Å; A71-P73 WeakPolarHBondContact O-CD 3.2Å; P73-H75 PolarHBondContact O-ND1 2.93Å; P73-Y157 HydrophobicContact CG-CD1 3.65Å; P73-Y157 HydrophobicContact CG-CE1 4.38Å; P73-Y157 HydrophobicContact CG-CG 4.21Å; P73-A170 HydrophobicContact CG-CB 4.26Å
74	D	90.9	Very high	91.8	Very high	47 Å²	47	24.1 Å²	24.1	25%	0.251	12%	0.123	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	139.9	170.5	-59.6	-33.5	0	0	0	108.3	F94 Y157 R158 K160	D74-F94 HydrophobicContact CB-CE1 3.87Å; D74-F94 HydrophobicContact CB-CZ 4.33Å; D74-Y157 CarbonylContact O-C 3.59Å; D74-Y157 WeakPolarHBondContact O-CA 3.46Å; D74-R158 PolarHBondContact N-O 3.19Å; D74-R158 PolarHBondContact O-N 2.88Å; D74-K160 WeakPolarHBondContact OD1-CE 3.46Å; D74-K160 IonicContact OD1-NZ 3.36Å; D74-K160 PolarHBondContact OD1-NZ 3.14Å; D74-K160 WeakPolarHBondContact OD2-CE 3.21Å; D74-K160 IonicContact OD2-NZ 2.79Å
75	H	93.2	Very high	91.7	Very high	19 Å²	19	29.6 Å²	29.6	9%	0.088	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	149.6	-173.4	55.7	-76.8	0	0	0	111.2	P73 M113 G114 I156 Y157 C176	P73-H75 PolarHBondContact O-ND1 2.93Å; H75-M113 PolarHBondContact NE2-O 3.4Å; H75-G114 WeakPolarHBondContact O-CA 3.37Å; H75-I156 WeakPolarHBondContact CA-O 3.4Å; H75-Y157 HydrophobicContact CB-CD1 3.61Å; H75-Y157 HydrophobicContact CB-CE1 3.6Å; H75-C176 PolarHBondContact NE2-SG 2.95Å; H75-C176 VanDerWaalsContact NE2-SG 3.35Å
76	R	93.9	Very high	91.5	Very high	18 Å²	18	30.4 Å²	30.4	7%	0.068	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	160.6	170.1	67.2	175.7	-179	79	-5.5	109.7	R78 E84 F94 A98 Y155 I156	R76-R78 PolarHBondContact O-N 3.36Å; R76-E84 IonicContact CZ-OE1 3.09Å; R76-E84 IonicContact CZ-OE2 3.01Å; R76-E84 IonicContact NH1-OE1 2.68Å; R76-E84 PolarHBondContact NH1-OE1 3Å; R76-E84 IonicContact NH1-OE2 3.72Å; R76-E84 PolarHBondContact NH1-OE2 2.86Å; R76-E84 IonicContact NH2-OE1 2.78Å; R76-E84 IonicContact NH2-OE2 2.65Å; R76-E84 PolarHBondContact NH2-OE2 2.99Å; R76-F94 HydrophobicContact CB-CE2 4.49Å; R76-F94 HydrophobicContact CB-CZ 4.19Å; R76-F94 HydrophobicContact CG-CD2 4.48Å; R76-F94 HydrophobicContact CG-CE2 3.78Å; R76-F94 HydrophobicContact CG-CZ 3.98Å; R76-A98 HydrophobicContact CB-CB 3.74Å; R76-A98 HydrophobicContact CG-CB 4.41Å; R76-Y155 CarbonylContact O-C 3.58Å; R76-Y155 VanDerWaalsContact O-CA 3.27Å; R76-Y155 WeakPolarHBondContact O-CA 3.32Å; R76-I156 HydrophobicContact CG-CB 4.22Å; R76-I156 PolarHBondContact N-O 3.35Å; R76-I156 PolarHBondContact O-N 3.35Å
77	C	94.2	Very high	91.3	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.007	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	135.1	171.2	-63.7	0	0	0	0	110.4	V101 G114 R116 R117 C151	C77-V101 HydrophobicContact CB-CG1 3.98Å; C77-G114 PolarHBondContact N-O 3.4Å; C77-R116 VanDerWaalsContact SG-C 3.57Å; C77-R117 HydrophobicContact CB-CB 4.19Å; C77-C151 WeakPolarHBondContact CA-SG 3.46Å; C77-C151 HydrophobicContact CB-CB 3.62Å; C77-C151 WeakPolarHBondContact CB-SG 3.46Å; C77-C151 WeakPolarHBondContact SG-CB 3.31Å; C77-C151 CovalentContact SG-SG 2.02Å; C77-C151 PolarHBondContact SG-SG 2.8Å
78	R	93.5	Very high	91.1	Very high	110 Å²	110	37.8 Å²	37.8	42%	0.415	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-74.6	123.5	166.4	-179.2	171.3	176	-178.7	-3.4	108.5	R76 D81 N153 G154 I156	R76-R78 PolarHBondContact O-N 3.36Å; R78-D81 IonicContact NH2-OD1 3.85Å; R78-D81 PolarHBondContact NH2-OD1 3.46Å; R78-N153 HydrophobicContact CB-CB 4.43Å; R78-N153 HydrophobicContact CG-CB 4.43Å; R78-G154 PolarHBondContact N-O 3.05Å; R78-I156 HydrophobicContact CB-CD1 4.22Å; R78-I156 HydrophobicContact CB-CG1 3.92Å; R78-I156 HydrophobicContact CG-CD1 4.03Å; R78-I156 HydrophobicContact CG-CG1 4.05Å
79	M	91.7	Very high	90.9	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-84.2	168.5	174.5	-58.9	-52.6	-67	0	0	111.1	M83 E84 F87 V101 W122	M79-M83 HydrophobicContact CB-CB 3.77Å; M79-E84 HydrophobicContact CB-CG 4.09Å; M79-E84 WeakPolarHBondContact CB-OE1 3.48Å; M79-E84 PolarHBondContact N-OE1 3.48Å; M79-F87 HydrophobicContact CB-CE2 4.31Å; M79-F87 HydrophobicContact CG-CE2 3.77Å; M79-F87 HydrophobicContact CG-CZ 4.3Å; M79-V101 HydrophobicContact CG-CG1 4.27Å; M79-V101 HydrophobicContact CG-CG2 3.59Å; M79-V101 HydrophobicContact SD-CB 4.3Å; M79-V101 HydrophobicContact SD-CG1 3.46Å; M79-V101 WeakPolarHBondContact SD-CG1 3.37Å; M79-V101 HydrophobicContact SD-CG2 3.82Å; M79-W122 HydrophobicContact CE-CB 4.01Å; M79-W122 HydrophobicContact CE-CD2 3.04Å; M79-W122 HydrophobicContact CE-CE3 3.33Å; M79-W122 HydrophobicContact CE-CG 3.33Å; M79-W122 HydrophobicContact CE-CH2 4.16Å; M79-W122 HydrophobicContact CE-CZ2 3.9Å; M79-W122 HydrophobicContact CE-CZ3 3.88Å
80	E	91.5	Very high	90.6	Very high	56 Å²	56	47.7 Å²	47.7	26%	0.262	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-55.7	145.6	170.4	-60.7	78.3	-174.3	0	0	110	P82 M83 E84 R117 W122	E80-P82 VanDerWaalsContact C-N 3.32Å; E80-P82 VanDerWaalsContact O-N 3.15Å; E80-M83 WeakPolarHBondContact O-CB 3.48Å; E80-M83 PolarHBondContact O-N 2.94Å; E80-E84 PolarHBondContact O-N 3.37Å; E80-E84 VanDerWaalsContact O-N 3.16Å; E80-R117 IonicContact OE1-CZ 2.77Å; E80-R117 IonicContact OE1-NH1 2.61Å; E80-R117 PolarHBondContact OE1-NH1 3.16Å; E80-R117 IonicContact OE1-NH2 3.39Å; E80-R117 IonicContact OE2-NH1 2.94Å; E80-R117 PolarHBondContact OE2-NH1 3.36Å; E80-W122 WeakPolarHBondContact OE2-CB 3.35Å
81	D	89.2	Confident	90.5	Very high	106 Å²	106	54.5 Å²	54.5	57%	0.567	27%	0.267	S	S	*	.	H	α-helix	trans	-53.5	-38.4	-171.3	-62	-44.2	0	0	0	114.4	R78 M83 E84 E85	R78-D81 IonicContact NH2-OD1 3.85Å; R78-D81 PolarHBondContact NH2-OD1 3.46Å; D81-M83 VanDerWaalsContact C-N 3.3Å; D81-M83 PolarHBondContact O-N 2.96Å; D81-E84 PolarHBondContact O-N 3.5Å; D81-E85 PolarHBondContact O-N 2.71Å
82	P	88.5	Confident	90.6	Very high	81 Å²	81	56.9 Å²	56.9	53%	0.526	28%	0.279	S	S	.	.	H	α-helix	trans	-60.1	-36.2	174.6	-24.2	34.6	0	0	0	113.8	E80 I86	E80-P82 VanDerWaalsContact C-N 3.32Å; E80-P82 VanDerWaalsContact O-N 3.15Å; P82-I86 WeakPolarHBondContact O-CG1 3.34Å; P82-I86 PolarHBondContact O-N 2.6Å; P82-I86 VanDerWaalsContact O-N 3.14Å
83	M	88.7	Confident	90.7	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-74.4	-37.2	178.8	-77	-54.9	-44	0	0	112	M79 E80 D81 E85 I86 F87 W122 I128	M79-M83 HydrophobicContact CB-CB 3.77Å; E80-M83 WeakPolarHBondContact O-CB 3.48Å; E80-M83 PolarHBondContact O-N 2.94Å; D81-M83 VanDerWaalsContact C-N 3.3Å; D81-M83 PolarHBondContact O-N 2.96Å; M83-E85 VanDerWaalsContact C-N 3.28Å; M83-E85 PolarHBondContact O-N 3.37Å; M83-I86 HydrophobicContact CE-CD1 4.38Å; M83-I86 PolarHBondContact O-N 2.99Å; M83-I86 HydrophobicContact SD-CD1 3.91Å; M83-F87 HydrophobicContact CE-CD1 4.41Å; M83-F87 HydrophobicContact CE-CE1 3.66Å; M83-F87 HydrophobicContact CE-CZ 3.86Å; M83-F87 WeakPolarHBondContact O-CD2 3.38Å; M83-F87 VanDerWaalsContact O-CG 3.25Å; M83-F87 WeakPolarHBondContact O-CG 3.41Å; M83-F87 PolarHBondContact O-N 2.77Å; M83-W122 HydrophobicContact CE-CE3 4.44Å; M83-W122 HydrophobicContact CE-CZ3 4.43Å; M83-W122 HydrophobicContact CG-CE3 4.38Å; M83-I128 HydrophobicContact CE-CB 4.34Å; M83-I128 HydrophobicContact CE-CG2 3.38Å; M83-I128 HydrophobicContact SD-CB 4.16Å; M83-I128 HydrophobicContact SD-CD1 3.95Å; M83-I128 HydrophobicContact SD-CG2 3.81Å
84	E	91.1	Very high	90.7	Very high	14 Å²	14	58.5 Å²	58.5	7%	0.065	29%	0.289	C	S	.	.	H	α-helix	trans	-67.7	-29.7	174.6	-67.4	-63.1	161.3	0	0	112.4	R76 M79 E80 D81 K88 I156	R76-E84 IonicContact CZ-OE1 3.09Å; R76-E84 IonicContact CZ-OE2 3.01Å; R76-E84 IonicContact NH1-OE1 2.68Å; R76-E84 PolarHBondContact NH1-OE1 3Å; R76-E84 IonicContact NH1-OE2 3.72Å; R76-E84 PolarHBondContact NH1-OE2 2.86Å; R76-E84 IonicContact NH2-OE1 2.78Å; R76-E84 IonicContact NH2-OE2 2.65Å; R76-E84 PolarHBondContact NH2-OE2 2.99Å; M79-E84 HydrophobicContact CB-CG 4.09Å; M79-E84 WeakPolarHBondContact CB-OE1 3.48Å; M79-E84 PolarHBondContact N-OE1 3.48Å; E80-E84 PolarHBondContact O-N 3.37Å; E80-E84 VanDerWaalsContact O-N 3.16Å; D81-E84 PolarHBondContact O-N 3.5Å; E84-K88 WeakPolarHBondContact O-CG 3.34Å; E84-K88 PolarHBondContact O-N 3.05Å; E84-I156 HydrophobicContact CG-CD1 4.27Å; E84-I156 VanDerWaalsContact OE1-CD1 3.27Å; E84-I156 WeakPolarHBondContact OE1-CD1 3.37Å; E84-I156 VanDerWaalsContact OE2-CD1 3.26Å; E84-I156 WeakPolarHBondContact OE2-CD1 3.05Å
85	E	89.7	Confident	90.8	Very high	122 Å²	122	59.7 Å²	59.7	57%	0.57	29%	0.293	S	S	*	.	H	α-helix	trans	-68.5	-46.1	171.8	-166.9	166.1	-155.6	0	0	111.2	D81 M83 F87 K88 D89	D81-E85 PolarHBondContact O-N 2.71Å; M83-E85 VanDerWaalsContact C-N 3.28Å; M83-E85 PolarHBondContact O-N 3.37Å; E85-F87 VanDerWaalsContact C-N 3.31Å; E85-F87 PolarHBondContact O-N 2.95Å; E85-K88 CarbonylContact O-C 3.5Å; E85-K88 WeakPolarHBondContact O-CA 3.41Å; E85-K88 WeakPolarHBondContact O-CB 3.42Å; E85-K88 PolarHBondContact O-N 2.96Å; E85-D89 PolarHBondContact O-N 3.1Å
86	I	88.8	Confident	90.7	Very high	19 Å²	19	63.9 Å²	63.9	10%	0.097	31%	0.313	C	S	.	.	H	α-helix	trans	-55.4	-45.5	173.3	-69.6	167	0	0	0	111.1	P82 M83 K88 D89 Y90 L132	P82-I86 WeakPolarHBondContact O-CG1 3.34Å; P82-I86 PolarHBondContact O-N 2.6Å; P82-I86 VanDerWaalsContact O-N 3.14Å; M83-I86 HydrophobicContact CE-CD1 4.38Å; M83-I86 PolarHBondContact O-N 2.99Å; M83-I86 HydrophobicContact SD-CD1 3.91Å; I86-K88 PolarHBondContact O-N 3.25Å; I86-D89 PolarHBondContact O-N 3.38Å; I86-Y90 HydrophobicContact CG2-CD2 3.7Å; I86-Y90 HydrophobicContact CG2-CE2 3.91Å; I86-Y90 VanDerWaalsContact O-CD2 3.29Å; I86-Y90 WeakPolarHBondContact O-CD2 3.44Å; I86-Y90 PolarHBondContact O-N 2.55Å; I86-L132 HydrophobicContact CG2-CD1 3.61Å
87	F	90.6	Very high	90.6	Very high	6 Å²	6	63.1 Å²	63.1	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-61.2	-33.1	178.2	-62.9	-22.8	0	0	0	113	M79 M83 E85 N91 L92 A97 F100 V101 L132	M79-F87 HydrophobicContact CB-CE2 4.31Å; M79-F87 HydrophobicContact CG-CE2 3.77Å; M79-F87 HydrophobicContact CG-CZ 4.3Å; M83-F87 HydrophobicContact CE-CD1 4.41Å; M83-F87 HydrophobicContact CE-CE1 3.66Å; M83-F87 HydrophobicContact CE-CZ 3.86Å; M83-F87 WeakPolarHBondContact O-CD2 3.38Å; M83-F87 VanDerWaalsContact O-CG 3.25Å; M83-F87 WeakPolarHBondContact O-CG 3.41Å; M83-F87 PolarHBondContact O-N 2.77Å; E85-F87 VanDerWaalsContact C-N 3.31Å; E85-F87 PolarHBondContact O-N 2.95Å; F87-N91 PolarHBondContact O-N 3.47Å; F87-L92 HydrophobicContact CB-CD1 4.34Å; F87-L92 HydrophobicContact CD1-CD1 3.56Å; F87-L92 HydrophobicContact CE1-CD1 4.22Å; F87-L92 HydrophobicContact CG-CD1 4.22Å; F87-L92 PolarHBondContact O-N 3.31Å; F87-A97 HydrophobicContact CD2-CB 4.25Å; F87-A97 HydrophobicContact CG-CB 4.43Å; F87-F100 AromaticContact CE1-CD1 3.7Å; F87-F100 HydrophobicContact CE1-CD1 3.7Å; F87-F100 HydrophobicContact CE1-CE1 4.06Å; F87-F100 AromaticContact CZ-CD1 3.88Å; F87-F100 HydrophobicContact CZ-CD1 3.88Å; F87-F100 HydrophobicContact CZ-CE1 4.38Å; F87-V101 HydrophobicContact CE2-CG2 3.7Å; F87-V101 HydrophobicContact CZ-CG2 3.67Å; F87-L132 HydrophobicContact CD1-CD1 4.42Å; F87-L132 HydrophobicContact CE1-CD1 4.22Å
88	K	89.8	Confident	90.5	Very high	153 Å²	153	63.2 Å²	63.2	67%	0.665	31%	0.311	S	S	*	.	H	α-helix	trans	-74.3	-42.6	174.5	-69.9	171.3	-174.2	173.2	0	111.9	E84 E85 I86 Y90 N91	E84-K88 WeakPolarHBondContact O-CG 3.34Å; E84-K88 PolarHBondContact O-N 3.05Å; E85-K88 CarbonylContact O-C 3.5Å; E85-K88 WeakPolarHBondContact O-CA 3.41Å; E85-K88 WeakPolarHBondContact O-CB 3.42Å; E85-K88 PolarHBondContact O-N 2.96Å; I86-K88 PolarHBondContact O-N 3.25Å; K88-Y90 VanDerWaalsContact C-N 3.27Å; K88-Y90 PolarHBondContact O-N 2.99Å; K88-N91 PolarHBondContact O-N 3.47Å; K88-N91 PolarHBondContact O-OD1 2.93Å
89	D	89.7	Confident	90.4	Very high	118 Å²	118	59.3 Å²	59.3	63%	0.631	30%	0.302	S	S	*	.	H	α-helix	trans	-60.2	-39.8	179.2	-72.8	-16.4	0	0	0	111.7	E85 I86 N91	E85-D89 PolarHBondContact O-N 3.1Å; I86-D89 PolarHBondContact O-N 3.38Å; D89-N91 VanDerWaalsContact C-N 3.28Å; D89-N91 PolarHBondContact O-N 3.49Å
90	Y	87.2	Confident	90.3	Very high	91 Å²	91	61.4 Å²	61.4	36%	0.357	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	2.1	175.7	-74.2	-77.2	0	0	0	114.1	I86 K88 L92 E129 L133	I86-Y90 HydrophobicContact CG2-CD2 3.7Å; I86-Y90 HydrophobicContact CG2-CE2 3.91Å; I86-Y90 VanDerWaalsContact O-CD2 3.29Å; I86-Y90 WeakPolarHBondContact O-CD2 3.44Å; I86-Y90 PolarHBondContact O-N 2.55Å; K88-Y90 VanDerWaalsContact C-N 3.27Å; K88-Y90 PolarHBondContact O-N 2.99Å; Y90-L92 PolarHBondContact O-N 3.37Å; Y90-E129 HydrophobicContact CE2-CG 4.19Å; Y90-E129 PolarHBondContact OH-OE1 3.48Å; Y90-L133 HydrophobicContact CE1-CD2 3.62Å; Y90-L133 HydrophobicContact CE1-CG 4.48Å
91	N	90	Very high	90.3	Very high	145 Å²	145	58.9 Å²	58.9	78%	0.775	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	41.3	-176.4	-77	-42.7	0	0	0	113.2	F87 K88 D89 S93	F87-N91 PolarHBondContact O-N 3.47Å; K88-N91 PolarHBondContact O-N 3.47Å; K88-N91 PolarHBondContact O-OD1 2.93Å; D89-N91 VanDerWaalsContact C-N 3.28Å; D89-N91 PolarHBondContact O-N 3.49Å; N91-S93 PolarHBondContact O-N 3.15Å
92	L	89.9	Confident	90.4	Very high	51 Å²	51	53.9 Å²	53.9	27%	0.267	27%	0.273	S	S	.	.			trans	-66	133.2	177.8	-66	179.2	0	0	0	110	F87 Y90 E96 A97 L132	F87-L92 HydrophobicContact CB-CD1 4.34Å; F87-L92 HydrophobicContact CD1-CD1 3.56Å; F87-L92 HydrophobicContact CE1-CD1 4.22Å; F87-L92 HydrophobicContact CG-CD1 4.22Å; F87-L92 PolarHBondContact O-N 3.31Å; Y90-L92 PolarHBondContact O-N 3.37Å; L92-E96 HydrophobicContact CB-CB 4.46Å; L92-E96 HydrophobicContact CD2-CB 4.39Å; L92-A97 HydrophobicContact CB-CB 4.38Å; L92-L132 HydrophobicContact CD1-CD2 3.94Å
93	S	91.9	Very high	90.5	Very high	42 Å²	42	51.1 Å²	51.1	29%	0.294	26%	0.256	S	S	.	.			trans	-63.2	160.1	169.7	63.7	0	0	0	0	110.7	N91 E95 E96 A97	N91-S93 PolarHBondContact O-N 3.15Å; S93-E95 PolarHBondContact O-N 2.98Å; S93-E96 WeakPolarHBondContact CB-OE2 3.48Å; S93-E96 PolarHBondContact N-OE2 2.94Å; S93-E96 PolarHBondContact O-N 3.36Å; S93-E96 WeakPolarHBondContact OG-CB 3.4Å; S93-E96 WeakPolarHBondContact OG-CG 3.09Å; S93-E96 PolarHBondContact OG-N 3.47Å; S93-E96 PolarHBondContact OG-OE2 2.81Å; S93-A97 WeakPolarHBondContact O-CB 3.46Å; S93-A97 PolarHBondContact O-N 2.96Å
94	F	91.7	Very high	90.6	Very high	26 Å²	26	52.3 Å²	52.3	11%	0.114	26%	0.26	C	S	.	.	H	α-helix	trans	-57.3	-40.3	178.7	179	-91.6	0	0	0	111.7	D74 R76 A98 W104 I156 R158	D74-F94 HydrophobicContact CB-CE1 3.87Å; D74-F94 HydrophobicContact CB-CZ 4.33Å; R76-F94 HydrophobicContact CB-CE2 4.49Å; R76-F94 HydrophobicContact CB-CZ 4.19Å; R76-F94 HydrophobicContact CG-CD2 4.48Å; R76-F94 HydrophobicContact CG-CE2 3.78Å; R76-F94 HydrophobicContact CG-CZ 3.98Å; F94-A98 WeakPolarHBondContact O-CB 3.46Å; F94-A98 PolarHBondContact O-N 3.27Å; F94-W104 AromaticContact CE1-CH2 3.96Å; F94-W104 HydrophobicContact CE1-CH2 3.96Å; F94-W104 HydrophobicContact CE1-CZ2 4.35Å; F94-I156 HydrophobicContact CE2-CG2 4.18Å; F94-R158 HydrophobicContact CD1-CB 4.16Å; F94-R158 HydrophobicContact CD2-CB 3.77Å; F94-R158 HydrophobicContact CE1-CB 4.18Å; F94-R158 HydrophobicContact CE2-CB 3.78Å; F94-R158 HydrophobicContact CG-CB 3.96Å; F94-R158 HydrophobicContact CG-CG 4.48Å; F94-R158 HydrophobicContact CZ-CB 3.98Å
95	E	91.4	Very high	90.4	Very high	72 Å²	72	59 Å²	59	34%	0.336	29%	0.291	S	S	.	.	H	α-helix	trans	-69.2	-42.4	179.8	-62.8	70.4	-148.9	0	0	111.6	S93 A98 A99 R158	S93-E95 PolarHBondContact O-N 2.98Å; E95-A98 PolarHBondContact O-N 3.4Å; E95-A99 VanDerWaalsContact O-CB 3.29Å; E95-A99 WeakPolarHBondContact O-CB 3.38Å; E95-A99 PolarHBondContact O-N 3.45Å; E95-R158 IonicContact OE1-CZ 3.22Å; E95-R158 IonicContact OE1-NH1 3.84Å; E95-R158 PolarHBondContact OE1-NH1 2.89Å; E95-R158 IonicContact OE2-NH1 3.49Å; E95-R158 PolarHBondContact OE2-NH1 3.34Å
96	E	90.9	Very high	90.1	Very high	108 Å²	108	57 Å²	57	51%	0.505	30%	0.303	S	S	.	.	H	α-helix	trans	-64.5	-45.2	175.8	-73.5	164.4	147.7	0	0	111.5	L92 S93 A98 A99 F100	L92-E96 HydrophobicContact CB-CB 4.46Å; L92-E96 HydrophobicContact CD2-CB 4.39Å; S93-E96 WeakPolarHBondContact CB-OE2 3.48Å; S93-E96 PolarHBondContact N-OE2 2.94Å; S93-E96 PolarHBondContact O-N 3.36Å; S93-E96 WeakPolarHBondContact OG-CB 3.4Å; S93-E96 WeakPolarHBondContact OG-CG 3.09Å; S93-E96 PolarHBondContact OG-N 3.47Å; S93-E96 PolarHBondContact OG-OE2 2.81Å; E96-A98 VanDerWaalsContact C-N 3.34Å; E96-A98 PolarHBondContact O-N 2.83Å; E96-A99 PolarHBondContact O-N 3.49Å; E96-F100 WeakPolarHBondContact O-CB 3.39Å; E96-F100 PolarHBondContact O-N 3.3Å
97	A	92.2	Very high	90	Very high	2 Å²	2	59.4 Å²	59.4	2%	0.017	31%	0.314	C	S	.	.	H	α-helix	trans	-62.8	-42.2	176	0	0	0	0	0	111.2	F87 L92 S93 F100 V101	F87-A97 HydrophobicContact CD2-CB 4.25Å; F87-A97 HydrophobicContact CG-CB 4.43Å; L92-A97 HydrophobicContact CB-CB 4.38Å; S93-A97 WeakPolarHBondContact O-CB 3.46Å; S93-A97 PolarHBondContact O-N 2.96Å; A97-F100 PolarHBondContact O-N 3.39Å; A97-V101 WeakPolarHBondContact O-CB 3.42Å; A97-V101 VanDerWaalsContact O-CG2 3.23Å; A97-V101 WeakPolarHBondContact O-CG2 3.48Å; A97-V101 PolarHBondContact O-N 2.89Å
98	A	92.8	Very high	89.8	Confident	3 Å²	3	61.4 Å²	61.4	3%	0.025	33%	0.327	C	S	.	.	H	α-helix	trans	-66.4	-42.9	178.8	0	0	0	0	0	112.6	R76 F94 E95 E96 F100 V101 G102 W104	R76-A98 HydrophobicContact CB-CB 3.74Å; R76-A98 HydrophobicContact CG-CB 4.41Å; F94-A98 WeakPolarHBondContact O-CB 3.46Å; F94-A98 PolarHBondContact O-N 3.27Å; E95-A98 PolarHBondContact O-N 3.4Å; E96-A98 VanDerWaalsContact C-N 3.34Å; E96-A98 PolarHBondContact O-N 2.83Å; A98-F100 VanDerWaalsContact C-N 3.29Å; A98-F100 PolarHBondContact O-N 3.47Å; A98-V101 PolarHBondContact O-N 3.03Å; A98-G102 PolarHBondContact O-N 3.23Å; A98-G102 VanDerWaalsContact O-N 3.12Å; A98-W104 HydrophobicContact CB-CD2 3.73Å; A98-W104 HydrophobicContact CB-CE3 3.41Å; A98-W104 VanDerWaalsContact CB-CE3 3.41Å; A98-W104 HydrophobicContact CB-CH2 3.55Å; A98-W104 HydrophobicContact CB-CZ2 3.85Å; A98-W104 HydrophobicContact CB-CZ3 3.32Å
99	A	90.3	Very high	89.5	Confident	28 Å²	28	57.5 Å²	57.5	23%	0.231	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-31.9	174.5	0	0	0	0	0	112.9	E95 E96 G102 W104 R143	E95-A99 VanDerWaalsContact O-CB 3.29Å; E95-A99 WeakPolarHBondContact O-CB 3.38Å; E95-A99 PolarHBondContact O-N 3.45Å; E96-A99 PolarHBondContact O-N 3.49Å; A99-G102 VanDerWaalsContact O-O 3.11Å; A99-W104 HydrophobicContact CB-CB 3.93Å; A99-W104 HydrophobicContact CB-CG 4.11Å; A99-R143 PolarHBondContact O-NH2 3.12Å
100	F	89.7	Confident	89.1	Confident	45 Å²	45	56.6 Å²	56.6	20%	0.197	32%	0.317	C	S	.	.	H	α-helix	trans	-72	-43.2	174.8	-174.8	-104.7	0	0	0	112.5	F87 E96 A97 A98 W122 I128 L131 L132	F87-F100 AromaticContact CE1-CD1 3.7Å; F87-F100 HydrophobicContact CE1-CD1 3.7Å; F87-F100 HydrophobicContact CE1-CE1 4.06Å; F87-F100 AromaticContact CZ-CD1 3.88Å; F87-F100 HydrophobicContact CZ-CD1 3.88Å; F87-F100 HydrophobicContact CZ-CE1 4.38Å; E96-F100 WeakPolarHBondContact O-CB 3.39Å; E96-F100 PolarHBondContact O-N 3.3Å; A97-F100 PolarHBondContact O-N 3.39Å; A98-F100 VanDerWaalsContact C-N 3.29Å; A98-F100 PolarHBondContact O-N 3.47Å; F100-W122 HydrophobicContact CD1-CH2 4.38Å; F100-W122 HydrophobicContact CD1-CZ3 4.32Å; F100-W122 HydrophobicContact CE1-CH2 4.18Å; F100-W122 AromaticContact CE1-CZ3 3.82Å; F100-W122 HydrophobicContact CE1-CZ3 3.82Å; F100-I128 HydrophobicContact CE1-CG2 3.58Å; F100-I128 HydrophobicContact CZ-CG2 3.67Å; F100-L131 HydrophobicContact CE2-CB 4.29Å; F100-L131 HydrophobicContact CZ-CB 4.25Å; F100-L132 HydrophobicContact CD1-CD2 3.65Å; F100-L132 HydrophobicContact CD1-CG 4.31Å; F100-L132 HydrophobicContact CD2-CD2 3.51Å; F100-L132 HydrophobicContact CD2-CG 4.33Å; F100-L132 HydrophobicContact CE1-CD1 4.16Å; F100-L132 HydrophobicContact CE1-CD2 3.57Å; F100-L132 HydrophobicContact CE1-CG 3.71Å; F100-L132 HydrophobicContact CE2-CD2 3.46Å; F100-L132 VanDerWaalsContact CE2-CD2 3.46Å; F100-L132 HydrophobicContact CE2-CG 3.76Å; F100-L132 HydrophobicContact CG-CD2 3.61Å; F100-L132 HydrophobicContact CZ-CD1 4.29Å; F100-L132 HydrophobicContact CZ-CD2 3.49Å; F100-L132 VanDerWaalsContact CZ-CD2 3.49Å; F100-L132 HydrophobicContact CZ-CG 3.42Å; F100-L132 VanDerWaalsContact CZ-CG 3.42Å
101	V	91.4	Very high	88.8	Confident	2 Å²	2	55 Å²	55	1%	0.012	32%	0.319	C	S	.	.	H	α-helix	trans	-69.6	-36.9	-176.4	167.1	0	0	0	0	112.9	C77 M79 F87 A97 A98 R117 F118	C77-V101 HydrophobicContact CB-CG1 3.98Å; M79-V101 HydrophobicContact CG-CG1 4.27Å; M79-V101 HydrophobicContact CG-CG2 3.59Å; M79-V101 HydrophobicContact SD-CB 4.3Å; M79-V101 HydrophobicContact SD-CG1 3.46Å; M79-V101 WeakPolarHBondContact SD-CG1 3.37Å; M79-V101 HydrophobicContact SD-CG2 3.82Å; F87-V101 HydrophobicContact CE2-CG2 3.7Å; F87-V101 HydrophobicContact CZ-CG2 3.67Å; A97-V101 WeakPolarHBondContact O-CB 3.42Å; A97-V101 VanDerWaalsContact O-CG2 3.23Å; A97-V101 WeakPolarHBondContact O-CG2 3.48Å; A97-V101 PolarHBondContact O-N 2.89Å; A98-V101 PolarHBondContact O-N 3.03Å; V101-R117 HydrophobicContact CG1-CB 3.67Å; V101-R117 CarbonylContact O-C 3.53Å; V101-R117 WeakPolarHBondContact O-CA 3.47Å; V101-F118 VanDerWaalsContact O-CD2 3.31Å; V101-F118 WeakPolarHBondContact O-CD2 3.33Å; V101-F118 PolarHBondContact O-N 3.37Å
102	G	92.1	Very high	88.6	Confident	2 Å²	2	51.5 Å²	51.5	2%	0.021	30%	0.299	C	S	.	.	S	Bend	trans	-160.2	-175.7	-174	0	0	0	0	0	114	A98 A99 W104 F118 R143	A98-G102 PolarHBondContact O-N 3.23Å; A98-G102 VanDerWaalsContact O-N 3.12Å; A99-G102 VanDerWaalsContact O-O 3.11Å; G102-W104 PolarHBondContact O-N 2.88Å; G102-F118 VanDerWaalsContact C-CE2 3.45Å; G102-F118 VanDerWaalsContact CA-CE2 3.42Å; G102-R143 PolarHBondContact O-NH2 3.15Å; G102-R143 VanDerWaalsContact O-NH2 3.08Å
103	P	91.4	Very high	88.5	Confident	23 Å²	23	50.6 Å²	50.6	15%	0.149	29%	0.294	C	S	.	.			trans	-60.7	134.1	173.9	-21.2	32.4	0	0	0	111.6	E107 V108 F118 T148	P103-E107 VanDerWaalsContact CA-OE2 3.27Å; P103-E107 WeakPolarHBondContact CA-OE2 3.34Å; P103-E107 HydrophobicContact CB-CB 4.28Å; P103-V108 HydrophobicContact CB-CG1 3.62Å; P103-V108 HydrophobicContact CB-CG2 4.29Å; P103-V108 HydrophobicContact CG-CG1 4.49Å; P103-F118 HydrophobicContact CG-CE1 3.99Å; P103-F118 HydrophobicContact CG-CZ 4.26Å; P103-T148 HydrophobicContact CG-CG2 3.77Å
104	W	90.9	Very high	88.5	Confident	26 Å²	26	48.9 Å²	48.9	10%	0.098	28%	0.283	C	S	.	.			trans	-129.4	-161.3	-174.8	-161.5	-111	0	0	0	112.4	F94 A98 A99 G102 G106 E107 V108 M113	F94-W104 AromaticContact CE1-CH2 3.96Å; F94-W104 HydrophobicContact CE1-CH2 3.96Å; F94-W104 HydrophobicContact CE1-CZ2 4.35Å; A98-W104 HydrophobicContact CB-CD2 3.73Å; A98-W104 HydrophobicContact CB-CE3 3.41Å; A98-W104 VanDerWaalsContact CB-CE3 3.41Å; A98-W104 HydrophobicContact CB-CH2 3.55Å; A98-W104 HydrophobicContact CB-CZ2 3.85Å; A98-W104 HydrophobicContact CB-CZ3 3.32Å; A99-W104 HydrophobicContact CB-CB 3.93Å; A99-W104 HydrophobicContact CB-CG 4.11Å; G102-W104 PolarHBondContact O-N 2.88Å; W104-G106 PolarHBondContact O-N 2.67Å; W104-E107 PolarHBondContact N-OE2 2.74Å; W104-E107 WeakPolarHBondContact O-CB 3.4Å; W104-E107 PolarHBondContact O-N 3.18Å; W104-V108 PolarHBondContact O-N 2.73Å; W104-M113 HydrophobicContact CD2-CG 3.78Å; W104-M113 HydrophobicContact CD2-SD 4.04Å; W104-M113 HydrophobicContact CE3-CG 3.44Å; W104-M113 VanDerWaalsContact CE3-CG 3.44Å; W104-M113 HydrophobicContact CE3-SD 4.25Å; W104-M113 HydrophobicContact CH2-CG 3.83Å; W104-M113 HydrophobicContact CH2-SD 4.02Å; W104-M113 HydrophobicContact CZ2-CG 4.14Å; W104-M113 HydrophobicContact CZ2-SD 3.8Å; W104-M113 HydrophobicContact CZ3-CG 3.46Å; W104-M113 VanDerWaalsContact CZ3-CG 3.46Å; W104-M113 HydrophobicContact CZ3-SD 4.23Å
105	E	85.5	Confident	88.5	Confident	154 Å²	154	47.9 Å²	47.9	72%	0.72	28%	0.279	S	S	*	.	B	Isolated β-bridge	trans	-47.1	127.7	-178.3	-168.8	172.1	-166.9	0	0	112.8	E107 M113	E105-E107 VanDerWaalsContact C-N 3.3Å; E105-E107 PolarHBondContact O-N 3.03Å; E105-M113 HydrophobicContact CB-CE 3.81Å; E105-M113 HydrophobicContact CG-CE 4.13Å
106	G	84.3	Confident	88.6	Confident	80 Å²	80	48.8 Å²	48.8	83%	0.825	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-16.1	-176.9	0	0	0	0	0	115.4	W104	W104-G106 PolarHBondContact O-N 2.67Å
107	E	85.3	Confident	88.7	Confident	70 Å²	70	44.7 Å²	44.7	33%	0.327	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-32.1	178.5	-63.5	173.5	155.9	0	0	112.7	P103 W104 E105 R143	P103-E107 VanDerWaalsContact CA-OE2 3.27Å; P103-E107 WeakPolarHBondContact CA-OE2 3.34Å; P103-E107 HydrophobicContact CB-CB 4.28Å; W104-E107 PolarHBondContact N-OE2 2.74Å; W104-E107 WeakPolarHBondContact O-CB 3.4Å; W104-E107 PolarHBondContact O-N 3.18Å; E105-E107 VanDerWaalsContact C-N 3.3Å; E105-E107 PolarHBondContact O-N 3.03Å; E107-R143 VanDerWaalsContact CD-NH1 3.35Å; E107-R143 IonicContact OE1-CZ 2.64Å; E107-R143 IonicContact OE1-NE 3.05Å; E107-R143 IonicContact OE1-NH1 3.13Å; E107-R143 PolarHBondContact OE1-NH1 3.32Å; E107-R143 IonicContact OE1-NH2 3.6Å; E107-R143 IonicContact OE2-CZ 3.67Å; E107-R143 IonicContact OE2-NH1 3.26Å; E107-R143 PolarHBondContact OE2-NH1 3.17Å; E107-R143 IonicContact OE2-NH2 3.96Å; E107-R143 PolarHBondContact OE2-NH2 3.11Å
108	V	86.4	Confident	88.7	Confident	48 Å²	48	44.9 Å²	44.9	29%	0.291	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-131.3	162.6	179.8	-69.5	0	0	0	0	111.2	P103 W104 M112 M113	P103-V108 HydrophobicContact CB-CG1 3.62Å; P103-V108 HydrophobicContact CB-CG2 4.29Å; P103-V108 HydrophobicContact CG-CG1 4.49Å; W104-V108 PolarHBondContact O-N 2.73Å; V108-M112 HydrophobicContact CB-CB 4.34Å; V108-M113 HydrophobicContact CG2-CB 4.46Å
109	S	83.7	Confident	88.6	Confident	71 Å²	71	46.9 Å²	46.9	50%	0.497	28%	0.277	S	S	.	.			trans	-62	152.3	171.9	59.9	0	0	0	0	110.9	S111 M112 M113	S109-S111 PolarHBondContact O-N 3.12Å; S109-S111 VanDerWaalsContact O-N 3.12Å; S109-S111 PolarHBondContact OG-OG 3.13Å; S109-M112 PolarHBondContact O-N 3.04Å; S109-M113 PolarHBondContact O-N 3.4Å
110	V	82.1	Confident	88.4	Confident	99 Å²	99	48.4 Å²	48.4	60%	0.6	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-53.7	-35.9	178.7	-178.9	0	0	0	0	112	M112 F553	V110-M112 VanDerWaalsContact C-N 3.27Å; V110-M112 PolarHBondContact O-N 3.46Å; V110-F553 HydrophobicContact CG1-CD1 4.28Å
111	S	80.6	Confident	88.2	Confident	58 Å²	58	51 Å²	51	41%	0.406	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-67.4	-19.9	177.2	56.2	0	0	0	0	115.3	S109	S109-S111 PolarHBondContact O-N 3.12Å; S109-S111 VanDerWaalsContact O-N 3.12Å; S109-S111 PolarHBondContact OG-OG 3.13Å
112	M	85.5	Confident	87.9	Confident	71 Å²	71	51.3 Å²	51.3	35%	0.35	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-111.1	-1.7	-175.4	-162.9	60.3	-171.3	0	0	112.5	V108 S109 V110 G114 C115 R116	V108-M112 HydrophobicContact CB-CB 4.34Å; S109-M112 PolarHBondContact O-N 3.04Å; V110-M112 VanDerWaalsContact C-N 3.27Å; V110-M112 PolarHBondContact O-N 3.46Å; M112-G114 PolarHBondContact O-N 3.4Å; M112-C115 HydrophobicContact CE-CB 3.88Å; M112-C115 HydrophobicContact CG-CB 4.49Å; M112-C115 WeakPolarHBondContact O-CB 3.29Å; M112-C115 PolarHBondContact O-N 3.44Å; M112-C115 HydrophobicContact SD-CB 3.81Å; M112-R116 HydrophobicContact CE-CG 3.6Å
113	M	88.9	Confident	87.6	Confident	32 Å²	32	55.9 Å²	55.9	16%	0.158	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	126.8	179.2	-170.9	176.2	-61.4	0	0	110.5	H75 W104 E105 V108 S109 C115	H75-M113 PolarHBondContact NE2-O 3.4Å; W104-M113 HydrophobicContact CD2-CG 3.78Å; W104-M113 HydrophobicContact CD2-SD 4.04Å; W104-M113 HydrophobicContact CE3-CG 3.44Å; W104-M113 VanDerWaalsContact CE3-CG 3.44Å; W104-M113 HydrophobicContact CE3-SD 4.25Å; W104-M113 HydrophobicContact CH2-CG 3.83Å; W104-M113 HydrophobicContact CH2-SD 4.02Å; W104-M113 HydrophobicContact CZ2-CG 4.14Å; W104-M113 HydrophobicContact CZ2-SD 3.8Å; W104-M113 HydrophobicContact CZ3-CG 3.46Å; W104-M113 VanDerWaalsContact CZ3-CG 3.46Å; W104-M113 HydrophobicContact CZ3-SD 4.23Å; E105-M113 HydrophobicContact CB-CE 3.81Å; E105-M113 HydrophobicContact CG-CE 4.13Å; V108-M113 HydrophobicContact CG2-CB 4.46Å; S109-M113 PolarHBondContact O-N 3.4Å; M113-C115 PolarHBondContact O-N 3.42Å
114	G	91.4	Very high	87.3	Confident	6 Å²	6	57.8 Å²	57.8	6%	0.062	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	4.8	178.4	0	0	0	0	0	116.2	H75 C77 M112	H75-G114 WeakPolarHBondContact O-CA 3.37Å; C77-G114 PolarHBondContact N-O 3.4Å; M112-G114 PolarHBondContact O-N 3.4Å
115	C	92.2	Very high	86.7	Confident	6 Å²	6	59 Å²	59	4%	0.041	35%	0.35	C	S	.	.	S	Bend	trans	-83	-18.6	-177.4	-69.5	0	0	0	0	115	M112 M113 C151 C176	M112-C115 HydrophobicContact CE-CB 3.88Å; M112-C115 HydrophobicContact CG-CB 4.49Å; M112-C115 WeakPolarHBondContact O-CB 3.29Å; M112-C115 PolarHBondContact O-N 3.44Å; M112-C115 HydrophobicContact SD-CB 3.81Å; M113-C115 PolarHBondContact O-N 3.42Å; C115-C151 PolarHBondContact O-SG 2.95Å; C115-C176 WeakPolarHBondContact CA-SG 3.26Å; C115-C176 HydrophobicContact CB-CB 3.72Å; C115-C176 WeakPolarHBondContact CB-SG 3.49Å; C115-C176 VanDerWaalsContact SG-CA 3.57Å; C115-C176 WeakPolarHBondContact SG-CB 3.23Å; C115-C176 CovalentContact SG-SG 2.02Å; C115-C176 PolarHBondContact SG-SG 2.92Å
116	R	92.6	Very high	86.5	Confident	91 Å²	91	55.7 Å²	55.7	34%	0.343	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	148.6	-177.2	-66	176	82.6	110.2	3.7	110	C77 M112 T148 E149	C77-R116 VanDerWaalsContact SG-C 3.57Å; M112-R116 HydrophobicContact CE-CG 3.6Å; R116-T148 PolarHBondContact NE-OG1 2.96Å; R116-T148 PolarHBondContact NH2-O 3.22Å; R116-E149 CarbonylContact C-O 3.58Å; R116-E149 VanDerWaalsContact CA-O 3.29Å; R116-E149 WeakPolarHBondContact CA-O 3.3Å; R116-E149 WeakPolarHBondContact CB-O 3.34Å
117	R	92.8	Very high	86.4	Confident	21 Å²	21	56 Å²	56	8%	0.079	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	158.4	171.3	64.3	176.5	-166.6	158.1	0.1	110.8	C77 E80 V101 T148 E149	C77-R117 HydrophobicContact CB-CB 4.19Å; E80-R117 IonicContact OE1-CZ 2.77Å; E80-R117 IonicContact OE1-NH1 2.61Å; E80-R117 PolarHBondContact OE1-NH1 3.16Å; E80-R117 IonicContact OE1-NH2 3.39Å; E80-R117 IonicContact OE2-NH1 2.94Å; E80-R117 PolarHBondContact OE2-NH1 3.36Å; V101-R117 HydrophobicContact CG1-CB 3.67Å; V101-R117 CarbonylContact O-C 3.53Å; V101-R117 WeakPolarHBondContact O-CA 3.47Å; R117-T148 CarbonylContact O-C 3.59Å; R117-T148 WeakPolarHBondContact O-CA 3.37Å; R117-T148 WeakPolarHBondContact O-CB 3.39Å; R117-E149 HydrophobicContact CG-CG 3.77Å; R117-E149 IonicContact CZ-OE1 3.18Å; R117-E149 PolarHBondContact N-O 3.44Å; R117-E149 IonicContact NE-OE1 3.59Å; R117-E149 PolarHBondContact NE-OE1 2.88Å; R117-E149 IonicContact NH2-OE1 2.94Å; R117-E149 PolarHBondContact NH2-OE1 3.42Å; R117-E149 PolarHBondContact O-N 3Å
118	F	91.8	Very high	86.2	Confident	7 Å²	7	52.7 Å²	52.7	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	136.7	169.5	-62.9	-60.8	0	0	0	110	V101 G102 P103 L120 W122 R143 L146 T148	V101-F118 VanDerWaalsContact O-CD2 3.31Å; V101-F118 WeakPolarHBondContact O-CD2 3.33Å; V101-F118 PolarHBondContact O-N 3.37Å; G102-F118 VanDerWaalsContact C-CE2 3.45Å; G102-F118 VanDerWaalsContact CA-CE2 3.42Å; P103-F118 HydrophobicContact CG-CE1 3.99Å; P103-F118 HydrophobicContact CG-CZ 4.26Å; F118-L120 HydrophobicContact CB-CD1 4.13Å; F118-L120 HydrophobicContact CB-CG 4.07Å; F118-L120 PolarHBondContact O-N 3.48Å; F118-W122 HydrophobicContact CB-CZ2 4.35Å; F118-W122 PolarHBondContact O-NE1 3.02Å; F118-R143 HydrophobicContact CZ-CB 4.42Å; F118-L146 HydrophobicContact CD1-CB 3.53Å; F118-L146 HydrophobicContact CD1-CD1 4.23Å; F118-L146 HydrophobicContact CD1-CG 4.36Å; F118-L146 HydrophobicContact CE1-CB 3.91Å; F118-L146 HydrophobicContact CE1-CD1 4.34Å; F118-L146 HydrophobicContact CG-CB 4.36Å; F118-T148 HydrophobicContact CD1-CG2 3.95Å; F118-T148 HydrophobicContact CE1-CG2 4.28Å
119	A	90.7	Very high	86	Confident	45 Å²	45	53.7 Å²	53.7	37%	0.372	31%	0.309	S	S	.	.			trans	-80.5	66.5	178	0	0	0	0	0	110.1	K147 E149	A119-K147 HydrophobicContact CB-CB 4.23Å; A119-K147 PolarHBondContact N-O 2.96Å; A119-E149 HydrophobicContact CB-CB 4.37Å; A119-E149 HydrophobicContact CB-CG 4.04Å
120	L	86.9	Confident	85.9	Confident	59 Å²	59	54.5 Å²	54.5	31%	0.309	31%	0.308	S	S	.	.			trans	-100.8	160.7	174.9	-66.3	173.6	0	0	0	109.9	F118 W122 L146	F118-L120 HydrophobicContact CB-CD1 4.13Å; F118-L120 HydrophobicContact CB-CG 4.07Å; F118-L120 PolarHBondContact O-N 3.48Å; L120-W122 VanDerWaalsContact C-N 3.28Å; L120-W122 HydrophobicContact CB-CD2 4.48Å; L120-W122 HydrophobicContact CB-CZ2 4.33Å; L120-W122 HydrophobicContact CD1-CH2 4.38Å; L120-W122 HydrophobicContact CD1-CZ2 4.2Å; L120-W122 PolarHBondContact O-N 3.31Å; L120-L146 HydrophobicContact CD2-CD2 3.64Å; L120-L146 HydrophobicContact CG-CD2 4.19Å
121	D	85.5	Confident	85.9	Confident	100 Å²	100	51.1 Å²	51.1	54%	0.535	29%	0.286	S	S	.	.			trans	-76.6	83.5	172	-171.7	3.9	0	0	0	110.4	S123 N124 I128	D121-S123 PolarHBondContact O-N 3.48Å; D121-S123 VanDerWaalsContact O-N 3.1Å; D121-S123 WeakPolarHBondContact OD1-CB 3.27Å; D121-S123 PolarHBondContact OD1-N 3.11Å; D121-S123 PolarHBondContact OD1-OG 3.44Å; D121-N124 PolarHBondContact O-N 3.46Å; D121-I128 WeakPolarHBondContact O-CD1 3.39Å
122	W	85.7	Confident	85.9	Confident	9 Å²	9	49.9 Å²	49.9	3%	0.034	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-11	-179.8	-63	104.4	0	0	0	114.1	M79 E80 M83 F100 F118 L120 I128	M79-W122 HydrophobicContact CE-CB 4.01Å; M79-W122 HydrophobicContact CE-CD2 3.04Å; M79-W122 HydrophobicContact CE-CE3 3.33Å; M79-W122 HydrophobicContact CE-CG 3.33Å; M79-W122 HydrophobicContact CE-CH2 4.16Å; M79-W122 HydrophobicContact CE-CZ2 3.9Å; M79-W122 HydrophobicContact CE-CZ3 3.88Å; E80-W122 WeakPolarHBondContact OE2-CB 3.35Å; M83-W122 HydrophobicContact CE-CE3 4.44Å; M83-W122 HydrophobicContact CE-CZ3 4.43Å; M83-W122 HydrophobicContact CG-CE3 4.38Å; F100-W122 HydrophobicContact CD1-CH2 4.38Å; F100-W122 HydrophobicContact CD1-CZ3 4.32Å; F100-W122 HydrophobicContact CE1-CH2 4.18Å; F100-W122 AromaticContact CE1-CZ3 3.82Å; F100-W122 HydrophobicContact CE1-CZ3 3.82Å; F118-W122 HydrophobicContact CB-CZ2 4.35Å; F118-W122 PolarHBondContact O-NE1 3.02Å; L120-W122 VanDerWaalsContact C-N 3.28Å; L120-W122 HydrophobicContact CB-CD2 4.48Å; L120-W122 HydrophobicContact CB-CZ2 4.33Å; L120-W122 HydrophobicContact CD1-CH2 4.38Å; L120-W122 HydrophobicContact CD1-CZ2 4.2Å; L120-W122 PolarHBondContact O-N 3.31Å; W122-I128 VanDerWaalsContact CA-CD1 3.48Å; W122-I128 HydrophobicContact CB-CD1 4.45Å; W122-I128 HydrophobicContact CD2-CD1 4.42Å; W122-I128 HydrophobicContact CE3-CD1 3.77Å; W122-I128 HydrophobicContact CE3-CG1 4.44Å; W122-I128 HydrophobicContact CE3-CG2 4.27Å; W122-I128 HydrophobicContact CZ3-CD1 4.47Å; W122-I128 HydrophobicContact CZ3-CG2 3.99Å
123	S	84.5	Confident	85.7	Confident	97 Å²	97	51 Å²	51	68%	0.678	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-23.5	175.8	76.5	0	0	0	0	113.2	D121 S125	D121-S123 PolarHBondContact O-N 3.48Å; D121-S123 VanDerWaalsContact O-N 3.1Å; D121-S123 WeakPolarHBondContact OD1-CB 3.27Å; D121-S123 PolarHBondContact OD1-N 3.11Å; D121-S123 PolarHBondContact OD1-OG 3.44Å; S123-S125 PolarHBondContact O-N 2.8Å; S123-S125 VanDerWaalsContact O-N 3.13Å
124	N	84.9	Confident	85.3	Confident	63 Å²	63	53.2 Å²	53.2	34%	0.337	29%	0.294	S	S	.	.			trans	-87.2	79.2	179.7	-168.5	-8.6	0	0	0	111.5	D121 T126 L127 I128	D121-N124 PolarHBondContact O-N 3.46Å; N124-T126 VanDerWaalsContact C-N 3.25Å; N124-T126 PolarHBondContact O-N 3.03Å; N124-T126 PolarHBondContact OD1-OG1 3.27Å; N124-L127 HydrophobicContact CB-CB 4.13Å; N124-L127 PolarHBondContact O-N 3.34Å; N124-L127 PolarHBondContact OD1-N 2.91Å; N124-I128 WeakPolarHBondContact O-CD1 3.21Å; N124-I128 WeakPolarHBondContact O-CG1 3.31Å; N124-I128 PolarHBondContact O-N 2.86Å
125	S	79.4	Confident	84.3	Confident	52 Å²	52	61.1 Å²	61.1	36%	0.364	33%	0.327	S	S	.	.	H	α-helix	trans	-53.4	-39.5	-178.4	58.7	0	0	0	0	113.3	S123 L127 I128 E129	S123-S125 PolarHBondContact O-N 2.8Å; S123-S125 VanDerWaalsContact O-N 3.13Å; S125-L127 PolarHBondContact O-N 3.49Å; S125-I128 PolarHBondContact O-N 3.21Å; S125-E129 WeakPolarHBondContact O-CB 3.13Å; S125-E129 PolarHBondContact O-N 2.99Å
126	T	81.7	Confident	83.3	Confident	85 Å²	85	64.7 Å²	64.7	52%	0.521	35%	0.352	S	S	.	.	H	α-helix	trans	-65.4	-39.4	-178.9	64.3	0	0	0	0	113.4	N124 I128 N130	N124-T126 VanDerWaalsContact C-N 3.25Å; N124-T126 PolarHBondContact O-N 3.03Å; N124-T126 PolarHBondContact OD1-OG1 3.27Å; T126-I128 VanDerWaalsContact C-N 3.29Å; T126-I128 PolarHBondContact O-N 2.97Å; T126-N130 WeakPolarHBondContact O-CB 3.4Å; T126-N130 VanDerWaalsContact O-CG 3.3Å; T126-N130 PolarHBondContact O-N 2.87Å; T126-N130 VanDerWaalsContact O-N 3.16Å; T126-N130 PolarHBondContact O-ND2 3.39Å
127	L	81.2	Confident	82.1	Confident	86 Å²	86	63.2 Å²	63.2	45%	0.45	35%	0.353	S	S	.	.	H	α-helix	trans	-62.1	-42.9	174.9	-177.7	88	0	0	0	110.3	N124 S125 N130 L131	N124-L127 HydrophobicContact CB-CB 4.13Å; N124-L127 PolarHBondContact O-N 3.34Å; N124-L127 PolarHBondContact OD1-N 2.91Å; S125-L127 PolarHBondContact O-N 3.49Å; L127-N130 WeakPolarHBondContact O-CB 3.5Å; L127-N130 PolarHBondContact O-N 3Å; L127-L131 WeakPolarHBondContact O-CG 3.36Å; L127-L131 PolarHBondContact O-N 3.06Å
128	I	81.4	Confident	81	Confident	1 Å²	1	64 Å²	64	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-78.6	-38.3	-171.4	-62.3	159.2	0	0	0	111.2	M83 F100 D121 W122 N124 S125 T126 N130 L131 L132	M83-I128 HydrophobicContact CE-CB 4.34Å; M83-I128 HydrophobicContact CE-CG2 3.38Å; M83-I128 HydrophobicContact SD-CB 4.16Å; M83-I128 HydrophobicContact SD-CD1 3.95Å; M83-I128 HydrophobicContact SD-CG2 3.81Å; F100-I128 HydrophobicContact CE1-CG2 3.58Å; F100-I128 HydrophobicContact CZ-CG2 3.67Å; D121-I128 WeakPolarHBondContact O-CD1 3.39Å; W122-I128 VanDerWaalsContact CA-CD1 3.48Å; W122-I128 HydrophobicContact CB-CD1 4.45Å; W122-I128 HydrophobicContact CD2-CD1 4.42Å; W122-I128 HydrophobicContact CE3-CD1 3.77Å; W122-I128 HydrophobicContact CE3-CG1 4.44Å; W122-I128 HydrophobicContact CE3-CG2 4.27Å; W122-I128 HydrophobicContact CZ3-CD1 4.47Å; W122-I128 HydrophobicContact CZ3-CG2 3.99Å; N124-I128 WeakPolarHBondContact O-CD1 3.21Å; N124-I128 WeakPolarHBondContact O-CG1 3.31Å; N124-I128 PolarHBondContact O-N 2.86Å; S125-I128 PolarHBondContact O-N 3.21Å; T126-I128 VanDerWaalsContact C-N 3.29Å; T126-I128 PolarHBondContact O-N 2.97Å; I128-N130 VanDerWaalsContact C-N 3.28Å; I128-N130 PolarHBondContact O-N 3.36Å; I128-L131 CarbonylContact O-C 3.58Å; I128-L131 WeakPolarHBondContact O-CA 3.31Å; I128-L131 WeakPolarHBondContact O-CB 3.24Å; I128-L131 PolarHBondContact O-N 3.28Å; I128-L132 PolarHBondContact O-N 2.84Å
129	E	82	Confident	80	Confident	68 Å²	68	68.3 Å²	68.3	32%	0.318	40%	0.395	S	S	.	.	H	α-helix	trans	-61.1	-40.1	171.4	-170.3	173.1	-163	0	0	110.9	Y90 S125 L131 L132 L133	Y90-E129 HydrophobicContact CE2-CG 4.19Å; Y90-E129 PolarHBondContact OH-OE1 3.48Å; S125-E129 WeakPolarHBondContact O-CB 3.13Å; S125-E129 PolarHBondContact O-N 2.99Å; E129-L131 VanDerWaalsContact C-N 3.32Å; E129-L131 PolarHBondContact O-N 3.21Å; E129-L132 WeakPolarHBondContact O-CB 3.48Å; E129-L132 PolarHBondContact O-N 2.86Å; E129-L133 HydrophobicContact CG-CD1 4.01Å; E129-L133 HydrophobicContact CG-CG 4.49Å; E129-L133 WeakPolarHBondContact O-CB 3.41Å; E129-L133 VanDerWaalsContact O-CG 3.31Å; E129-L133 WeakPolarHBondContact O-CG 3.46Å; E129-L133 PolarHBondContact O-N 3.32Å
130	N	82.2	Confident	79.1	Confident	89 Å²	89	70.5 Å²	70.5	48%	0.476	41%	0.407	S	S	.	.	H	α-helix	trans	-62.4	-36.8	171.5	-78.5	-43.9	0	0	0	112.8	T126 L127 I128 N134	T126-N130 WeakPolarHBondContact O-CB 3.4Å; T126-N130 VanDerWaalsContact O-CG 3.3Å; T126-N130 PolarHBondContact O-N 2.87Å; T126-N130 VanDerWaalsContact O-N 3.16Å; T126-N130 PolarHBondContact O-ND2 3.39Å; L127-N130 WeakPolarHBondContact O-CB 3.5Å; L127-N130 PolarHBondContact O-N 3Å; I128-N130 VanDerWaalsContact C-N 3.28Å; I128-N130 PolarHBondContact O-N 3.36Å; N130-N134 VanDerWaalsContact O-CB 3.24Å; N130-N134 WeakPolarHBondContact O-CB 3.11Å; N130-N134 PolarHBondContact O-N 2.8Å
131	L	81.6	Confident	78.5	Confident	28 Å²	28	70.8 Å²	70.8	15%	0.147	41%	0.409	C	S	.	.	H	α-helix	trans	-68.6	-36.5	174.2	-71.3	172.7	0	0	0	112.4	F100 L127 I128 E129 V137 I141	F100-L131 HydrophobicContact CE2-CB 4.29Å; F100-L131 HydrophobicContact CZ-CB 4.25Å; L127-L131 WeakPolarHBondContact O-CG 3.36Å; L127-L131 PolarHBondContact O-N 3.06Å; I128-L131 CarbonylContact O-C 3.58Å; I128-L131 WeakPolarHBondContact O-CA 3.31Å; I128-L131 WeakPolarHBondContact O-CB 3.24Å; I128-L131 PolarHBondContact O-N 3.28Å; E129-L131 VanDerWaalsContact C-N 3.32Å; E129-L131 PolarHBondContact O-N 3.21Å; L131-V137 HydrophobicContact CD2-CG1 3.75Å; L131-I141 HydrophobicContact CD2-CD1 3.63Å
132	L	81.3	Confident	78.3	Confident	32 Å²	32	70.6 Å²	70.6	17%	0.168	41%	0.408	C	S	.	.	H	α-helix	trans	-66.1	-44.7	175	-77.4	169.3	0	0	0	111.7	I86 F87 L92 F100 I128 E129	I86-L132 HydrophobicContact CG2-CD1 3.61Å; F87-L132 HydrophobicContact CD1-CD1 4.42Å; F87-L132 HydrophobicContact CE1-CD1 4.22Å; L92-L132 HydrophobicContact CD1-CD2 3.94Å; F100-L132 HydrophobicContact CD1-CD2 3.65Å; F100-L132 HydrophobicContact CD1-CG 4.31Å; F100-L132 HydrophobicContact CD2-CD2 3.51Å; F100-L132 HydrophobicContact CD2-CG 4.33Å; F100-L132 HydrophobicContact CE1-CD1 4.16Å; F100-L132 HydrophobicContact CE1-CD2 3.57Å; F100-L132 HydrophobicContact CE1-CG 3.71Å; F100-L132 HydrophobicContact CE2-CD2 3.46Å; F100-L132 VanDerWaalsContact CE2-CD2 3.46Å; F100-L132 HydrophobicContact CE2-CG 3.76Å; F100-L132 HydrophobicContact CG-CD2 3.61Å; F100-L132 HydrophobicContact CZ-CD1 4.29Å; F100-L132 HydrophobicContact CZ-CD2 3.49Å; F100-L132 VanDerWaalsContact CZ-CD2 3.49Å; F100-L132 HydrophobicContact CZ-CG 3.42Å; F100-L132 VanDerWaalsContact CZ-CG 3.42Å; I128-L132 PolarHBondContact O-N 2.84Å; E129-L132 WeakPolarHBondContact O-CB 3.48Å; E129-L132 PolarHBondContact O-N 2.86Å
133	L	80.9	Confident	78.1	Confident	95 Å²	95	74 Å²	74	50%	0.497	42%	0.421	S	S	.	.	H	α-helix	trans	-76.3	-43.6	-177.4	-69.1	171.6	0	0	0	112.6	Y90 E129 K135	Y90-L133 HydrophobicContact CE1-CD2 3.62Å; Y90-L133 HydrophobicContact CE1-CG 4.48Å; E129-L133 HydrophobicContact CG-CD1 4.01Å; E129-L133 HydrophobicContact CG-CG 4.49Å; E129-L133 WeakPolarHBondContact O-CB 3.41Å; E129-L133 VanDerWaalsContact O-CG 3.31Å; E129-L133 WeakPolarHBondContact O-CG 3.46Å; E129-L133 PolarHBondContact O-N 3.32Å; L133-K135 PolarHBondContact O-N 3.32Å; L133-K135 VanDerWaalsContact O-N 3.14Å
134	N	80.5	Confident	77.9	Confident	78 Å²	78	78 Å²	78	42%	0.417	43%	0.426	S	S	.	.			trans	-88.5	80.6	-178.1	-71	-38.8	0	0	0	111.7	N130 S136 V137 A138	N130-N134 VanDerWaalsContact O-CB 3.24Å; N130-N134 WeakPolarHBondContact O-CB 3.11Å; N130-N134 PolarHBondContact O-N 2.8Å; N134-S136 PolarHBondContact O-N 3.41Å; N134-V137 HydrophobicContact CB-CB 4.02Å; N134-V137 HydrophobicContact CB-CG2 3.79Å; N134-V137 PolarHBondContact O-N 2.96Å; N134-A138 PolarHBondContact O-N 2.99Å
135	K	71.3	Confident	77.8	Confident	171 Å²	171	79 Å²	79	74%	0.743	44%	0.437	S	S	*	.	H	α-helix	trans	-52.2	-30.4	173.6	-68.8	-172.2	179	-176.4	0	113.4	L133 S139	L133-K135 PolarHBondContact O-N 3.32Å; L133-K135 VanDerWaalsContact O-N 3.14Å; K135-S139 VanDerWaalsContact O-CB 3.29Å; K135-S139 WeakPolarHBondContact O-CB 3.26Å; K135-S139 PolarHBondContact O-N 2.97Å; K135-S139 PolarHBondContact O-OG 2.91Å
136	S	69.7	Low	78.2	Confident	81 Å²	81	78.5 Å²	78.5	57%	0.566	43%	0.431	S	S	*	.	H	α-helix	trans	-63.7	-45.4	175	56.3	0	0	0	0	112.3	N134 S139 S140	N134-S136 PolarHBondContact O-N 3.41Å; S136-S139 WeakPolarHBondContact CA-OG 3.36Å; S136-S139 PolarHBondContact O-N 3.37Å; S136-S139 PolarHBondContact O-OG 3.48Å; S136-S140 PolarHBondContact O-N 3.18Å; S136-S140 VanDerWaalsContact O-N 3.11Å
137	V	68.2	Low	78.7	Confident	61 Å²	61	82.8 Å²	82.8	37%	0.37	44%	0.442	S	S	.	.	H	α-helix	trans	-66.2	-46.2	176.5	179	0	0	0	0	109.8	L131 N134 S139 S140 I141	L131-V137 HydrophobicContact CD2-CG1 3.75Å; N134-V137 HydrophobicContact CB-CB 4.02Å; N134-V137 HydrophobicContact CB-CG2 3.79Å; N134-V137 PolarHBondContact O-N 2.96Å; V137-S139 VanDerWaalsContact C-N 3.26Å; V137-S139 PolarHBondContact O-N 2.88Å; V137-S140 PolarHBondContact O-N 3.08Å; V137-S140 PolarHBondContact O-OG 3.21Å; V137-I141 WeakPolarHBondContact O-CG1 3.32Å; V137-I141 PolarHBondContact O-N 3.44Å
138	A	69.6	Low	79.2	Confident	37 Å²	37	80.6 Å²	80.6	31%	0.306	43%	0.433	S	S	.	.	H	α-helix	trans	-57.6	-39.7	175.7	0	0	0	0	0	112.3	N134 S140 I141	N134-A138 PolarHBondContact O-N 2.99Å; A138-S140 VanDerWaalsContact C-N 3.32Å; A138-S140 PolarHBondContact O-N 3.19Å; A138-I141 PolarHBondContact O-N 3.1Å
139	S	70.2	Confident	79.7	Confident	97 Å²	97	83.9 Å²	83.9	68%	0.678	45%	0.448	S	S	*	.	H	α-helix	trans	-71.1	-23.5	177.4	71.8	0	0	0	0	114.2	K135 S136 V137	K135-S139 VanDerWaalsContact O-CB 3.29Å; K135-S139 WeakPolarHBondContact O-CB 3.26Å; K135-S139 PolarHBondContact O-N 2.97Å; K135-S139 PolarHBondContact O-OG 2.91Å; S136-S139 WeakPolarHBondContact CA-OG 3.36Å; S136-S139 PolarHBondContact O-N 3.37Å; S136-S139 PolarHBondContact O-OG 3.48Å; V137-S139 VanDerWaalsContact C-N 3.26Å; V137-S139 PolarHBondContact O-N 2.88Å
140	S	71.7	Confident	80.2	Confident	91 Å²	91	87.9 Å²	87.9	64%	0.636	47%	0.467	S	S	*	.	H	α-helix	trans	-78.5	-21.2	177.5	73.4	0	0	0	0	113.2	S136 V137 A138 D142	S136-S140 PolarHBondContact O-N 3.18Å; S136-S140 VanDerWaalsContact O-N 3.11Å; V137-S140 PolarHBondContact O-N 3.08Å; V137-S140 PolarHBondContact O-OG 3.21Å; A138-S140 VanDerWaalsContact C-N 3.32Å; A138-S140 PolarHBondContact O-N 3.19Å; S140-D142 PolarHBondContact O-N 3.02Å
141	I	75.8	Confident	80.6	Confident	65 Å²	65	84.4 Å²	84.4	33%	0.333	45%	0.449	S	S	.	.	S	Bend	trans	-80.1	120.8	179.9	-63.2	167	0	0	0	108.7	L131 V137 A138 R143 L146	L131-I141 HydrophobicContact CD2-CD1 3.63Å; V137-I141 WeakPolarHBondContact O-CG1 3.32Å; V137-I141 PolarHBondContact O-N 3.44Å; A138-I141 PolarHBondContact O-N 3.1Å; I141-R143 PolarHBondContact O-N 3.15Å; I141-L146 HydrophobicContact CG2-CD1 3.51Å; I141-L146 HydrophobicContact CG2-CG 4.33Å
142	D	80.8	Confident	80.9	Confident	97 Å²	97	86.5 Å²	86.5	52%	0.519	47%	0.47	S	S	.	.			trans	-69.3	97.7	170.6	179.6	13.5	0	0	0	110.2	S140 K144 S145	S140-D142 PolarHBondContact O-N 3.02Å; D142-K144 PolarHBondContact O-N 3.36Å; D142-K144 VanDerWaalsContact O-N 3.17Å; D142-K144 PolarHBondContact OD1-N 3.48Å; D142-S145 WeakPolarHBondContact O-CB 3.4Å; D142-S145 PolarHBondContact O-N 3.19Å; D142-S145 PolarHBondContact O-OG 2.85Å
143	R	81.7	Confident	81.3	Confident	80 Å²	80	88.8 Å²	88.8	30%	0.302	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-56.7	-29.1	-179.2	-68.3	-177.6	71	-133.4	-13.5	113.5	A99 G102 E107 F118 I141 S145	A99-R143 PolarHBondContact O-NH2 3.12Å; G102-R143 PolarHBondContact O-NH2 3.15Å; G102-R143 VanDerWaalsContact O-NH2 3.08Å; E107-R143 VanDerWaalsContact CD-NH1 3.35Å; E107-R143 IonicContact OE1-CZ 2.64Å; E107-R143 IonicContact OE1-NE 3.05Å; E107-R143 IonicContact OE1-NH1 3.13Å; E107-R143 PolarHBondContact OE1-NH1 3.32Å; E107-R143 IonicContact OE1-NH2 3.6Å; E107-R143 IonicContact OE2-CZ 3.67Å; E107-R143 IonicContact OE2-NH1 3.26Å; E107-R143 PolarHBondContact OE2-NH1 3.17Å; E107-R143 IonicContact OE2-NH2 3.96Å; E107-R143 PolarHBondContact OE2-NH2 3.11Å; F118-R143 HydrophobicContact CZ-CB 4.42Å; I141-R143 PolarHBondContact O-N 3.15Å; R143-S145 VanDerWaalsContact C-N 3.3Å; R143-S145 PolarHBondContact O-N 3.33Å
144	K	80.2	Confident	81.8	Confident	180 Å²	180	85.1 Å²	85.1	78%	0.783	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-74.2	-23	178.7	-67.3	-178.6	178.4	178.6	0	112.9	D142	D142-K144 PolarHBondContact O-N 3.36Å; D142-K144 VanDerWaalsContact O-N 3.17Å; D142-K144 PolarHBondContact OD1-N 3.48Å
145	S	83.1	Confident	82.5	Confident	84 Å²	84	83.7 Å²	83.7	59%	0.587	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-82.2	-17.5	179.2	75.6	0	0	0	0	113.6	D142 R143 K147	D142-S145 WeakPolarHBondContact O-CB 3.4Å; D142-S145 PolarHBondContact O-N 3.19Å; D142-S145 PolarHBondContact O-OG 2.85Å; R143-S145 VanDerWaalsContact C-N 3.3Å; R143-S145 PolarHBondContact O-N 3.33Å; S145-K147 PolarHBondContact O-N 2.95Å
146	L	87.4	Confident	83.5	Confident	42 Å²	42	77.8 Å²	77.8	22%	0.22	43%	0.433	C	S	.	.	S	Bend	trans	-68	131.2	-179.9	-84	144.8	0	0	0	111.1	F118 L120 I141	F118-L146 HydrophobicContact CD1-CB 3.53Å; F118-L146 HydrophobicContact CD1-CD1 4.23Å; F118-L146 HydrophobicContact CD1-CG 4.36Å; F118-L146 HydrophobicContact CE1-CB 3.91Å; F118-L146 HydrophobicContact CE1-CD1 4.34Å; F118-L146 HydrophobicContact CG-CB 4.36Å; L120-L146 HydrophobicContact CD2-CD2 3.64Å; L120-L146 HydrophobicContact CG-CD2 4.19Å; I141-L146 HydrophobicContact CG2-CD1 3.51Å; I141-L146 HydrophobicContact CG2-CG 4.33Å
147	K	91	Very high	84.6	Confident	175 Å²	175	76.5 Å²	76.5	76%	0.761	42%	0.416	S	S	*	.			trans	-66.1	145.5	171.1	-68.1	-178.1	-178.8	177.2	0	109.4	A119 S145	A119-K147 HydrophobicContact CB-CB 4.23Å; A119-K147 PolarHBondContact N-O 2.96Å; S145-K147 PolarHBondContact O-N 2.95Å
148	T	92.3	Very high	85.7	Confident	41 Å²	41	79 Å²	79	25%	0.252	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	147	179.1	59.2	0	0	0	0	110.9	P103 R116 R117 F118	P103-T148 HydrophobicContact CG-CG2 3.77Å; R116-T148 PolarHBondContact NE-OG1 2.96Å; R116-T148 PolarHBondContact NH2-O 3.22Å; R117-T148 CarbonylContact O-C 3.59Å; R117-T148 WeakPolarHBondContact O-CA 3.37Å; R117-T148 WeakPolarHBondContact O-CB 3.39Å; F118-T148 HydrophobicContact CD1-CG2 3.95Å; F118-T148 HydrophobicContact CE1-CG2 4.28Å
149	E	92.7	Very high	86.5	Confident	70 Å²	70	79.1 Å²	79.1	33%	0.327	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	165.1	178.5	60.2	180	-158.7	0	0	111.2	R116 R117 A119	R116-E149 CarbonylContact C-O 3.58Å; R116-E149 VanDerWaalsContact CA-O 3.29Å; R116-E149 WeakPolarHBondContact CA-O 3.3Å; R116-E149 WeakPolarHBondContact CB-O 3.34Å; R117-E149 HydrophobicContact CG-CG 3.77Å; R117-E149 IonicContact CZ-OE1 3.18Å; R117-E149 PolarHBondContact N-O 3.44Å; R117-E149 IonicContact NE-OE1 3.59Å; R117-E149 PolarHBondContact NE-OE1 2.88Å; R117-E149 IonicContact NH2-OE1 2.94Å; R117-E149 PolarHBondContact NH2-OE1 3.42Å; R117-E149 PolarHBondContact O-N 3Å; A119-E149 HydrophobicContact CB-CB 4.37Å; A119-E149 HydrophobicContact CB-CG 4.04Å
150	E	91.2	Very high	87.2	Confident	152 Å²	152	79 Å²	79	71%	0.71	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	155.3	178.5	-64	-176.2	174.1	0	0	111.3	A152	E150-A152 PolarHBondContact O-N 3.21Å; E150-A152 VanDerWaalsContact O-N 3.1Å
151	C	91.2	Very high	87.6	Confident	16 Å²	16	82.9 Å²	82.9	11%	0.108	41%	0.413	C	S	.	.			trans	-69.3	107.5	179.6	-47.8	0	0	0	0	110.8	C77 C115 G154 Y155	C77-C151 WeakPolarHBondContact CA-SG 3.46Å; C77-C151 HydrophobicContact CB-CB 3.62Å; C77-C151 WeakPolarHBondContact CB-SG 3.46Å; C77-C151 WeakPolarHBondContact SG-CB 3.31Å; C77-C151 CovalentContact SG-SG 2.02Å; C77-C151 PolarHBondContact SG-SG 2.8Å; C115-C151 PolarHBondContact O-SG 2.95Å; C151-G154 WeakPolarHBondContact CB-O 2.9Å; C151-Y155 HydrophobicContact CB-CD1 4.47Å; C151-Y155 HydrophobicContact CB-CE1 4.04Å; C151-Y155 WeakPolarHBondContact SG-CE1 3.28Å
152	A	88.2	Confident	87.8	Confident	72 Å²	72	84.9 Å²	84.9	60%	0.595	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-37.7	-177.6	0	0	0	0	0	113.6	E150	E150-A152 PolarHBondContact O-N 3.21Å; E150-A152 VanDerWaalsContact O-N 3.1Å
153	N	90.6	Very high	88.1	Confident	79 Å²	79	81.9 Å²	81.9	42%	0.422	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	20	-172.3	-60.1	-31.6	0	0	0	113.4	R78	R78-N153 HydrophobicContact CB-CB 4.43Å; R78-N153 HydrophobicContact CG-CB 4.43Å
154	G	91.1	Very high	88.5	Confident	18 Å²	18	78.1 Å²	78.1	19%	0.186	39%	0.388	C	S	.	.			trans	79.9	-152.8	-175.8	0	0	0	0	0	113.3	R78 C151	R78-G154 PolarHBondContact N-O 3.05Å; C151-G154 WeakPolarHBondContact CB-O 2.9Å
155	Y	93.8	Very high	88.9	Confident	49 Å²	49	71.6 Å²	71.6	19%	0.192	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	151.3	-170.1	-58.9	-84.7	0	0	0	112.2	R76 C151 N173 V175	R76-Y155 CarbonylContact O-C 3.58Å; R76-Y155 VanDerWaalsContact O-CA 3.27Å; R76-Y155 WeakPolarHBondContact O-CA 3.32Å; C151-Y155 HydrophobicContact CB-CD1 4.47Å; C151-Y155 HydrophobicContact CB-CE1 4.04Å; C151-Y155 WeakPolarHBondContact SG-CE1 3.28Å; Y155-N173 HydrophobicContact CD2-CB 4.34Å; Y155-V175 HydrophobicContact CD1-CG2 4.21Å; Y155-V175 HydrophobicContact CD2-CG2 3.73Å; Y155-V175 HydrophobicContact CE1-CG2 4.09Å; Y155-V175 HydrophobicContact CE2-CG2 3.61Å; Y155-V175 HydrophobicContact CG-CG2 4.04Å
156	I	93	Very high	89.2	Confident	47 Å²	47	69.2 Å²	69.2	24%	0.241	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	129.4	164.3	-68.6	170.1	0	0	0	107.6	H75 R76 R78 E84 F94	H75-I156 WeakPolarHBondContact CA-O 3.4Å; R76-I156 HydrophobicContact CG-CB 4.22Å; R76-I156 PolarHBondContact N-O 3.35Å; R76-I156 PolarHBondContact O-N 3.35Å; R78-I156 HydrophobicContact CB-CD1 4.22Å; R78-I156 HydrophobicContact CB-CG1 3.92Å; R78-I156 HydrophobicContact CG-CD1 4.03Å; R78-I156 HydrophobicContact CG-CG1 4.05Å; E84-I156 HydrophobicContact CG-CD1 4.27Å; E84-I156 VanDerWaalsContact OE1-CD1 3.27Å; E84-I156 WeakPolarHBondContact OE1-CD1 3.37Å; E84-I156 VanDerWaalsContact OE2-CD1 3.26Å; E84-I156 WeakPolarHBondContact OE2-CD1 3.05Å; F94-I156 HydrophobicContact CE2-CG2 4.18Å
157	Y	93.3	Very high	89.5	Confident	53 Å²	53	67.3 Å²	67.3	21%	0.208	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	138.6	-175.5	-63.9	-70.1	0	0	0	111.4	P73 D74 H75 A170 N173 V175	P73-Y157 HydrophobicContact CG-CD1 3.65Å; P73-Y157 HydrophobicContact CG-CE1 4.38Å; P73-Y157 HydrophobicContact CG-CG 4.21Å; D74-Y157 CarbonylContact O-C 3.59Å; D74-Y157 WeakPolarHBondContact O-CA 3.46Å; H75-Y157 HydrophobicContact CB-CD1 3.61Å; H75-Y157 HydrophobicContact CB-CE1 3.6Å; Y157-A170 HydrophobicContact CD1-CB 4.26Å; Y157-A170 HydrophobicContact CD2-CB 3.69Å; Y157-A170 HydrophobicContact CE2-CB 3.97Å; Y157-A170 WeakPolarHBondContact CE2-O 3.43Å; Y157-A170 HydrophobicContact CG-CB 3.85Å; Y157-N173 WeakPolarHBondContact OH-CA 3.08Å; Y157-N173 PolarHBondContact OH-OD1 3.18Å; Y157-V175 HydrophobicContact CE1-CG1 3.87Å; Y157-V175 HydrophobicContact CE1-CG2 4.39Å
158	R	91.2	Very high	89.6	Confident	114 Å²	114	59 Å²	59	43%	0.43	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	112.2	168	-176.8	-178.4	-176.6	174.4	5.4	108.7	D74 F94 E95	D74-R158 PolarHBondContact N-O 3.19Å; D74-R158 PolarHBondContact O-N 2.88Å; F94-R158 HydrophobicContact CD1-CB 4.16Å; F94-R158 HydrophobicContact CD2-CB 3.77Å; F94-R158 HydrophobicContact CE1-CB 4.18Å; F94-R158 HydrophobicContact CE2-CB 3.78Å; F94-R158 HydrophobicContact CG-CB 3.96Å; F94-R158 HydrophobicContact CG-CG 4.48Å; F94-R158 HydrophobicContact CZ-CB 3.98Å; E95-R158 IonicContact OE1-CZ 3.22Å; E95-R158 IonicContact OE1-NH1 3.84Å; E95-R158 PolarHBondContact OE1-NH1 2.89Å; E95-R158 IonicContact OE2-NH1 3.49Å; E95-R158 PolarHBondContact OE2-NH1 3.34Å
159	S	86.5	Confident	89.6	Confident	39 Å²	39	57 Å²	57	27%	0.273	29%	0.289	S	S	.	.			trans	-78.2	134.3	174.3	-57.9	0	0	0	0	109.6	P165	S159-P165 PolarHBondContact OG-O 2.93Å
160	K	84.9	Confident	89.6	Confident	96 Å²	96	54.6 Å²	54.6	42%	0.417	28%	0.281	S	S	.	.			trans	-66.9	152.5	175.6	-62.8	-179.5	-179.8	178.9	0	110.1	D74 F162 Q163	D74-K160 WeakPolarHBondContact OD1-CE 3.46Å; D74-K160 IonicContact OD1-NZ 3.36Å; D74-K160 PolarHBondContact OD1-NZ 3.14Å; D74-K160 WeakPolarHBondContact OD2-CE 3.21Å; D74-K160 IonicContact OD2-NZ 2.79Å; K160-F162 PolarHBondContact O-N 3.45Å; K160-F162 VanDerWaalsContact O-N 3.08Å; K160-Q163 HydrophobicContact CB-CB 4.31Å; K160-Q163 HydrophobicContact CB-CG 4Å; K160-Q163 PolarHBondContact O-N 3.36Å
161	E	79.2	Confident	89.7	Confident	172 Å²	172	51.4 Å²	51.4	80%	0.804	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-32.1	-179.4	-172.4	178.5	178	0	0	112.9
162	F	80.5	Confident	89.8	Confident	106 Å²	106	51.9 Å²	51.9	47%	0.465	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.2	-179.1	-53.6	-58.2	0	0	0	114.3	K160 N434 I435	K160-F162 PolarHBondContact O-N 3.45Å; K160-F162 VanDerWaalsContact O-N 3.08Å; F162-N434 HydrophobicContact CD1-CB 4.1Å; F162-I435 VanDerWaalsContact O-CB 3.3Å; F162-I435 WeakPolarHBondContact O-CB 3.46Å; F162-I435 WeakPolarHBondContact O-CG2 3.3Å; F162-I435 PolarHBondContact O-N 3.32Å
163	Q	86.7	Confident	90	Very high	35 Å²	35	51.6 Å²	51.6	16%	0.164	26%	0.255	C	S	.	.	S	Bend	trans	-103.5	161.8	-177.5	-72.9	179.2	-25	0	0	111.7	V72 K160	V72-Q163 PolarHBondContact O-NE2 3.23Å; K160-Q163 HydrophobicContact CB-CB 4.31Å; K160-Q163 HydrophobicContact CB-CG 4Å; K160-Q163 PolarHBondContact O-N 3.36Å
164	Y	89.7	Confident	90.1	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.235	C	C	.	.			trans	-73.7	129.6	171.9	-170.6	-106	0	0	0	109.9	F68 S166 T167 A290 V293 Q294 D295 W296 L299 Y436	F68-Y164 HydrophobicContact CB-CD1 4.24Å; F68-Y164 HydrophobicContact CB-CD2 4.4Å; F68-Y164 HydrophobicContact CB-CG 4Å; F68-Y164 HydrophobicContact CD1-CD2 4.21Å; F68-Y164 HydrophobicContact CD1-CG 4.41Å; Y164-S166 WeakPolarHBondContact CD1-O 2.98Å; Y164-S166 WeakPolarHBondContact CE1-O 3.38Å; Y164-T167 WeakPolarHBondContact O-CG2 3.45Å; Y164-A290 HydrophobicContact CD2-CB 4.37Å; Y164-A290 HydrophobicContact CE2-CB 4.09Å; Y164-A290 WeakPolarHBondContact CE2-O 3.35Å; Y164-V293 WeakPolarHBondContact CE2-O 3.35Å; Y164-V293 PolarHBondContact OH-O 3.25Å; Y164-Q294 VanDerWaalsContact OH-C 3.23Å; Y164-D295 PolarHBondContact OH-N 3.24Å; Y164-D295 VanDerWaalsContact OH-N 3.11Å; Y164-D295 PolarHBondContact OH-O 3.34Å; Y164-W296 HydrophobicContact CE1-CB 4.03Å; Y164-W296 PolarHBondContact OH-N 3.3Å; Y164-L299 HydrophobicContact CE1-CD2 4.21Å; Y164-L299 HydrophobicContact CE2-CD2 4.06Å; Y164-Y436 HydrophobicContact CD2-CE1 4.24Å
165	P	88.4	Confident	90.1	Very high	44 Å²	44	47.1 Å²	47.1	29%	0.286	23%	0.227	S	C	.	.	S	Bend	trans	-72.8	-46.5	-166.9	25.6	-34.7	0	0	0	114.3	S159 Q294	S159-P165 PolarHBondContact OG-O 2.93Å; P165-Q294 HydrophobicContact CG-CB 3.58Å; P165-Q294 HydrophobicContact CG-CG 3.79Å
166	S	89.8	Confident	89.8	Confident	33 Å²	33	45.8 Å²	45.8	23%	0.231	22%	0.224	C	C	.	.	S	Bend	trans	-95.1	107.6	-178.8	-177.5	0	0	0	0	110.4	Y164 Q294 W296	Y164-S166 WeakPolarHBondContact CD1-O 2.98Å; Y164-S166 WeakPolarHBondContact CE1-O 3.38Å; S166-Q294 WeakPolarHBondContact CB-O 3.32Å; S166-W296 WeakPolarHBondContact O-CB 3.37Å
167	T	93.4	Very high	89.5	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.012	25%	0.248	C	C	.	.			trans	-114	150.6	-176.8	64.7	0	0	0	0	111.5	V69 A71 Y164 V169 A170 E171	V69-T167 WeakPolarHBondContact O-CB 3.32Å; A71-T167 HydrophobicContact CB-CG2 4.27Å; Y164-T167 WeakPolarHBondContact O-CG2 3.45Å; T167-V169 PolarHBondContact O-N 3.16Å; T167-A170 PolarHBondContact O-N 3.35Å; T167-A170 VanDerWaalsContact OG1-CB 3.29Å; T167-A170 WeakPolarHBondContact OG1-CB 3.47Å; T167-A170 PolarHBondContact OG1-N 3.32Å; T167-A170 VanDerWaalsContact OG1-N 3.08Å; T167-E171 PolarHBondContact O-N 2.67Å
168	V	94	Very high	89.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-31.6	171.7	170.8	0	0	0	0	110.3	V69 F172 L174 Y236 W296	V69-V168 HydrophobicContact CB-CB 4.49Å; V69-V168 HydrophobicContact CB-CG2 3.87Å; V69-V168 HydrophobicContact CG2-CG2 3.95Å; V69-V168 PolarHBondContact O-N 3.48Å; V168-F172 HydrophobicContact CG1-CD2 3.57Å; V168-F172 HydrophobicContact CG1-CE2 3.87Å; V168-F172 PolarHBondContact O-N 3.49Å; V168-F172 VanDerWaalsContact O-N 3.07Å; V168-L174 HydrophobicContact CG1-CD1 4.4Å; V168-Y236 HydrophobicContact CG1-CD1 3.93Å; V168-Y236 HydrophobicContact CG1-CE1 3.63Å; V168-Y236 HydrophobicContact CG1-CE2 4.37Å; V168-Y236 HydrophobicContact CG1-CG 4.44Å; V168-Y236 HydrophobicContact CG2-CE1 4.42Å; V168-Y236 HydrophobicContact CG2-CE2 3.88Å; V168-W296 HydrophobicContact CG2-CD2 3.5Å; V168-W296 VanDerWaalsContact CG2-CD2 3.5Å; V168-W296 HydrophobicContact CG2-CE3 3.62Å; V168-W296 HydrophobicContact CG2-CG 4.01Å; V168-W296 HydrophobicContact CG2-CH2 4.15Å; V168-W296 HydrophobicContact CG2-CZ2 4.03Å; V168-W296 HydrophobicContact CG2-CZ3 3.95Å
169	V	92.8	Very high	89.2	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.2	-44.4	176.2	174.5	0	0	0	0	111.2	N70 V72 T167 N173 L174 V175	N70-V169 HydrophobicContact CB-CG2 4.48Å; V72-V169 HydrophobicContact CG2-CG1 4.5Å; T167-V169 PolarHBondContact O-N 3.16Å; V169-N173 WeakPolarHBondContact O-CA 3.2Å; V169-N173 PolarHBondContact O-N 2.53Å; V169-L174 HydrophobicContact CG1-CB 4.36Å; V169-L174 PolarHBondContact O-N 3Å; V169-V175 HydrophobicContact CG1-CG1 3.64Å
170	A	92.5	Very high	89.3	Confident	19 Å²	19	47.6 Å²	47.6	16%	0.157	26%	0.258	C	S	.	.	H	α-helix	trans	-69	-45.4	176.6	0	0	0	0	0	112.1	P73 Y157 T167 F172 N173	P73-A170 HydrophobicContact CG-CB 4.26Å; Y157-A170 HydrophobicContact CD1-CB 4.26Å; Y157-A170 HydrophobicContact CD2-CB 3.69Å; Y157-A170 HydrophobicContact CE2-CB 3.97Å; Y157-A170 WeakPolarHBondContact CE2-O 3.43Å; Y157-A170 HydrophobicContact CG-CB 3.85Å; T167-A170 PolarHBondContact O-N 3.35Å; T167-A170 VanDerWaalsContact OG1-CB 3.29Å; T167-A170 WeakPolarHBondContact OG1-CB 3.47Å; T167-A170 PolarHBondContact OG1-N 3.32Å; T167-A170 VanDerWaalsContact OG1-N 3.08Å; A170-F172 PolarHBondContact O-N 3.01Å; A170-N173 PolarHBondContact O-N 3.34Å
171	E	92.8	Very high	89.6	Confident	85 Å²	85	45 Å²	45	40%	0.397	25%	0.249	S	C	.	.	H	α-helix	trans	-67.3	-37.4	-175.8	-172.3	171.8	168.3	0	0	113.2	T167 W296 R297	T167-E171 PolarHBondContact O-N 2.67Å; E171-W296 VanDerWaalsContact OE2-CZ2 3.28Å; E171-W296 WeakPolarHBondContact OE2-CZ2 3.31Å; E171-W296 PolarHBondContact OE2-NE1 3.13Å; E171-R297 IonicContact OE1-CZ 3.22Å; E171-R297 VanDerWaalsContact OE1-CZ 3.28Å; E171-R297 IonicContact OE1-NE 2.58Å; E171-R297 PolarHBondContact OE1-NE 2.98Å; E171-R297 VanDerWaalsContact OE1-NE 3.13Å; E171-R297 IonicContact OE1-NH2 3.87Å; E171-R297 PolarHBondContact OE1-NH2 2.92Å; E171-R297 IonicContact OE2-CZ 3.17Å; E171-R297 IonicContact OE2-NE 2.97Å; E171-R297 PolarHBondContact OE2-NE 3.08Å; E171-R297 IonicContact OE2-NH2 3.66Å
172	F	93.9	Very high	90.2	Very high	27 Å²	27	37.1 Å²	37.1	12%	0.118	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	13.8	-179.6	-59.6	-40.4	0	0	0	114.2	V168 A170 L174 P231 H233 Y236 W296	V168-F172 HydrophobicContact CG1-CD2 3.57Å; V168-F172 HydrophobicContact CG1-CE2 3.87Å; V168-F172 PolarHBondContact O-N 3.49Å; V168-F172 VanDerWaalsContact O-N 3.07Å; A170-F172 PolarHBondContact O-N 3.01Å; F172-L174 VanDerWaalsContact C-N 3.31Å; F172-L174 HydrophobicContact CB-CD1 4.25Å; F172-L174 HydrophobicContact CB-CD2 4.26Å; F172-L174 HydrophobicContact CB-CG 3.92Å; F172-L174 PolarHBondContact O-N 2.76Å; F172-P231 WeakPolarHBondContact CE1-O 3.42Å; F172-H233 HydrophobicContact CB-CB 4.01Å; F172-H233 HydrophobicContact CD2-CB 3.73Å; F172-H233 HydrophobicContact CE2-CB 4.44Å; F172-H233 HydrophobicContact CG-CB 3.97Å; F172-Y236 HydrophobicContact CE2-CG 4.16Å; F172-W296 HydrophobicContact CE2-CH2 4.44Å; F172-W296 HydrophobicContact CE2-CZ2 4.33Å; F172-W296 HydrophobicContact CZ-CH2 4.43Å; F172-W296 HydrophobicContact CZ-CZ2 4.23Å
173	N	92.7	Very high	90.7	Very high	66 Å²	66	32.3 Å²	32.3	35%	0.353	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	44.4	-179.4	-62.4	-52.1	0	0	0	113.9	Y155 Y157 V169 A170 V175	Y155-N173 HydrophobicContact CD2-CB 4.34Å; Y157-N173 WeakPolarHBondContact OH-CA 3.08Å; Y157-N173 PolarHBondContact OH-OD1 3.18Å; V169-N173 WeakPolarHBondContact O-CA 3.2Å; V169-N173 PolarHBondContact O-N 2.53Å; A170-N173 PolarHBondContact O-N 3.34Å; N173-V175 PolarHBondContact O-N 3.22Å; N173-V175 VanDerWaalsContact O-N 3.1Å
174	L	92.2	Very high	91	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	20%	0.203	C	C	.	.			trans	-86.9	44.1	-177.5	-54.8	177.3	0	0	0	112.5	V168 V169 F172 I179 L181 H233	V168-L174 HydrophobicContact CG1-CD1 4.4Å; V169-L174 HydrophobicContact CG1-CB 4.36Å; V169-L174 PolarHBondContact O-N 3Å; F172-L174 VanDerWaalsContact C-N 3.31Å; F172-L174 HydrophobicContact CB-CD1 4.25Å; F172-L174 HydrophobicContact CB-CD2 4.26Å; F172-L174 HydrophobicContact CB-CG 3.92Å; F172-L174 PolarHBondContact O-N 2.76Å; L174-I179 WeakPolarHBondContact O-CA 3.18Å; L174-L181 HydrophobicContact CD2-CB 4.26Å; L174-L181 HydrophobicContact CD2-CD2 3.89Å; L174-L181 HydrophobicContact CD2-CG 4.19Å; L174-H233 HydrophobicContact CD1-CB 4.3Å; L174-H233 HydrophobicContact CD2-CB 4.17Å
175	V	90.2	Very high	91.3	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.006	20%	0.204	C	C	.	.			trans	-107.9	172.7	178.8	-64.8	0	0	0	0	111.2	V72 Y155 Y157 V169 N173 G177 N178	V72-V175 HydrophobicContact CG1-CG1 4.44Å; Y155-V175 HydrophobicContact CD1-CG2 4.21Å; Y155-V175 HydrophobicContact CD2-CG2 3.73Å; Y155-V175 HydrophobicContact CE1-CG2 4.09Å; Y155-V175 HydrophobicContact CE2-CG2 3.61Å; Y155-V175 HydrophobicContact CG-CG2 4.04Å; Y157-V175 HydrophobicContact CE1-CG1 3.87Å; Y157-V175 HydrophobicContact CE1-CG2 4.39Å; V169-V175 HydrophobicContact CG1-CG1 3.64Å; N173-V175 PolarHBondContact O-N 3.22Å; N173-V175 VanDerWaalsContact O-N 3.1Å; V175-G177 PolarHBondContact O-N 3.09Å; V175-N178 PolarHBondContact O-N 3.26Å
176	C	88.5	Confident	91.5	Very high	20 Å²	20	32.8 Å²	32.8	14%	0.135	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	54.7	-122.5	175.4	-52.6	0	0	0	0	112.2	H75 C115 N178 I179	H75-C176 PolarHBondContact NE2-SG 2.95Å; H75-C176 VanDerWaalsContact NE2-SG 3.35Å; C115-C176 WeakPolarHBondContact CA-SG 3.26Å; C115-C176 HydrophobicContact CB-CB 3.72Å; C115-C176 WeakPolarHBondContact CB-SG 3.49Å; C115-C176 VanDerWaalsContact SG-CA 3.57Å; C115-C176 WeakPolarHBondContact SG-CB 3.23Å; C115-C176 CovalentContact SG-SG 2.02Å; C115-C176 PolarHBondContact SG-SG 2.92Å; C176-N178 PolarHBondContact O-N 2.93Å; C176-N178 VanDerWaalsContact O-N 3.16Å; C176-I179 WeakPolarHBondContact O-CB 3.13Å; C176-I179 WeakPolarHBondContact O-CG2 3.14Å; C176-I179 PolarHBondContact O-N 3.38Å; C176-I179 VanDerWaalsContact O-N 3.14Å
177	G	85.4	Confident	91.8	Very high	71 Å²	71	31.4 Å²	31.4	73%	0.732	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-59.3	-25.2	177.7	0	0	0	0	0	114.3	V175	V175-G177 PolarHBondContact O-N 3.09Å
178	N	89.5	Confident	92	Very high	92 Å²	92	34.1 Å²	34.1	49%	0.492	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-92.1	3.2	-178.8	-66.4	-31.9	0	0	0	113.7	V175 C176 M180 L181	V175-N178 PolarHBondContact O-N 3.26Å; C176-N178 PolarHBondContact O-N 2.93Å; C176-N178 VanDerWaalsContact O-N 3.16Å; N178-M180 PolarHBondContact O-N 2.81Å; N178-L181 VanDerWaalsContact O-CB 3.22Å; N178-L181 WeakPolarHBondContact O-CB 3.29Å; N178-L181 PolarHBondContact O-N 3Å
179	I	88.9	Confident	92.1	Very high	34 Å²	34	34.3 Å²	34.3	17%	0.174	20%	0.198	C	C	.	.	H	α-helix	trans	-60.2	-35	-178.7	-164.6	161.1	0	0	0	112.8	V72 L174 C176 L181 S182 L183	V72-I179 HydrophobicContact CG2-CD1 4.39Å; L174-I179 WeakPolarHBondContact O-CA 3.18Å; C176-I179 WeakPolarHBondContact O-CB 3.13Å; C176-I179 WeakPolarHBondContact O-CG2 3.14Å; C176-I179 PolarHBondContact O-N 3.38Å; C176-I179 VanDerWaalsContact O-N 3.14Å; I179-L181 PolarHBondContact O-N 3.11Å; I179-L181 VanDerWaalsContact O-N 3.17Å; I179-S182 WeakPolarHBondContact O-CB 3.2Å; I179-S182 PolarHBondContact O-N 3.42Å; I179-S182 VanDerWaalsContact O-N 3.15Å; I179-L183 PolarHBondContact O-N 3.04Å
180	M	88.7	Confident	92.3	Very high	94 Å²	94	34.3 Å²	34.3	46%	0.463	20%	0.198	S	C	.	.	H	α-helix	trans	-61.5	-26.4	178.6	-64.8	-63.1	155.4	0	0	112.1	N178 L183 L184 H550	N178-M180 PolarHBondContact O-N 2.81Å; M180-L183 PolarHBondContact O-N 3.48Å; M180-L183 HydrophobicContact SD-CD1 4.06Å; M180-L184 VanDerWaalsContact O-CB 3.28Å; M180-L184 WeakPolarHBondContact O-CB 3.48Å; M180-L184 PolarHBondContact O-N 2.94Å; M180-H550 WeakPolarHBondContact CE-NE2 3.49Å
181	L	92.3	Very high	92.6	Very high	43 Å²	43	35.5 Å²	35.5	23%	0.225	20%	0.203	C	C	.	.	H	α-helix	trans	-72.5	-33.4	-179.9	-167.1	50.1	0	0	0	112.3	L174 N178 I179 L184 G185 H233 H237	L174-L181 HydrophobicContact CD2-CB 4.26Å; L174-L181 HydrophobicContact CD2-CD2 3.89Å; L174-L181 HydrophobicContact CD2-CG 4.19Å; N178-L181 VanDerWaalsContact O-CB 3.22Å; N178-L181 WeakPolarHBondContact O-CB 3.29Å; N178-L181 PolarHBondContact O-N 3Å; I179-L181 PolarHBondContact O-N 3.11Å; I179-L181 VanDerWaalsContact O-N 3.17Å; L181-L184 HydrophobicContact CD1-CD2 4.17Å; L181-G185 PolarHBondContact O-N 3.19Å; L181-H233 WeakPolarHBondContact CD2-CD2 3.41Å; L181-H233 WeakPolarHBondContact CD2-NE2 3.25Å; L181-H237 PolarHBondContact O-CE1 3.49Å; L181-H237 VanDerWaalsContact O-CE1 3.29Å
182	S	91.3	Very high	92.8	Very high	5 Å²	5	31.5 Å²	31.5	4%	0.035	19%	0.185	C	C	.	.	H	α-helix	trans	-66.7	-41.8	172.5	178.7	0	0	0	0	111.8	I179 G185 T186	I179-S182 WeakPolarHBondContact O-CB 3.2Å; I179-S182 PolarHBondContact O-N 3.42Å; I179-S182 VanDerWaalsContact O-N 3.15Å; S182-G185 PolarHBondContact O-N 3.17Å; S182-T186 PolarHBondContact O-N 2.7Å; S182-T186 PolarHBondContact O-OG1 3.26Å
183	L	91.5	Very high	92.9	Very high	5 Å²	5	31.1 Å²	31.1	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-65.2	-46.7	175	-60.1	175.8	0	0	0	111.1	I179 M180 G185 T186 S187 F547 H550	I179-L183 PolarHBondContact O-N 3.04Å; M180-L183 PolarHBondContact O-N 3.48Å; M180-L183 HydrophobicContact SD-CD1 4.06Å; L183-G185 VanDerWaalsContact C-N 3.26Å; L183-G185 PolarHBondContact O-N 3.49Å; L183-T186 PolarHBondContact O-N 2.96Å; L183-T186 VanDerWaalsContact O-N 3.1Å; L183-S187 PolarHBondContact O-N 3.31Å; L183-S187 PolarHBondContact O-OG 2.87Å; L183-F547 HydrophobicContact CB-CE1 4.26Å; L183-F547 HydrophobicContact CD1-CD1 4.37Å; L183-H550 HydrophobicContact CD1-CB 3.61Å; L183-H550 HydrophobicContact CD2-CB 4.39Å
184	L	93.5	Very high	93.1	Very high	79 Å²	79	28.7 Å²	28.7	41%	0.414	17%	0.172	S	C	.	.	H	α-helix	trans	-57.2	-40.1	175.2	-175.8	64.9	0	0	0	111.4	M180 L181 T186 S187 L188	M180-L184 VanDerWaalsContact O-CB 3.28Å; M180-L184 WeakPolarHBondContact O-CB 3.48Å; M180-L184 PolarHBondContact O-N 2.94Å; L181-L184 HydrophobicContact CD1-CD2 4.17Å; L184-T186 VanDerWaalsContact C-N 3.34Å; L184-T186 PolarHBondContact O-N 2.91Å; L184-S187 CarbonylContact O-C 3.59Å; L184-S187 WeakPolarHBondContact O-CB 3.44Å; L184-S187 PolarHBondContact O-N 2.72Å; L184-L188 HydrophobicContact CD1-CG 4.46Å; L184-L188 HydrophobicContact CG-CD1 4.17Å; L184-L188 HydrophobicContact CG-CG 4.32Å; L184-L188 WeakPolarHBondContact O-CB 3.03Å; L184-L188 VanDerWaalsContact O-CG 3.28Å; L184-L188 WeakPolarHBondContact O-CG 3.39Å; L184-L188 PolarHBondContact O-N 3.35Å
185	G	94.1	Very high	93.2	Very high	2 Å²	2	33.4 Å²	33.4	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-57.3	-42.6	174.6	0	0	0	0	0	114.2	L181 S182 L183 F189 H237	L181-G185 PolarHBondContact O-N 3.19Å; S182-G185 PolarHBondContact O-N 3.17Å; L183-G185 VanDerWaalsContact C-N 3.26Å; L183-G185 PolarHBondContact O-N 3.49Å; G185-F189 PolarHBondContact O-N 3.13Å; G185-H237 WeakPolarHBondContact CA-CD2 3.21Å; G185-H237 WeakPolarHBondContact CA-NE2 3.23Å
186	T	94.4	Very high	93.5	Very high	8 Å²	8	33.3 Å²	33.3	5%	0.049	19%	0.192	C	C	.	.	H	α-helix	trans	-69.3	-40.2	176	-50.7	0	0	0	0	111	P66 N70 S182 L183 L184 F189 I190 L426 T546	P66-T186 HydrophobicContact CB-CG2 4.23Å; P66-T186 HydrophobicContact CG-CG2 3.98Å; N70-T186 PolarHBondContact ND2-OG1 3.05Å; S182-T186 PolarHBondContact O-N 2.7Å; S182-T186 PolarHBondContact O-OG1 3.26Å; L183-T186 PolarHBondContact O-N 2.96Å; L183-T186 VanDerWaalsContact O-N 3.1Å; L184-T186 VanDerWaalsContact C-N 3.34Å; L184-T186 PolarHBondContact O-N 2.91Å; T186-F189 WeakPolarHBondContact O-CB 3.34Å; T186-F189 PolarHBondContact O-N 3.24Å; T186-I190 WeakPolarHBondContact O-CG1 3.41Å; T186-I190 PolarHBondContact O-N 3.39Å; T186-L426 HydrophobicContact CG2-CD1 3.92Å; T186-T546 HydrophobicContact CG2-CG2 3.67Å
187	S	95.9	Very high	93.7	Very high	4 Å²	4	33.2 Å²	33.2	3%	0.028	19%	0.19	C	C	.	.	H	α-helix	trans	-61.1	-42.7	174.9	-65.6	0	0	0	0	112.3	L183 L184 F189 I190 V191 T546 F547	L183-S187 PolarHBondContact O-N 3.31Å; L183-S187 PolarHBondContact O-OG 2.87Å; L184-S187 CarbonylContact O-C 3.59Å; L184-S187 WeakPolarHBondContact O-CB 3.44Å; L184-S187 PolarHBondContact O-N 2.72Å; S187-F189 VanDerWaalsContact C-N 3.35Å; S187-F189 PolarHBondContact O-N 3.44Å; S187-I190 CarbonylContact O-C 3.56Å; S187-I190 WeakPolarHBondContact O-CA 3.38Å; S187-I190 WeakPolarHBondContact O-CB 3.32Å; S187-I190 PolarHBondContact O-N 3.42Å; S187-I190 VanDerWaalsContact O-N 3.07Å; S187-V191 WeakPolarHBondContact O-CG2 3.3Å; S187-V191 PolarHBondContact O-N 2.95Å; S187-T546 PolarHBondContact OG-OG1 3.48Å; S187-F547 WeakPolarHBondContact OG-CE2 3.29Å
188	L	96.8	Very high	93.9	Very high	59 Å²	59	32.8 Å²	32.8	31%	0.309	17%	0.17	S	C	.	.	H	α-helix	trans	-63.6	-37.9	177.5	-74.5	172.5	0	0	0	112.1	L184 I190 V191 G192 H237 T241	L184-L188 HydrophobicContact CD1-CG 4.46Å; L184-L188 HydrophobicContact CG-CD1 4.17Å; L184-L188 HydrophobicContact CG-CG 4.32Å; L184-L188 WeakPolarHBondContact O-CB 3.03Å; L184-L188 VanDerWaalsContact O-CG 3.28Å; L184-L188 WeakPolarHBondContact O-CG 3.39Å; L184-L188 PolarHBondContact O-N 3.35Å; L188-I190 VanDerWaalsContact C-N 3.29Å; L188-I190 PolarHBondContact O-N 3.21Å; L188-V191 WeakPolarHBondContact O-CB 3.49Å; L188-V191 PolarHBondContact O-N 3.21Å; L188-G192 PolarHBondContact O-N 3.29Å; L188-H237 HydrophobicContact CD1-CB 4.22Å; L188-T241 WeakPolarHBondContact CB-OG1 3.5Å; L188-T241 WeakPolarHBondContact O-CG2 3.41Å
189	F	97	Very high	94	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.018	17%	0.165	C	C	.	.	H	α-helix	trans	-56.5	-44.8	170	177.9	-87.3	0	0	0	111.6	M62 V63 G185 T186 S187 G192 M193 R240 V243	M62-F189 HydrophobicContact CB-CE2 4.17Å; M62-F189 HydrophobicContact CB-CZ 4.14Å; V63-F189 HydrophobicContact CB-CE1 3.87Å; V63-F189 HydrophobicContact CB-CZ 4.43Å; V63-F189 HydrophobicContact CG2-CE1 3.95Å; G185-F189 PolarHBondContact O-N 3.13Å; T186-F189 WeakPolarHBondContact O-CB 3.34Å; T186-F189 PolarHBondContact O-N 3.24Å; S187-F189 VanDerWaalsContact C-N 3.35Å; S187-F189 PolarHBondContact O-N 3.44Å; F189-G192 WeakPolarHBondContact O-CA 3.13Å; F189-G192 PolarHBondContact O-N 2.68Å; F189-M193 HydrophobicContact CD1-CG 4.16Å; F189-M193 HydrophobicContact CD1-SD 3.85Å; F189-M193 HydrophobicContact CE1-CG 3.85Å; F189-M193 HydrophobicContact CE1-SD 3.45Å; F189-M193 WeakPolarHBondContact CE1-SD 3.25Å; F189-M193 HydrophobicContact CZ-SD 4.47Å; F189-M193 WeakPolarHBondContact O-CG 3.49Å; F189-M193 PolarHBondContact O-N 3.29Å; F189-R240 HydrophobicContact CD2-CB 4.3Å; F189-R240 WeakPolarHBondContact CD2-O 3.35Å; F189-V243 HydrophobicContact CE2-CB 4.36Å; F189-V243 HydrophobicContact CE2-CG1 4.05Å
190	I	97	Very high	94	Very high	1 Å²	1	31 Å²	31	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-69	-36.5	179.1	-61.1	171.2	0	0	0	111.3	T186 S187 L188 G192 M193 S194 L422 R539 G542 I543 T546	T186-I190 WeakPolarHBondContact O-CG1 3.41Å; T186-I190 PolarHBondContact O-N 3.39Å; S187-I190 CarbonylContact O-C 3.56Å; S187-I190 WeakPolarHBondContact O-CA 3.38Å; S187-I190 WeakPolarHBondContact O-CB 3.32Å; S187-I190 PolarHBondContact O-N 3.42Å; S187-I190 VanDerWaalsContact O-N 3.07Å; L188-I190 VanDerWaalsContact C-N 3.29Å; L188-I190 PolarHBondContact O-N 3.21Å; I190-G192 VanDerWaalsContact C-N 3.28Å; I190-G192 PolarHBondContact O-N 2.81Å; I190-M193 HydrophobicContact CG1-SD 4.38Å; I190-M193 WeakPolarHBondContact O-CA 3.29Å; I190-M193 VanDerWaalsContact O-CB 3.32Å; I190-M193 WeakPolarHBondContact O-CB 3.49Å; I190-M193 PolarHBondContact O-N 3.5Å; I190-S194 PolarHBondContact O-N 3.06Å; I190-S194 PolarHBondContact O-OG 3.24Å; I190-L422 HydrophobicContact CD1-CD1 4.07Å; I190-L422 HydrophobicContact CG1-CD1 4.41Å; I190-R539 HydrophobicContact CG2-CB 3.87Å; I190-R539 WeakPolarHBondContact CG2-O 3.42Å; I190-G542 WeakPolarHBondContact CD1-O 3.45Å; I190-I543 HydrophobicContact CB-CG1 4.06Å; I190-I543 HydrophobicContact CG2-CG1 3.81Å; I190-T546 HydrophobicContact CD1-CG2 4.07Å
191	V	97.5	Very high	93.8	Very high	43 Å²	43	27.6 Å²	27.6	26%	0.261	15%	0.145	S	C	.	.	H	α-helix	trans	-56.7	-44.9	170	171.9	0	0	0	0	110.5	S187 L188 M193 S194 F195 I543	S187-V191 WeakPolarHBondContact O-CG2 3.3Å; S187-V191 PolarHBondContact O-N 2.95Å; L188-V191 WeakPolarHBondContact O-CB 3.49Å; L188-V191 PolarHBondContact O-N 3.21Å; V191-M193 VanDerWaalsContact C-N 3.33Å; V191-M193 PolarHBondContact O-N 2.71Å; V191-S194 VanDerWaalsContact O-CB 3.3Å; V191-S194 WeakPolarHBondContact O-CB 3.16Å; V191-S194 PolarHBondContact O-N 3.04Å; V191-F195 HydrophobicContact CG1-CD2 3.98Å; V191-F195 HydrophobicContact CG1-CE2 3.7Å; V191-F195 VanDerWaalsContact O-CD2 3.29Å; V191-F195 WeakPolarHBondContact O-CD2 3.29Å; V191-F195 PolarHBondContact O-N 3.3Å; V191-I543 HydrophobicContact CG2-CD1 3.43Å; V191-I543 VanDerWaalsContact CG2-CD1 3.43Å; V191-I543 HydrophobicContact CG2-CG1 4.2Å
192	G	97.6	Very high	93.5	Very high	2 Å²	2	29.1 Å²	29.1	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-53.6	-49.9	171.4	0	0	0	0	0	111.5	L188 F189 I190 S194 F195 G196 F245	L188-G192 PolarHBondContact O-N 3.29Å; F189-G192 WeakPolarHBondContact O-CA 3.13Å; F189-G192 PolarHBondContact O-N 2.68Å; I190-G192 VanDerWaalsContact C-N 3.28Å; I190-G192 PolarHBondContact O-N 2.81Å; G192-S194 VanDerWaalsContact C-N 3.32Å; G192-S194 PolarHBondContact O-N 3.02Å; G192-F195 PolarHBondContact O-N 3.25Å; G192-G196 PolarHBondContact O-N 3.35Å; G192-F245 WeakPolarHBondContact O-CA 3.27Å
193	M	96.2	Very high	93.3	Very high	19 Å²	19	32.1 Å²	32.1	9%	0.094	16%	0.161	C	C	.	.	H	α-helix	trans	-57.4	-41.1	176.7	-58.9	175.7	66.3	0	0	112.8	V63 F189 I190 V191 F195 G196 F197 G244 T248	V63-M193 HydrophobicContact CG2-SD 4.1Å; F189-M193 HydrophobicContact CD1-CG 4.16Å; F189-M193 HydrophobicContact CD1-SD 3.85Å; F189-M193 HydrophobicContact CE1-CG 3.85Å; F189-M193 HydrophobicContact CE1-SD 3.45Å; F189-M193 WeakPolarHBondContact CE1-SD 3.25Å; F189-M193 HydrophobicContact CZ-SD 4.47Å; F189-M193 WeakPolarHBondContact O-CG 3.49Å; F189-M193 PolarHBondContact O-N 3.29Å; I190-M193 HydrophobicContact CG1-SD 4.38Å; I190-M193 WeakPolarHBondContact O-CA 3.29Å; I190-M193 VanDerWaalsContact O-CB 3.32Å; I190-M193 WeakPolarHBondContact O-CB 3.49Å; I190-M193 PolarHBondContact O-N 3.5Å; V191-M193 VanDerWaalsContact C-N 3.33Å; V191-M193 PolarHBondContact O-N 2.71Å; M193-F195 VanDerWaalsContact C-N 3.35Å; M193-F195 PolarHBondContact O-N 2.71Å; M193-G196 WeakPolarHBondContact O-CA 2.84Å; M193-G196 PolarHBondContact O-N 3.29Å; M193-G196 VanDerWaalsContact O-N 3.11Å; M193-F197 VanDerWaalsContact O-CD2 3.28Å; M193-F197 WeakPolarHBondContact O-CD2 3.3Å; M193-F197 PolarHBondContact O-N 2.96Å; M193-G244 WeakPolarHBondContact CA-O 3.31Å; M193-T248 HydrophobicContact CB-CG2 4.46Å; M193-T248 WeakPolarHBondContact CG-OG1 3.36Å; M193-T248 WeakPolarHBondContact O-CG2 3.24Å
194	S	96	Very high	93.1	Very high	14 Å²	14	31.9 Å²	31.9	10%	0.098	16%	0.16	C	C	.	.	H	α-helix	trans	-54.8	-51.3	177.6	-47	0	0	0	0	111.2	I190 V191 G192 G196 F197 I198 G536 R539	I190-S194 PolarHBondContact O-N 3.06Å; I190-S194 PolarHBondContact O-OG 3.24Å; V191-S194 VanDerWaalsContact O-CB 3.3Å; V191-S194 WeakPolarHBondContact O-CB 3.16Å; V191-S194 PolarHBondContact O-N 3.04Å; G192-S194 VanDerWaalsContact C-N 3.32Å; G192-S194 PolarHBondContact O-N 3.02Å; S194-G196 VanDerWaalsContact C-N 3.31Å; S194-G196 PolarHBondContact O-N 2.78Å; S194-F197 PolarHBondContact O-N 3.22Å; S194-I198 WeakPolarHBondContact O-CG1 3.09Å; S194-I198 PolarHBondContact O-N 2.97Å; S194-G536 WeakPolarHBondContact CB-O 3.06Å; S194-R539 WeakPolarHBondContact OG-CB 3.4Å
195	F	95.8	Very high	92.7	Very high	101 Å²	101	31 Å²	31	44%	0.443	16%	0.155	S	C	.	.	H	α-helix	trans	-66.9	-34.2	177.5	-71.9	-62.4	0	0	0	111.9	V191 G192 M193 F197 I198 F199 F245	V191-F195 HydrophobicContact CG1-CD2 3.98Å; V191-F195 HydrophobicContact CG1-CE2 3.7Å; V191-F195 VanDerWaalsContact O-CD2 3.29Å; V191-F195 WeakPolarHBondContact O-CD2 3.29Å; V191-F195 PolarHBondContact O-N 3.3Å; G192-F195 PolarHBondContact O-N 3.25Å; M193-F195 VanDerWaalsContact C-N 3.35Å; M193-F195 PolarHBondContact O-N 2.71Å; F195-F197 VanDerWaalsContact C-N 3.31Å; F195-F197 PolarHBondContact O-N 3.04Å; F195-I198 PolarHBondContact O-N 3.45Å; F195-F199 HydrophobicContact CB-CD2 4.11Å; F195-F199 HydrophobicContact CB-CE2 4.41Å; F195-F199 HydrophobicContact CD1-CD2 4.15Å; F195-F199 AromaticContact CD1-CE2 3.64Å; F195-F199 HydrophobicContact CD1-CE2 3.64Å; F195-F199 HydrophobicContact CE1-CE2 4.38Å; F195-F199 HydrophobicContact CG-CE2 4.43Å; F195-F199 WeakPolarHBondContact O-CB 3.19Å; F195-F199 WeakPolarHBondContact O-CD2 3.4Å; F195-F199 PolarHBondContact O-N 3.24Å; F195-F245 HydrophobicContact CB-CD2 3.77Å; F195-F245 HydrophobicContact CB-CE2 4.11Å
196	G	95.3	Very high	92.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.6	-38	174	0	0	0	0	0	112.8	G192 M193 S194 G200 F245	G192-G196 PolarHBondContact O-N 3.35Å; M193-G196 WeakPolarHBondContact O-CA 2.84Å; M193-G196 PolarHBondContact O-N 3.29Å; M193-G196 VanDerWaalsContact O-N 3.11Å; S194-G196 VanDerWaalsContact C-N 3.31Å; S194-G196 PolarHBondContact O-N 2.78Å; G196-G200 WeakPolarHBondContact O-CA 3.46Å; G196-G200 PolarHBondContact O-N 3.08Å; G196-F245 WeakPolarHBondContact CA-O 3.42Å
197	F	92.5	Very high	92	Very high	18 Å²	18	38.6 Å²	38.6	8%	0.079	19%	0.188	C	C	.	.	H	α-helix	trans	-69.7	-44.8	174.6	-79.4	-61.2	0	0	0	113	M193 S194 F195 T248 V252 N535 R539	M193-F197 VanDerWaalsContact O-CD2 3.28Å; M193-F197 WeakPolarHBondContact O-CD2 3.3Å; M193-F197 PolarHBondContact O-N 2.96Å; S194-F197 PolarHBondContact O-N 3.22Å; F195-F197 VanDerWaalsContact C-N 3.31Å; F195-F197 PolarHBondContact O-N 3.04Å; F197-T248 HydrophobicContact CB-CG2 4.48Å; F197-T248 HydrophobicContact CD1-CG2 3.73Å; F197-T248 HydrophobicContact CD2-CG2 3.44Å; F197-T248 VanDerWaalsContact CD2-CG2 3.44Å; F197-T248 HydrophobicContact CE1-CG2 3.64Å; F197-T248 HydrophobicContact CE2-CG2 3.33Å; F197-T248 HydrophobicContact CG-CG2 3.63Å; F197-T248 HydrophobicContact CZ-CG2 3.45Å; F197-T248 VanDerWaalsContact CZ-CG2 3.45Å; F197-V252 HydrophobicContact CD1-CG2 3.47Å; F197-V252 VanDerWaalsContact CD1-CG2 3.47Å; F197-V252 HydrophobicContact CE1-CG2 3.8Å; F197-N535 WeakPolarHBondContact CD1-ND2 3.38Å; F197-N535 WeakPolarHBondContact CE1-ND2 3.46Å; F197-N535 VanDerWaalsContact CZ-ND2 3.35Å; F197-N535 WeakPolarHBondContact CZ-ND2 3.29Å; F197-R539 HydrophobicContact CD2-CG 4.19Å; F197-R539 HydrophobicContact CE2-CG 4.43Å
198	I	90.8	Very high	91.7	Very high	62 Å²	62	38.4 Å²	38.4	32%	0.318	19%	0.186	S	C	.	.	H	α-helix	trans	-66.8	-48.4	-177.7	-65.3	168.6	0	0	0	110.5	S194 F195	S194-I198 WeakPolarHBondContact O-CG1 3.09Å; S194-I198 PolarHBondContact O-N 2.97Å; F195-I198 PolarHBondContact O-N 3.45Å
199	F	90.4	Very high	91.4	Very high	89 Å²	89	36.4 Å²	36.4	39%	0.39	17%	0.174	S	C	.	.	H	α-helix	trans	-87.6	-25.8	-175.5	-67.9	-66.3	0	0	0	113.4	F195 G201 Y202 F203 F245	F195-F199 HydrophobicContact CB-CD2 4.11Å; F195-F199 HydrophobicContact CB-CE2 4.41Å; F195-F199 HydrophobicContact CD1-CD2 4.15Å; F195-F199 AromaticContact CD1-CE2 3.64Å; F195-F199 HydrophobicContact CD1-CE2 3.64Å; F195-F199 HydrophobicContact CE1-CE2 4.38Å; F195-F199 HydrophobicContact CG-CE2 4.43Å; F195-F199 WeakPolarHBondContact O-CB 3.19Å; F195-F199 WeakPolarHBondContact O-CD2 3.4Å; F195-F199 PolarHBondContact O-N 3.24Å; F199-G201 VanDerWaalsContact C-N 3.32Å; F199-G201 PolarHBondContact O-N 3.23Å; F199-Y202 WeakPolarHBondContact O-CB 3.49Å; F199-Y202 PolarHBondContact O-N 2.85Å; F199-Y202 VanDerWaalsContact O-N 3.07Å; F199-F203 HydrophobicContact CB-CD2 3.98Å; F199-F203 HydrophobicContact CB-CE2 3.97Å; F199-F203 VanDerWaalsContact O-CD2 3.25Å; F199-F203 WeakPolarHBondContact O-CD2 3.04Å; F199-F203 PolarHBondContact O-N 3.48Å; F199-F245 HydrophobicContact CB-CE2 4.28Å; F199-F245 HydrophobicContact CD2-CE2 4.25Å
200	G	89.6	Confident	91.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-55.4	-44.9	-178.7	0	0	0	0	0	112.9	G196 G204 V253	G196-G200 WeakPolarHBondContact O-CA 3.46Å; G196-G200 PolarHBondContact O-N 3.08Å; G200-G204 PolarHBondContact O-N 3.34Å; G200-V253 VanDerWaalsContact O-CG2 3.25Å; G200-V253 WeakPolarHBondContact O-CG2 3.27Å
201	G	84.3	Confident	91.1	Very high	21 Å²	21	43.1 Å²	43.1	22%	0.216	21%	0.205	C	C	.	.	H	α-helix	trans	-62.4	-45.8	174.6	0	0	0	0	0	112.5	F199 F203 G204 D205	F199-G201 VanDerWaalsContact C-N 3.32Å; F199-G201 PolarHBondContact O-N 3.23Å; G201-F203 PolarHBondContact O-N 3.07Å; G201-G204 PolarHBondContact O-N 3.46Å; G201-D205 WeakPolarHBondContact O-CB 3.23Å; G201-D205 PolarHBondContact O-N 3.44Å
202	Y	86.3	Confident	90.9	Very high	76 Å²	76	41.2 Å²	41.2	30%	0.298	19%	0.194	S	C	.	.	H	α-helix	trans	-58.7	-47.8	177.7	175.3	-94.1	0	0	0	112.6	F199 D205 K206	F199-Y202 WeakPolarHBondContact O-CB 3.49Å; F199-Y202 PolarHBondContact O-N 2.85Å; F199-Y202 VanDerWaalsContact O-N 3.07Å; Y202-D205 PolarHBondContact O-N 3.47Å; Y202-K206 HydrophobicContact CE1-CD 3.86Å; Y202-K206 VanDerWaalsContact O-CB 3.28Å; Y202-K206 WeakPolarHBondContact O-CB 3.33Å; Y202-K206 PolarHBondContact O-N 2.62Å; Y202-K206 PolarHBondContact OH-NZ 2.98Å
203	F	87.8	Confident	90.7	Very high	68 Å²	68	41.1 Å²	41.1	30%	0.298	19%	0.193	S	C	.	.	H	α-helix	trans	-63.4	-42.7	177.9	-83.1	-79.7	0	0	0	111.4	F199 G201 D205 K206 F207 F216	F199-F203 HydrophobicContact CB-CD2 3.98Å; F199-F203 HydrophobicContact CB-CE2 3.97Å; F199-F203 VanDerWaalsContact O-CD2 3.25Å; F199-F203 WeakPolarHBondContact O-CD2 3.04Å; F199-F203 PolarHBondContact O-N 3.48Å; G201-F203 PolarHBondContact O-N 3.07Å; F203-D205 VanDerWaalsContact C-N 3.34Å; F203-D205 PolarHBondContact O-N 3.03Å; F203-K206 PolarHBondContact O-N 3.49Å; F203-F207 HydrophobicContact CB-CD2 4.49Å; F203-F207 AromaticContact CD1-CD2 3.57Å; F203-F207 HydrophobicContact CD1-CD2 3.57Å; F203-F207 AromaticContact CD1-CE2 3.45Å; F203-F207 HydrophobicContact CD1-CE2 3.45Å; F203-F207 VanDerWaalsContact CD1-CE2 3.45Å; F203-F207 HydrophobicContact CE1-CD2 4.28Å; F203-F207 AromaticContact CE1-CE2 3.71Å; F203-F207 HydrophobicContact CE1-CE2 3.71Å; F203-F207 HydrophobicContact CG-CD2 4.46Å; F203-F207 PolarHBondContact O-N 3.03Å; F203-F216 HydrophobicContact CB-CE2 3.8Å; F203-F216 HydrophobicContact CB-CZ 4.06Å; F203-F216 HydrophobicContact CD2-CE2 4.32Å; F203-F216 AromaticContact CD2-CZ 3.68Å; F203-F216 HydrophobicContact CD2-CZ 3.68Å; F203-F216 HydrophobicContact CE2-CZ 4.4Å; F203-F216 HydrophobicContact CG-CE2 4.2Å; F203-F216 AromaticContact CG-CZ 3.98Å; F203-F216 HydrophobicContact CG-CZ 3.98Å
204	G	85.9	Confident	90.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.5	-38.9	176.4	0	0	0	0	0	113.1	G200 G201 G208 R209	G200-G204 PolarHBondContact O-N 3.34Å; G201-G204 PolarHBondContact O-N 3.46Å; G204-G208 CarbonylContact O-C 3.56Å; G204-G208 VanDerWaalsContact O-C 3.28Å; G204-G208 VanDerWaalsContact O-CA 3.32Å; G204-G208 WeakPolarHBondContact O-CA 3.42Å; G204-G208 PolarHBondContact O-N 3.46Å; G204-R209 PolarHBondContact O-NH1 3.15Å
205	D	85	Confident	90.5	Very high	59 Å²	59	44.1 Å²	44.1	32%	0.316	21%	0.211	S	C	.	.	H	α-helix	trans	-77.9	-27.5	-178	-72	-17.4	0	0	0	112.3	G201 Y202 F203 R209 W323	G201-D205 WeakPolarHBondContact O-CB 3.23Å; G201-D205 PolarHBondContact O-N 3.44Å; Y202-D205 PolarHBondContact O-N 3.47Å; F203-D205 VanDerWaalsContact C-N 3.34Å; F203-D205 PolarHBondContact O-N 3.03Å; D205-R209 VanDerWaalsContact N-NH1 3.14Å; D205-R209 IonicContact OD1-CZ 3.75Å; D205-R209 VanDerWaalsContact OD1-CZ 3.22Å; D205-R209 IonicContact OD1-NH1 3.95Å; D205-R209 PolarHBondContact OD1-NH1 3.17Å; D205-R209 IonicContact OD1-NH2 3.91Å; D205-R209 PolarHBondContact OD1-NH2 3.07Å; D205-W323 PolarHBondContact O-NE1 3.18Å
206	K	85.4	Confident	90.5	Very high	79 Å²	79	39.6 Å²	39.6	34%	0.343	19%	0.191	S	C	.	.	H	α-helix	trans	-86.4	-50.8	-179.2	-177.6	175.1	178.9	-179.3	0	113	Y202 F203	Y202-K206 HydrophobicContact CE1-CD 3.86Å; Y202-K206 VanDerWaalsContact O-CB 3.28Å; Y202-K206 WeakPolarHBondContact O-CB 3.33Å; Y202-K206 PolarHBondContact O-N 2.62Å; Y202-K206 PolarHBondContact OH-NZ 2.98Å; F203-K206 PolarHBondContact O-N 3.49Å
207	F	89	Confident	90.5	Very high	92 Å²	92	39.6 Å²	39.6	40%	0.404	19%	0.191	S	C	.	.	H	α-helix	trans	-99.1	-8.5	-171.9	-62.7	-75.4	0	0	0	113.6	F203 N211	F203-F207 HydrophobicContact CB-CD2 4.49Å; F203-F207 AromaticContact CD1-CD2 3.57Å; F203-F207 HydrophobicContact CD1-CD2 3.57Å; F203-F207 AromaticContact CD1-CE2 3.45Å; F203-F207 HydrophobicContact CD1-CE2 3.45Å; F203-F207 VanDerWaalsContact CD1-CE2 3.45Å; F203-F207 HydrophobicContact CE1-CD2 4.28Å; F203-F207 AromaticContact CE1-CE2 3.71Å; F203-F207 HydrophobicContact CE1-CE2 3.71Å; F203-F207 HydrophobicContact CG-CD2 4.46Å; F203-F207 PolarHBondContact O-N 3.03Å; F207-N211 HydrophobicContact CB-CB 4.42Å; F207-N211 PolarHBondContact O-ND2 3.46Å
208	G	89.1	Confident	90.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.2	C	C	.	.			trans	94.6	159.6	-171.9	0	0	0	0	0	111.8	G204 G212 E319 W323	G204-G208 CarbonylContact O-C 3.56Å; G204-G208 VanDerWaalsContact O-C 3.28Å; G204-G208 VanDerWaalsContact O-CA 3.32Å; G204-G208 WeakPolarHBondContact O-CA 3.42Å; G204-G208 PolarHBondContact O-N 3.46Å; G208-G212 PolarHBondContact O-N 3.3Å; G208-G212 VanDerWaalsContact O-N 3.09Å; G208-E319 WeakPolarHBondContact CA-OE2 3.31Å; G208-W323 VanDerWaalsContact CA-CZ2 3.42Å; G208-W323 VanDerWaalsContact CA-CZ3 3.41Å
209	R	91.9	Very high	90.9	Very high	16 Å²	16	41.5 Å²	41.5	6%	0.06	20%	0.2	C	C	.	.	H	α-helix	trans	-67.9	-40.5	-178	-52.2	-57.6	-176.3	-145.2	4.1	111.2	G204 D205 A213 V253 L257 E260 E319	G204-R209 PolarHBondContact O-NH1 3.15Å; D205-R209 VanDerWaalsContact N-NH1 3.14Å; D205-R209 IonicContact OD1-CZ 3.75Å; D205-R209 VanDerWaalsContact OD1-CZ 3.22Å; D205-R209 IonicContact OD1-NH1 3.95Å; D205-R209 PolarHBondContact OD1-NH1 3.17Å; D205-R209 IonicContact OD1-NH2 3.91Å; D205-R209 PolarHBondContact OD1-NH2 3.07Å; R209-A213 VanDerWaalsContact O-CB 3.29Å; R209-A213 WeakPolarHBondContact O-CB 3.44Å; R209-A213 PolarHBondContact O-N 2.86Å; R209-V253 VanDerWaalsContact CA-CG1 3.45Å; R209-V253 HydrophobicContact CB-CG1 3.95Å; R209-V253 WeakPolarHBondContact O-CG1 3.13Å; R209-L257 HydrophobicContact CB-CB 4.49Å; R209-L257 HydrophobicContact CB-CD1 4.14Å; R209-L257 HydrophobicContact CG-CD1 4.45Å; R209-E260 IonicContact CZ-OE1 3.54Å; R209-E260 IonicContact NE-OE1 2.72Å; R209-E260 PolarHBondContact NE-OE1 3.48Å; R209-E260 IonicContact NE-OE2 3.44Å; R209-E260 PolarHBondContact NE-OE2 3.16Å; R209-E260 IonicContact NH2-OE1 3.62Å; R209-E260 PolarHBondContact NH2-OE1 3.19Å; R209-E260 VanDerWaalsContact NH2-OE1 3.17Å; R209-E319 WeakPolarHBondContact CA-OE1 3.39Å; R209-E319 VanDerWaalsContact CB-OE1 3.31Å; R209-E319 WeakPolarHBondContact CB-OE1 3.09Å; R209-E319 VanDerWaalsContact N-CD 3.3Å; R209-E319 PolarHBondContact N-OE1 2.82Å; R209-E319 PolarHBondContact N-OE2 3.43Å; R209-E319 VanDerWaalsContact N-OE2 3.13Å
210	R	93.9	Very high	91.2	Very high	73 Å²	73	37.3 Å²	37.3	28%	0.275	18%	0.181	S	C	.	.	H	α-helix	trans	-66.5	-52.8	-177.8	179.9	-177.1	175.6	-103.4	4.7	111.2	A213 I214 F314 L317 E319	R210-A213 PolarHBondContact O-N 3.15Å; R210-I214 HydrophobicContact CG-CD1 3.97Å; R210-I214 VanDerWaalsContact O-CG1 3.32Å; R210-I214 WeakPolarHBondContact O-CG1 3.22Å; R210-I214 PolarHBondContact O-N 3.03Å; R210-F314 PolarHBondContact NH2-O 2.67Å; R210-L317 WeakPolarHBondContact CD-O 3.48Å; R210-L317 HydrophobicContact CG-CB 4.46Å; R210-L317 HydrophobicContact CG-CD2 4.34Å; R210-L317 PolarHBondContact NE-O 3.36Å; R210-L317 VanDerWaalsContact NE-O 3.16Å; R210-E319 HydrophobicContact CB-CB 4.32Å; R210-E319 VanDerWaalsContact CB-OE2 3.3Å; R210-E319 WeakPolarHBondContact CB-OE2 3.43Å; R210-E319 PolarHBondContact N-OE1 3.5Å; R210-E319 PolarHBondContact N-OE2 3.23Å
211	N	92.6	Very high	91.4	Very high	74 Å²	74	38.4 Å²	38.4	40%	0.396	19%	0.187	S	C	.	.	H	α-helix	trans	-67	-40.4	-177.4	-65.6	-23.7	0	0	0	111.5	F207 A213 I214 V215	F207-N211 HydrophobicContact CB-CB 4.42Å; F207-N211 PolarHBondContact O-ND2 3.46Å; N211-A213 PolarHBondContact O-N 3.04Å; N211-I214 PolarHBondContact O-N 3.26Å; N211-V215 WeakPolarHBondContact O-CG2 3.45Å; N211-V215 PolarHBondContact O-N 3.42Å
212	G	92.8	Very high	92	Very high	3 Å²	3	43.4 Å²	43.4	3%	0.031	21%	0.208	C	C	.	.	H	α-helix	trans	-57.7	-47.8	174	0	0	0	0	0	111.9	G208 I214 V215 F216	G208-G212 PolarHBondContact O-N 3.3Å; G208-G212 VanDerWaalsContact O-N 3.09Å; G212-I214 PolarHBondContact O-N 3.33Å; G212-V215 PolarHBondContact O-N 2.89Å; G212-F216 WeakPolarHBondContact O-CD2 3.26Å; G212-F216 PolarHBondContact O-N 3.33Å
213	A	93.8	Very high	92.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.9	-42.6	177.5	0	0	0	0	0	112.8	R209 R210 N211 S217 V253 L254 Y313 L317	R209-A213 VanDerWaalsContact O-CB 3.29Å; R209-A213 WeakPolarHBondContact O-CB 3.44Å; R209-A213 PolarHBondContact O-N 2.86Å; R210-A213 PolarHBondContact O-N 3.15Å; N211-A213 PolarHBondContact O-N 3.04Å; A213-S217 VanDerWaalsContact O-CB 3.3Å; A213-S217 WeakPolarHBondContact O-CB 3.46Å; A213-S217 PolarHBondContact O-N 2.7Å; A213-S217 PolarHBondContact O-OG 2.9Å; A213-V253 HydrophobicContact CB-CG1 4.31Å; A213-L254 HydrophobicContact CB-CD1 4.42Å; A213-L254 HydrophobicContact CB-CD2 3.45Å; A213-L254 VanDerWaalsContact CB-CD2 3.45Å; A213-L254 HydrophobicContact CB-CG 3.78Å; A213-Y313 HydrophobicContact CB-CD2 4.35Å; A213-Y313 HydrophobicContact CB-CE2 4.22Å; A213-L317 HydrophobicContact CB-CD2 3.87Å
214	I	94.5	Very high	92.9	Very high	14 Å²	14	36.7 Å²	36.7	7%	0.072	18%	0.181	C	C	.	.	H	α-helix	trans	-60.4	-53.3	177.7	-70.4	168	0	0	0	110.5	R210 N211 G212 F216 S217 F218 Y313 F314	R210-I214 HydrophobicContact CG-CD1 3.97Å; R210-I214 VanDerWaalsContact O-CG1 3.32Å; R210-I214 WeakPolarHBondContact O-CG1 3.22Å; R210-I214 PolarHBondContact O-N 3.03Å; N211-I214 PolarHBondContact O-N 3.26Å; G212-I214 PolarHBondContact O-N 3.33Å; I214-F216 PolarHBondContact O-N 3.46Å; I214-S217 PolarHBondContact O-N 2.89Å; I214-S217 VanDerWaalsContact O-N 3.15Å; I214-F218 HydrophobicContact CG2-CD2 3.79Å; I214-F218 HydrophobicContact CG2-CE2 3.78Å; I214-F218 WeakPolarHBondContact O-CD2 3.43Å; I214-F218 PolarHBondContact O-N 3.5Å; I214-Y313 HydrophobicContact CG1-CD2 4.26Å; I214-F314 HydrophobicContact CD1-CD1 4Å; I214-F314 HydrophobicContact CD1-CE1 4.09Å; I214-F314 HydrophobicContact CG2-CE1 3.89Å; I214-F314 HydrophobicContact CG2-CE2 4.26Å; I214-F314 HydrophobicContact CG2-CZ 3.62Å
215	V	94.8	Very high	93.4	Very high	81 Å²	81	40.3 Å²	40.3	49%	0.491	20%	0.203	S	C	.	.	H	α-helix	trans	-59	-49.2	-177.9	171.6	0	0	0	0	111.3	N211 G212 S217 F218 I219	N211-V215 WeakPolarHBondContact O-CG2 3.45Å; N211-V215 PolarHBondContact O-N 3.42Å; G212-V215 PolarHBondContact O-N 2.89Å; V215-S217 VanDerWaalsContact C-N 3.29Å; V215-S217 PolarHBondContact O-N 3.4Å; V215-F218 PolarHBondContact O-N 3.28Å; V215-I219 HydrophobicContact CG1-CD1 3.9Å; V215-I219 WeakPolarHBondContact O-CG1 3.14Å; V215-I219 PolarHBondContact O-N 2.77Å; V215-I219 VanDerWaalsContact O-N 3.15Å
216	F	95.8	Very high	94	Very high	6 Å²	6	38.4 Å²	38.4	3%	0.026	20%	0.197	C	C	.	.	H	α-helix	trans	-61.6	-38.4	177.9	-76.8	-58.9	0	0	0	112.3	F203 G212 I214 F218 I219 E220 F245 S246 K250 V253	F203-F216 HydrophobicContact CB-CE2 3.8Å; F203-F216 HydrophobicContact CB-CZ 4.06Å; F203-F216 HydrophobicContact CD2-CE2 4.32Å; F203-F216 AromaticContact CD2-CZ 3.68Å; F203-F216 HydrophobicContact CD2-CZ 3.68Å; F203-F216 HydrophobicContact CE2-CZ 4.4Å; F203-F216 HydrophobicContact CG-CE2 4.2Å; F203-F216 AromaticContact CG-CZ 3.98Å; F203-F216 HydrophobicContact CG-CZ 3.98Å; G212-F216 WeakPolarHBondContact O-CD2 3.26Å; G212-F216 PolarHBondContact O-N 3.33Å; I214-F216 PolarHBondContact O-N 3.46Å; F216-F218 PolarHBondContact O-N 2.89Å; F216-I219 PolarHBondContact O-N 2.83Å; F216-E220 WeakPolarHBondContact O-CB 3.36Å; F216-E220 PolarHBondContact O-N 2.66Å; F216-F245 HydrophobicContact CD1-CE1 4.35Å; F216-F245 HydrophobicContact CE1-CD1 4.4Å; F216-F245 AromaticContact CE1-CE1 3.7Å; F216-F245 HydrophobicContact CE1-CE1 3.7Å; F216-F245 AromaticContact CE1-CZ 3.78Å; F216-F245 HydrophobicContact CE1-CZ 3.78Å; F216-F245 HydrophobicContact CZ-CZ 4.47Å; F216-S246 WeakPolarHBondContact O-CB 3.05Å; F216-K250 HydrophobicContact CB-CB 3.84Å; F216-V253 HydrophobicContact CD2-CG2 4.46Å; F216-V253 HydrophobicContact CE2-CG2 4.33Å
217	S	94.7	Very high	94.6	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.007	18%	0.181	C	C	.	.	H	α-helix	trans	-68	-35.6	-179.8	-55.6	0	0	0	0	113.3	A213 I214 V215 E220 L221 K250 C310 Y313	A213-S217 VanDerWaalsContact O-CB 3.3Å; A213-S217 WeakPolarHBondContact O-CB 3.46Å; A213-S217 PolarHBondContact O-N 2.7Å; A213-S217 PolarHBondContact O-OG 2.9Å; I214-S217 PolarHBondContact O-N 2.89Å; I214-S217 VanDerWaalsContact O-N 3.15Å; V215-S217 VanDerWaalsContact C-N 3.29Å; V215-S217 PolarHBondContact O-N 3.4Å; S217-E220 PolarHBondContact O-N 2.7Å; S217-L221 WeakPolarHBondContact O-CB 3.35Å; S217-L221 PolarHBondContact O-N 2.86Å; S217-K250 WeakPolarHBondContact OG-CD 2.99Å; S217-C310 VanDerWaalsContact CB-CB 3.41Å; S217-Y313 WeakPolarHBondContact OG-CE2 3.45Å
218	F	95.1	Very high	94.9	Very high	60 Å²	60	31 Å²	31	26%	0.263	17%	0.166	S	C	.	.	H	α-helix	trans	-67.1	-43.4	174	-88.7	-76.7	0	0	0	112	I214 V215 F216 E220 L221 L222 F311 F314	I214-F218 HydrophobicContact CG2-CD2 3.79Å; I214-F218 HydrophobicContact CG2-CE2 3.78Å; I214-F218 WeakPolarHBondContact O-CD2 3.43Å; I214-F218 PolarHBondContact O-N 3.5Å; V215-F218 PolarHBondContact O-N 3.28Å; F216-F218 PolarHBondContact O-N 2.89Å; F218-E220 VanDerWaalsContact C-N 3.29Å; F218-E220 PolarHBondContact O-N 3.32Å; F218-L221 PolarHBondContact O-N 3.5Å; F218-L222 WeakPolarHBondContact O-CG 3.39Å; F218-L222 PolarHBondContact O-N 3.24Å; F218-F311 HydrophobicContact CE1-CD1 4.3Å; F218-F311 AromaticContact CE1-CE1 3.53Å; F218-F311 HydrophobicContact CE1-CE1 3.53Å; F218-F311 AromaticContact CE1-CZ 3.95Å; F218-F311 HydrophobicContact CE1-CZ 3.95Å; F218-F311 AromaticContact CZ-CD1 3.88Å; F218-F311 HydrophobicContact CZ-CD1 3.88Å; F218-F311 AromaticContact CZ-CE1 3.55Å; F218-F311 HydrophobicContact CZ-CE1 3.55Å; F218-F311 HydrophobicContact CZ-CZ 4.35Å; F218-F314 AromaticContact CE2-CE2 3.39Å; F218-F314 HydrophobicContact CE2-CE2 3.39Å; F218-F314 AromaticContact CE2-CZ 3.48Å; F218-F314 HydrophobicContact CE2-CZ 3.48Å; F218-F314 VanDerWaalsContact CE2-CZ 3.48Å; F218-F314 AromaticContact CZ-CE2 3.6Å; F218-F314 HydrophobicContact CZ-CE2 3.6Å; F218-F314 AromaticContact CZ-CZ 3.95Å; F218-F314 HydrophobicContact CZ-CZ 3.95Å
219	I	96.4	Very high	95.3	Very high	60 Å²	60	37.1 Å²	37.1	31%	0.308	20%	0.199	S	C	.	.	H	α-helix	trans	-60.5	-43.4	175.8	-64.5	168.2	0	0	0	110	V215 F216 A223 I242	V215-I219 HydrophobicContact CG1-CD1 3.9Å; V215-I219 WeakPolarHBondContact O-CG1 3.14Å; V215-I219 PolarHBondContact O-N 2.77Å; V215-I219 VanDerWaalsContact O-N 3.15Å; F216-I219 PolarHBondContact O-N 2.83Å; I219-A223 WeakPolarHBondContact O-CB 3.38Å; I219-A223 PolarHBondContact O-N 3.21Å; I219-I242 HydrophobicContact CG2-CG2 3.5Å; I219-I242 VanDerWaalsContact CG2-CG2 3.5Å
220	E	96.5	Very high	95.5	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-64.1	-43.3	177.9	-173.1	179.6	176.9	0	0	112.6	F216 S217 F218 G224 S246 S247 K250 C307	F216-E220 WeakPolarHBondContact O-CB 3.36Å; F216-E220 PolarHBondContact O-N 2.66Å; S217-E220 PolarHBondContact O-N 2.7Å; F218-E220 VanDerWaalsContact C-N 3.29Å; F218-E220 PolarHBondContact O-N 3.32Å; E220-G224 PolarHBondContact O-N 3.02Å; E220-S246 WeakPolarHBondContact CA-OG 3.21Å; E220-S246 WeakPolarHBondContact CB-OG 2.97Å; E220-S246 PolarHBondContact N-OG 3.48Å; E220-S247 WeakPolarHBondContact OE1-CB 3.5Å; E220-K250 IonicContact OE1-NZ 2.84Å; E220-K250 PolarHBondContact OE1-NZ 3.13Å; E220-K250 VanDerWaalsContact OE2-CD 3.31Å; E220-K250 WeakPolarHBondContact OE2-CD 3.31Å; E220-K250 WeakPolarHBondContact OE2-CE 3.38Å; E220-K250 IonicContact OE2-NZ 3.51Å; E220-K250 PolarHBondContact OE2-NZ 3.17Å; E220-C307 PolarHBondContact OE1-SG 3.11Å
221	L	95	Very high	95.6	Very high	23 Å²	23	37.3 Å²	37.3	12%	0.12	21%	0.211	C	C	.	.	H	α-helix	trans	-62	-49.4	177.8	178.8	65	0	0	0	111.3	S217 F218 G224 V225 C307 L308 F311	S217-L221 WeakPolarHBondContact O-CB 3.35Å; S217-L221 PolarHBondContact O-N 2.86Å; F218-L221 PolarHBondContact O-N 3.5Å; L221-G224 PolarHBondContact O-N 3.32Å; L221-V225 WeakPolarHBondContact O-CG2 3.26Å; L221-V225 PolarHBondContact O-N 3.19Å; L221-C307 HydrophobicContact CD1-CB 4.21Å; L221-L308 HydrophobicContact CD1-CD2 3.65Å; L221-L308 HydrophobicContact CD1-CG 4.22Å; L221-L308 HydrophobicContact CD2-CD2 3.99Å; L221-L308 HydrophobicContact CG-CD2 4.47Å; L221-F311 HydrophobicContact CD2-CE2 4Å; L221-F311 HydrophobicContact CD2-CZ 4.18Å
222	L	96.3	Very high	95.7	Very high	125 Å²	125	36.6 Å²	36.6	65%	0.654	21%	0.207	S	C	*	.	H	α-helix	trans	-63.8	-44.4	179.4	-68.7	174.6	0	0	0	111.6	F218 G224 V225 G226	F218-L222 WeakPolarHBondContact O-CG 3.39Å; F218-L222 PolarHBondContact O-N 3.24Å; L222-G224 VanDerWaalsContact C-N 3.35Å; L222-V225 PolarHBondContact O-N 3.19Å; L222-G226 PolarHBondContact O-N 3.49Å
223	A	97.3	Very high	95.7	Very high	3 Å²	3	38.1 Å²	38.1	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-38	177.3	0	0	0	0	0	111.8	I219 G226 V227 I242 V243	I219-A223 WeakPolarHBondContact O-CB 3.38Å; I219-A223 PolarHBondContact O-N 3.21Å; A223-G226 CarbonylContact O-C 3.59Å; A223-G226 WeakPolarHBondContact O-CA 3.47Å; A223-G226 PolarHBondContact O-N 3.28Å; A223-G226 VanDerWaalsContact O-N 3.14Å; A223-V227 WeakPolarHBondContact O-CG2 3.13Å; A223-V227 PolarHBondContact O-N 3Å; A223-I242 HydrophobicContact CB-CB 3.89Å; A223-I242 HydrophobicContact CB-CG2 3.56Å; A223-V243 HydrophobicContact CB-CG2 3.6Å
224	G	96	Very high	95.8	Very high	1 Å²	1	44 Å²	44	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-43.5	175.8	0	0	0	0	0	112.7	E220 L221 L222 G226 V227 S228 N300	E220-G224 PolarHBondContact O-N 3.02Å; L221-G224 PolarHBondContact O-N 3.32Å; L222-G224 VanDerWaalsContact C-N 3.35Å; G224-G226 VanDerWaalsContact C-N 3.34Å; G224-V227 WeakPolarHBondContact O-CB 3.43Å; G224-V227 PolarHBondContact O-N 3.16Å; G224-S228 PolarHBondContact O-N 3.13Å; G224-N300 PolarHBondContact O-ND2 2.98Å
225	V	96.2	Very high	96	Very high	76 Å²	76	46.3 Å²	46.3	46%	0.461	25%	0.253	S	S	.	.	H	α-helix	trans	-62.9	-42.5	171.1	173.5	0	0	0	0	110.7	L221 L222 V227 S228 L229	L221-V225 WeakPolarHBondContact O-CG2 3.26Å; L221-V225 PolarHBondContact O-N 3.19Å; L222-V225 PolarHBondContact O-N 3.19Å; V225-V227 VanDerWaalsContact C-N 3.26Å; V225-V227 PolarHBondContact O-N 2.64Å; V225-S228 PolarHBondContact O-N 3.25Å; V225-S228 VanDerWaalsContact O-N 3.15Å; V225-L229 HydrophobicContact CG1-CD1 3.76Å; V225-L229 HydrophobicContact CG1-CG 4.32Å; V225-L229 PolarHBondContact O-N 2.96Å
226	G	97.1	Very high	96	Very high	18 Å²	18	42.5 Å²	42.5	19%	0.186	23%	0.23	C	C	.	.	H	α-helix	trans	-58.4	-33.9	175.1	0	0	0	0	0	113.8	L222 A223 G224 A230	L222-G226 PolarHBondContact O-N 3.49Å; A223-G226 CarbonylContact O-C 3.59Å; A223-G226 WeakPolarHBondContact O-CA 3.47Å; A223-G226 PolarHBondContact O-N 3.28Å; A223-G226 VanDerWaalsContact O-N 3.14Å; G224-G226 VanDerWaalsContact C-N 3.34Å; G226-A230 PolarHBondContact O-N 3.43Å; G226-A230 VanDerWaalsContact O-N 3.1Å
227	V	97.1	Very high	96.1	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-65.7	-46.6	173.6	173	0	0	0	0	111.1	A223 G224 V225 L229 A230 Y236 M239 R240 V243 W296	A223-V227 WeakPolarHBondContact O-CG2 3.13Å; A223-V227 PolarHBondContact O-N 3Å; G224-V227 WeakPolarHBondContact O-CB 3.43Å; G224-V227 PolarHBondContact O-N 3.16Å; V225-V227 VanDerWaalsContact C-N 3.26Å; V225-V227 PolarHBondContact O-N 2.64Å; V227-L229 VanDerWaalsContact C-N 3.32Å; V227-L229 PolarHBondContact O-N 2.77Å; V227-A230 WeakPolarHBondContact O-CB 3.18Å; V227-A230 PolarHBondContact O-N 3.44Å; V227-Y236 HydrophobicContact CG1-CD2 3.85Å; V227-Y236 HydrophobicContact CG1-CE2 3.74Å; V227-M239 HydrophobicContact CG2-CB 3.65Å; V227-R240 HydrophobicContact CG1-CG 4.13Å; V227-R240 HydrophobicContact CG2-CB 4.46Å; V227-R240 HydrophobicContact CG2-CG 3.68Å; V227-V243 HydrophobicContact CG2-CG2 4.12Å; V227-W296 HydrophobicContact CG1-CZ3 4.49Å
228	S	96	Very high	96.2	Very high	14 Å²	14	47.2 Å²	47.2	10%	0.098	25%	0.254	C	S	.	.	H	α-helix	trans	-66.4	-32	179.5	-75.3	0	0	0	0	113.2	G224 V225 R297 N300 A301	G224-S228 PolarHBondContact O-N 3.13Å; V225-S228 PolarHBondContact O-N 3.25Å; V225-S228 VanDerWaalsContact O-N 3.15Å; S228-R297 PolarHBondContact O-NH1 2.87Å; S228-R297 PolarHBondContact OG-O 3.41Å; S228-N300 PolarHBondContact N-ND2 2.69Å; S228-N300 PolarHBondContact OG-ND2 2.94Å; S228-A301 PolarHBondContact OG-N 3.24Å
229	L	96.7	Very high	96.3	Very high	130 Å²	130	46.7 Å²	46.7	68%	0.681	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	5.9	-179.9	-61.4	179	0	0	0	113.6	V225 V227 P231	V225-L229 HydrophobicContact CG1-CD1 3.76Å; V225-L229 HydrophobicContact CG1-CG 4.32Å; V225-L229 PolarHBondContact O-N 2.96Å; V227-L229 VanDerWaalsContact C-N 3.32Å; V227-L229 PolarHBondContact O-N 2.77Å; L229-P231 WeakPolarHBondContact O-CD 3.37Å
230	A	96.8	Very high	96.3	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.239	C	C	.	.			trans	-63	121.4	-174.9	0	0	0	0	0	111.3	G226 V227 I235 R297	G226-A230 PolarHBondContact O-N 3.43Å; G226-A230 VanDerWaalsContact O-N 3.1Å; V227-A230 WeakPolarHBondContact O-CB 3.18Å; V227-A230 PolarHBondContact O-N 3.44Å; A230-I235 HydrophobicContact CB-CB 4.48Å; A230-I235 HydrophobicContact CB-CG2 4.09Å; A230-R297 VanDerWaalsContact O-CZ 3.29Å; A230-R297 PolarHBondContact O-NH1 3.37Å; A230-R297 PolarHBondContact O-NH2 3.1Å
231	P	96	Very high	96.4	Very high	92 Å²	92	45.5 Å²	45.5	60%	0.597	25%	0.248	S	C	*	.	S	Bend	trans	-83.8	-19.1	-178.6	32.9	-35.8	0	0	0	112.9	F172 L229 I235	F172-P231 WeakPolarHBondContact CE1-O 3.42Å; L229-P231 WeakPolarHBondContact O-CD 3.37Å; P231-I235 HydrophobicContact CG-CD1 3.66Å
232	N	94.9	Very high	96.5	Very high	59 Å²	59	47 Å²	47	32%	0.316	26%	0.256	S	S	.	.	S	Bend	trans	-143.3	166.1	179.8	63.4	42.2	0	0	0	111.2	H234 I235 Y236	N232-H234 VanDerWaalsContact C-N 3.28Å; N232-H234 PolarHBondContact O-N 3.39Å; N232-H234 PolarHBondContact OD1-N 2.9Å; N232-I235 PolarHBondContact O-N 2.6Å; N232-I235 WeakPolarHBondContact OD1-CG1 3.21Å; N232-I235 PolarHBondContact OD1-N 3.4Å; N232-Y236 WeakPolarHBondContact O-CB 3.41Å; N232-Y236 PolarHBondContact O-N 3.27Å
233	H	93.9	Very high	96.6	Very high	36 Å²	36	41.3 Å²	41.3	17%	0.167	23%	0.226	C	C	.	.	H	α-helix	trans	-64.5	-29.6	-178.3	70	-93.3	0	0	0	113	F172 L174 L181 Y236 H237	F172-H233 HydrophobicContact CB-CB 4.01Å; F172-H233 HydrophobicContact CD2-CB 3.73Å; F172-H233 HydrophobicContact CE2-CB 4.44Å; F172-H233 HydrophobicContact CG-CB 3.97Å; L174-H233 HydrophobicContact CD1-CB 4.3Å; L174-H233 HydrophobicContact CD2-CB 4.17Å; L181-H233 WeakPolarHBondContact CD2-CD2 3.41Å; L181-H233 WeakPolarHBondContact CD2-NE2 3.25Å; H233-Y236 PolarHBondContact O-N 3.07Å; H233-H237 WeakPolarHBondContact O-CB 3.3Å; H233-H237 PolarHBondContact O-N 2.58Å; H233-H237 PolarHBondContact O-ND1 3.32Å
234	H	95.7	Very high	96.6	Very high	124 Å²	124	41.1 Å²	41.1	57%	0.574	23%	0.225	S	C	*	.	H	α-helix	trans	-64.6	-49.4	178.7	-61.9	-65.3	0	0	0	111.7	N232 Y236 H237 L238	N232-H234 VanDerWaalsContact C-N 3.28Å; N232-H234 PolarHBondContact O-N 3.39Å; N232-H234 PolarHBondContact OD1-N 2.9Å; H234-Y236 VanDerWaalsContact C-N 3.34Å; H234-H237 PolarHBondContact O-N 2.56Å; H234-L238 WeakPolarHBondContact O-CB 3.42Å; H234-L238 PolarHBondContact O-N 3.04Å
235	I	97	Very high	96.6	Very high	62 Å²	62	43.6 Å²	43.6	32%	0.318	24%	0.235	S	C	.	.	H	α-helix	trans	-65.3	-41.6	176.9	-67.7	168.2	0	0	0	109.7	A230 P231 N232 H237 L238 M239	A230-I235 HydrophobicContact CB-CB 4.48Å; A230-I235 HydrophobicContact CB-CG2 4.09Å; P231-I235 HydrophobicContact CG-CD1 3.66Å; N232-I235 PolarHBondContact O-N 2.6Å; N232-I235 WeakPolarHBondContact OD1-CG1 3.21Å; N232-I235 PolarHBondContact OD1-N 3.4Å; I235-H237 PolarHBondContact O-N 3.06Å; I235-L238 PolarHBondContact O-N 3.34Å; I235-M239 HydrophobicContact CG2-CG 4.04Å; I235-M239 WeakPolarHBondContact O-CB 2.92Å; I235-M239 VanDerWaalsContact O-CG 3.24Å; I235-M239 WeakPolarHBondContact O-CG 3.37Å; I235-M239 PolarHBondContact O-N 3.35Å
236	Y	96.6	Very high	96.6	Very high	1 Å²	1	40 Å²	40	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-56.3	-51.3	175.4	169	-101.1	0	0	0	111.9	V168 F172 V227 N232 H233 H234 L238 M239 R240 W296	V168-Y236 HydrophobicContact CG1-CD1 3.93Å; V168-Y236 HydrophobicContact CG1-CE1 3.63Å; V168-Y236 HydrophobicContact CG1-CE2 4.37Å; V168-Y236 HydrophobicContact CG1-CG 4.44Å; V168-Y236 HydrophobicContact CG2-CE1 4.42Å; V168-Y236 HydrophobicContact CG2-CE2 3.88Å; F172-Y236 HydrophobicContact CE2-CG 4.16Å; V227-Y236 HydrophobicContact CG1-CD2 3.85Å; V227-Y236 HydrophobicContact CG1-CE2 3.74Å; N232-Y236 WeakPolarHBondContact O-CB 3.41Å; N232-Y236 PolarHBondContact O-N 3.27Å; H233-Y236 PolarHBondContact O-N 3.07Å; H234-Y236 VanDerWaalsContact C-N 3.34Å; Y236-L238 PolarHBondContact O-N 2.9Å; Y236-M239 PolarHBondContact O-N 2.79Å; Y236-R240 HydrophobicContact CD2-CG 4.36Å; Y236-R240 HydrophobicContact CE2-CG 4.01Å; Y236-R240 WeakPolarHBondContact O-CB 3.09Å; Y236-R240 WeakPolarHBondContact O-CG 3.4Å; Y236-R240 PolarHBondContact O-N 2.97Å; Y236-R240 VanDerWaalsContact OH-CD 3.26Å; Y236-R240 WeakPolarHBondContact OH-CD 3.45Å; Y236-R240 PolarHBondContact OH-NH1 3.01Å; Y236-W296 HydrophobicContact CD2-CH2 4.15Å; Y236-W296 HydrophobicContact CD2-CZ3 4.03Å; Y236-W296 HydrophobicContact CE2-CH2 4.46Å; Y236-W296 AromaticContact CE2-CZ3 3.96Å; Y236-W296 HydrophobicContact CE2-CZ3 3.96Å
237	H	96.6	Very high	96.5	Very high	8 Å²	8	40 Å²	40	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-65.2	-40	179.3	-65.1	144.7	0	0	0	112.8	L181 G185 L188 H233 H234 I235 R240 T241	L181-H237 PolarHBondContact O-CE1 3.49Å; L181-H237 VanDerWaalsContact O-CE1 3.29Å; G185-H237 WeakPolarHBondContact CA-CD2 3.21Å; G185-H237 WeakPolarHBondContact CA-NE2 3.23Å; L188-H237 HydrophobicContact CD1-CB 4.22Å; H233-H237 WeakPolarHBondContact O-CB 3.3Å; H233-H237 PolarHBondContact O-N 2.58Å; H233-H237 PolarHBondContact O-ND1 3.32Å; H234-H237 PolarHBondContact O-N 2.56Å; I235-H237 PolarHBondContact O-N 3.06Å; H237-R240 PolarHBondContact O-N 3.48Å; H237-T241 PolarHBondContact O-N 3.46Å; H237-T241 PolarHBondContact O-OG1 3.41Å
238	L	97.6	Very high	96.3	Very high	98 Å²	98	40.2 Å²	40.2	51%	0.513	21%	0.212	S	C	.	.	H	α-helix	trans	-61.6	-51.8	175.8	177.8	62.4	0	0	0	111.2	H234 I235 Y236 R240 T241 I242	H234-L238 WeakPolarHBondContact O-CB 3.42Å; H234-L238 PolarHBondContact O-N 3.04Å; I235-L238 PolarHBondContact O-N 3.34Å; Y236-L238 PolarHBondContact O-N 2.9Å; L238-R240 VanDerWaalsContact C-N 3.32Å; L238-R240 PolarHBondContact O-N 3.37Å; L238-T241 WeakPolarHBondContact O-CB 3.28Å; L238-T241 PolarHBondContact O-N 3.02Å; L238-T241 VanDerWaalsContact O-N 3.12Å; L238-I242 HydrophobicContact CD1-CD1 4.47Å; L238-I242 HydrophobicContact CG-CD1 4.35Å; L238-I242 WeakPolarHBondContact O-CG1 3.31Å; L238-I242 PolarHBondContact O-N 2.9Å; L238-I242 VanDerWaalsContact O-N 3.1Å
239	M	97.6	Very high	96.3	Very high	48 Å²	48	39.5 Å²	39.5	24%	0.236	21%	0.207	C	C	.	.	H	α-helix	trans	-62.6	-40.5	180	-67.4	-61.4	143.2	0	0	111.2	V227 I235 Y236 T241 I242 V243	V227-M239 HydrophobicContact CG2-CB 3.65Å; I235-M239 HydrophobicContact CG2-CG 4.04Å; I235-M239 WeakPolarHBondContact O-CB 2.92Å; I235-M239 VanDerWaalsContact O-CG 3.24Å; I235-M239 WeakPolarHBondContact O-CG 3.37Å; I235-M239 PolarHBondContact O-N 3.35Å; Y236-M239 PolarHBondContact O-N 2.79Å; M239-T241 VanDerWaalsContact C-N 3.33Å; M239-T241 PolarHBondContact O-N 2.94Å; M239-I242 HydrophobicContact CE-CD1 4.41Å; M239-I242 PolarHBondContact O-N 3.45Å; M239-I242 HydrophobicContact SD-CD1 4.27Å; M239-V243 WeakPolarHBondContact O-CG2 2.93Å; M239-V243 PolarHBondContact O-N 3.28Å
240	R	96.3	Very high	96.1	Very high	5 Å²	5	33.5 Å²	33.5	2%	0.019	18%	0.176	C	C	.	.	H	α-helix	trans	-60.7	-40	173.1	-79.8	-156.5	65.6	149.3	7.7	113.1	M62 F189 V227 Y236 H237 L238 I242 V243 G244	M62-R240 PolarHBondContact O-NH2 3.19Å; F189-R240 HydrophobicContact CD2-CB 4.3Å; F189-R240 WeakPolarHBondContact CD2-O 3.35Å; V227-R240 HydrophobicContact CG1-CG 4.13Å; V227-R240 HydrophobicContact CG2-CB 4.46Å; V227-R240 HydrophobicContact CG2-CG 3.68Å; Y236-R240 HydrophobicContact CD2-CG 4.36Å; Y236-R240 HydrophobicContact CE2-CG 4.01Å; Y236-R240 WeakPolarHBondContact O-CB 3.09Å; Y236-R240 WeakPolarHBondContact O-CG 3.4Å; Y236-R240 PolarHBondContact O-N 2.97Å; Y236-R240 VanDerWaalsContact OH-CD 3.26Å; Y236-R240 WeakPolarHBondContact OH-CD 3.45Å; Y236-R240 PolarHBondContact OH-NH1 3.01Å; H237-R240 PolarHBondContact O-N 3.48Å; L238-R240 VanDerWaalsContact C-N 3.32Å; L238-R240 PolarHBondContact O-N 3.37Å; R240-I242 VanDerWaalsContact C-N 3.29Å; R240-I242 PolarHBondContact O-N 2.92Å; R240-V243 PolarHBondContact O-N 3.49Å; R240-G244 PolarHBondContact O-N 3.36Å
241	T	97.8	Very high	95.9	Very high	31 Å²	31	34.1 Å²	34.1	19%	0.19	18%	0.181	C	C	.	.	H	α-helix	trans	-60.5	-43	176.1	-56.1	0	0	0	0	111	L188 H237 L238 M239 G244 F245	L188-T241 WeakPolarHBondContact CB-OG1 3.5Å; L188-T241 WeakPolarHBondContact O-CG2 3.41Å; H237-T241 PolarHBondContact O-N 3.46Å; H237-T241 PolarHBondContact O-OG1 3.41Å; L238-T241 WeakPolarHBondContact O-CB 3.28Å; L238-T241 PolarHBondContact O-N 3.02Å; L238-T241 VanDerWaalsContact O-N 3.12Å; M239-T241 VanDerWaalsContact C-N 3.33Å; M239-T241 PolarHBondContact O-N 2.94Å; T241-G244 PolarHBondContact O-N 2.85Å; T241-F245 PolarHBondContact O-N 2.94Å
242	I	98	Very high	95.7	Very high	56 Å²	56	31 Å²	31	29%	0.287	16%	0.16	S	C	.	.	H	α-helix	trans	-65.4	-40.8	176.5	-61.3	168.3	0	0	0	110.9	I219 A223 L238 M239 R240 F245 S246	I219-I242 HydrophobicContact CG2-CG2 3.5Å; I219-I242 VanDerWaalsContact CG2-CG2 3.5Å; A223-I242 HydrophobicContact CB-CB 3.89Å; A223-I242 HydrophobicContact CB-CG2 3.56Å; L238-I242 HydrophobicContact CD1-CD1 4.47Å; L238-I242 HydrophobicContact CG-CD1 4.35Å; L238-I242 WeakPolarHBondContact O-CG1 3.31Å; L238-I242 PolarHBondContact O-N 2.9Å; L238-I242 VanDerWaalsContact O-N 3.1Å; M239-I242 HydrophobicContact CE-CD1 4.41Å; M239-I242 PolarHBondContact O-N 3.45Å; M239-I242 HydrophobicContact SD-CD1 4.27Å; R240-I242 VanDerWaalsContact C-N 3.29Å; R240-I242 PolarHBondContact O-N 2.92Å; I242-F245 PolarHBondContact O-N 2.92Å; I242-S246 WeakPolarHBondContact O-CB 3.31Å; I242-S246 PolarHBondContact O-N 3.36Å; I242-S246 PolarHBondContact O-OG 2.93Å
243	V	97.1	Very high	95.6	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.024	15%	0.145	C	C	.	.	H	α-helix	trans	-58.3	-48.1	172.3	174.8	0	0	0	0	110.3	M62 F189 A223 V227 M239 R240 F245 S246 S247	M62-V243 HydrophobicContact CB-CG1 4.16Å; M62-V243 HydrophobicContact CG-CG1 4.2Å; F189-V243 HydrophobicContact CE2-CB 4.36Å; F189-V243 HydrophobicContact CE2-CG1 4.05Å; A223-V243 HydrophobicContact CB-CG2 3.6Å; V227-V243 HydrophobicContact CG2-CG2 4.12Å; M239-V243 WeakPolarHBondContact O-CG2 2.93Å; M239-V243 PolarHBondContact O-N 3.28Å; R240-V243 PolarHBondContact O-N 3.49Å; V243-F245 VanDerWaalsContact C-N 3.33Å; V243-F245 PolarHBondContact O-N 3.44Å; V243-S246 WeakPolarHBondContact CA-OG 3.38Å; V243-S246 PolarHBondContact O-N 3.34Å; V243-S246 PolarHBondContact O-OG 3.3Å; V243-S247 WeakPolarHBondContact O-CB 3.3Å; V243-S247 PolarHBondContact O-N 3.09Å; V243-S247 PolarHBondContact O-OG 3.07Å
244	G	96.7	Very high	95.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.9	-40.5	179.8	0	0	0	0	0	113.4	M193 R240 T241 T248	M193-G244 WeakPolarHBondContact CA-O 3.31Å; R240-G244 PolarHBondContact O-N 3.36Å; T241-G244 PolarHBondContact O-N 2.85Å; G244-T248 VanDerWaalsContact O-CB 3.25Å; G244-T248 WeakPolarHBondContact O-CB 3.5Å; G244-T248 PolarHBondContact O-N 3.18Å; G244-T248 PolarHBondContact O-OG1 3.17Å
245	F	96.9	Very high	95.2	Very high	52 Å²	52	25.6 Å²	25.6	23%	0.228	13%	0.129	C	C	.	.	H	α-helix	trans	-64.2	-53.3	174.6	171.7	-105.7	0	0	0	112.3	G192 F195 G196 F199 F216 T241 I242 V243 G249	G192-F245 WeakPolarHBondContact O-CA 3.27Å; F195-F245 HydrophobicContact CB-CD2 3.77Å; F195-F245 HydrophobicContact CB-CE2 4.11Å; G196-F245 WeakPolarHBondContact CA-O 3.42Å; F199-F245 HydrophobicContact CB-CE2 4.28Å; F199-F245 HydrophobicContact CD2-CE2 4.25Å; F216-F245 HydrophobicContact CD1-CE1 4.35Å; F216-F245 HydrophobicContact CE1-CD1 4.4Å; F216-F245 AromaticContact CE1-CE1 3.7Å; F216-F245 HydrophobicContact CE1-CE1 3.7Å; F216-F245 AromaticContact CE1-CZ 3.78Å; F216-F245 HydrophobicContact CE1-CZ 3.78Å; F216-F245 HydrophobicContact CZ-CZ 4.47Å; T241-F245 PolarHBondContact O-N 2.94Å; I242-F245 PolarHBondContact O-N 2.92Å; V243-F245 VanDerWaalsContact C-N 3.33Å; V243-F245 PolarHBondContact O-N 3.44Å; F245-G249 PolarHBondContact O-N 3.22Å
246	S	95.9	Very high	94.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-70.1	-44.3	-174.6	53.7	0	0	0	0	112.9	F216 E220 I242 V243 T248 G249 K250	F216-S246 WeakPolarHBondContact O-CB 3.05Å; E220-S246 WeakPolarHBondContact CA-OG 3.21Å; E220-S246 WeakPolarHBondContact CB-OG 2.97Å; E220-S246 PolarHBondContact N-OG 3.48Å; I242-S246 WeakPolarHBondContact O-CB 3.31Å; I242-S246 PolarHBondContact O-N 3.36Å; I242-S246 PolarHBondContact O-OG 2.93Å; V243-S246 WeakPolarHBondContact CA-OG 3.38Å; V243-S246 PolarHBondContact O-N 3.34Å; V243-S246 PolarHBondContact O-OG 3.3Å; S246-T248 VanDerWaalsContact C-N 3.28Å; S246-T248 PolarHBondContact O-N 3.3Å; S246-G249 PolarHBondContact O-N 3.34Å; S246-K250 VanDerWaalsContact O-CB 3.26Å; S246-K250 WeakPolarHBondContact O-CB 3.37Å; S246-K250 PolarHBondContact O-N 3.39Å
247	S	94.8	Very high	94.6	Very high	18 Å²	18	25.4 Å²	25.4	13%	0.126	13%	0.128	C	C	.	.	H	α-helix	trans	-61.3	-39.3	178.1	75.2	0	0	0	0	111.5	E220 V243 A251	E220-S247 WeakPolarHBondContact OE1-CB 3.5Å; V243-S247 WeakPolarHBondContact O-CB 3.3Å; V243-S247 PolarHBondContact O-N 3.09Å; V243-S247 PolarHBondContact O-OG 3.07Å; S247-A251 VanDerWaalsContact O-CB 3.31Å; S247-A251 WeakPolarHBondContact O-CB 3.25Å; S247-A251 PolarHBondContact O-N 3.3Å
248	T	94.3	Very high	94.4	Very high	6 Å²	6	25.2 Å²	25.2	4%	0.037	13%	0.128	C	C	.	.	H	α-helix	trans	-75	-43.8	179.8	-55.8	0	0	0	0	111.6	M193 F197 G244 S246 K250 A251 V252	M193-T248 HydrophobicContact CB-CG2 4.46Å; M193-T248 WeakPolarHBondContact CG-OG1 3.36Å; M193-T248 WeakPolarHBondContact O-CG2 3.24Å; F197-T248 HydrophobicContact CB-CG2 4.48Å; F197-T248 HydrophobicContact CD1-CG2 3.73Å; F197-T248 HydrophobicContact CD2-CG2 3.44Å; F197-T248 VanDerWaalsContact CD2-CG2 3.44Å; F197-T248 HydrophobicContact CE1-CG2 3.64Å; F197-T248 HydrophobicContact CE2-CG2 3.33Å; F197-T248 HydrophobicContact CG-CG2 3.63Å; F197-T248 HydrophobicContact CZ-CG2 3.45Å; F197-T248 VanDerWaalsContact CZ-CG2 3.45Å; G244-T248 VanDerWaalsContact O-CB 3.25Å; G244-T248 WeakPolarHBondContact O-CB 3.5Å; G244-T248 PolarHBondContact O-N 3.18Å; G244-T248 PolarHBondContact O-OG1 3.17Å; S246-T248 VanDerWaalsContact C-N 3.28Å; S246-T248 PolarHBondContact O-N 3.3Å; T248-K250 PolarHBondContact O-N 3.07Å; T248-A251 PolarHBondContact O-N 2.89Å; T248-V252 WeakPolarHBondContact O-CG2 3.44Å; T248-V252 PolarHBondContact O-N 3.05Å
249	G	94.3	Very high	94	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-58.1	-46.7	174	0	0	0	0	0	112	F245 S246 A251 V252 V253	F245-G249 PolarHBondContact O-N 3.22Å; S246-G249 PolarHBondContact O-N 3.34Å; G249-A251 PolarHBondContact O-N 3.33Å; G249-V252 PolarHBondContact O-N 2.88Å; G249-V253 WeakPolarHBondContact O-CG2 3.3Å; G249-V253 PolarHBondContact O-N 2.75Å; G249-V253 VanDerWaalsContact O-N 3.17Å
250	K	94.3	Very high	93.6	Very high	3 Å²	3	21.7 Å²	21.7	1%	0.013	11%	0.109	C	C	.	.	H	α-helix	trans	-54.6	-50.6	171.9	-178.6	-176.6	71.8	-172.8	0	111.3	S58 F216 S217 E220 S246 T248 V252 V253 L254	S58-K250 PolarHBondContact O-NZ 2.92Å; F216-K250 HydrophobicContact CB-CB 3.84Å; S217-K250 WeakPolarHBondContact OG-CD 2.99Å; E220-K250 IonicContact OE1-NZ 2.84Å; E220-K250 PolarHBondContact OE1-NZ 3.13Å; E220-K250 VanDerWaalsContact OE2-CD 3.31Å; E220-K250 WeakPolarHBondContact OE2-CD 3.31Å; E220-K250 WeakPolarHBondContact OE2-CE 3.38Å; E220-K250 IonicContact OE2-NZ 3.51Å; E220-K250 PolarHBondContact OE2-NZ 3.17Å; S246-K250 VanDerWaalsContact O-CB 3.26Å; S246-K250 WeakPolarHBondContact O-CB 3.37Å; S246-K250 PolarHBondContact O-N 3.39Å; T248-K250 PolarHBondContact O-N 3.07Å; K250-V252 VanDerWaalsContact C-N 3.35Å; K250-V252 PolarHBondContact O-N 2.88Å; K250-V253 PolarHBondContact O-N 3.16Å; K250-L254 HydrophobicContact CD-CD1 4.1Å; K250-L254 HydrophobicContact CG-CD1 3.55Å; K250-L254 HydrophobicContact CG-CG 4.24Å; K250-L254 WeakPolarHBondContact O-CB 3.5Å; K250-L254 WeakPolarHBondContact O-CG 3.2Å; K250-L254 PolarHBondContact O-N 2.88Å
251	A	92.4	Very high	93.4	Very high	13 Å²	13	21.5 Å²	21.5	11%	0.107	11%	0.108	C	C	.	.	H	α-helix	trans	-62.2	-39.1	-177.8	0	0	0	0	0	112.9	S247 T248 G249 R255	S247-A251 VanDerWaalsContact O-CB 3.31Å; S247-A251 WeakPolarHBondContact O-CB 3.25Å; S247-A251 PolarHBondContact O-N 3.3Å; T248-A251 PolarHBondContact O-N 2.89Å; G249-A251 PolarHBondContact O-N 3.33Å; A251-R255 VanDerWaalsContact O-CB 3.27Å; A251-R255 WeakPolarHBondContact O-CB 3.31Å; A251-R255 WeakPolarHBondContact O-CD 3.24Å; A251-R255 WeakPolarHBondContact O-CG 3.5Å; A251-R255 PolarHBondContact O-N 3.45Å
252	V	91.5	Very high	93.1	Very high	27 Å²	27	20 Å²	20	16%	0.164	10%	0.099	C	C	.	.	H	α-helix	trans	-62.2	-47.7	176.2	170.4	0	0	0	0	110.8	F197 T248 G249 K250 L256	F197-V252 HydrophobicContact CD1-CG2 3.47Å; F197-V252 VanDerWaalsContact CD1-CG2 3.47Å; F197-V252 HydrophobicContact CE1-CG2 3.8Å; T248-V252 WeakPolarHBondContact O-CG2 3.44Å; T248-V252 PolarHBondContact O-N 3.05Å; G249-V252 PolarHBondContact O-N 2.88Å; K250-V252 VanDerWaalsContact C-N 3.35Å; K250-V252 PolarHBondContact O-N 2.88Å; V252-L256 WeakPolarHBondContact O-CG 3.41Å
253	V	92.5	Very high	92.6	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-68.2	-45.9	-177.7	177.9	0	0	0	0	111.7	G200 R209 A213 F216 G249 K250 L256	G200-V253 VanDerWaalsContact O-CG2 3.25Å; G200-V253 WeakPolarHBondContact O-CG2 3.27Å; R209-V253 VanDerWaalsContact CA-CG1 3.45Å; R209-V253 HydrophobicContact CB-CG1 3.95Å; R209-V253 WeakPolarHBondContact O-CG1 3.13Å; A213-V253 HydrophobicContact CB-CG1 4.31Å; F216-V253 HydrophobicContact CD2-CG2 4.46Å; F216-V253 HydrophobicContact CE2-CG2 4.33Å; G249-V253 WeakPolarHBondContact O-CG2 3.3Å; G249-V253 PolarHBondContact O-N 2.75Å; G249-V253 VanDerWaalsContact O-N 3.17Å; K250-V253 PolarHBondContact O-N 3.16Å; V253-L256 PolarHBondContact O-N 3.4Å
254	L	92.4	Very high	91.9	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-72.1	-34.6	-176	-74.8	178.4	0	0	0	113.5	I55 A213 K250 L256 L257 P258 Y313 L317	I55-L254 HydrophobicContact CD1-CB 4.35Å; I55-L254 WeakPolarHBondContact CD1-O 3.34Å; I55-L254 HydrophobicContact CG1-CB 4.17Å; I55-L254 HydrophobicContact CG1-CD1 4.38Å; I55-L254 HydrophobicContact CG1-CD2 4.13Å; I55-L254 HydrophobicContact CG1-CG 4.48Å; I55-L254 HydrophobicContact CG2-CB 4.11Å; A213-L254 HydrophobicContact CB-CD1 4.42Å; A213-L254 HydrophobicContact CB-CD2 3.45Å; A213-L254 VanDerWaalsContact CB-CD2 3.45Å; A213-L254 HydrophobicContact CB-CG 3.78Å; K250-L254 HydrophobicContact CD-CD1 4.1Å; K250-L254 HydrophobicContact CG-CD1 3.55Å; K250-L254 HydrophobicContact CG-CG 4.24Å; K250-L254 WeakPolarHBondContact O-CB 3.5Å; K250-L254 WeakPolarHBondContact O-CG 3.2Å; K250-L254 PolarHBondContact O-N 2.88Å; L254-L256 PolarHBondContact O-N 2.68Å; L254-L257 PolarHBondContact O-N 3.12Å; L254-P258 WeakPolarHBondContact O-CD 3.36Å; L254-Y313 HydrophobicContact CD1-CE2 4.04Å; L254-Y313 WeakPolarHBondContact CD1-OH 3.35Å; L254-L317 HydrophobicContact CD2-CD1 4.05Å; L254-L317 HydrophobicContact CD2-CD2 3.8Å
255	R	89.5	Confident	91.1	Very high	104 Å²	104	27.9 Å²	27.9	39%	0.392	14%	0.143	S	C	.	.	H	α-helix	trans	-65	-28.7	178.8	-75.4	173.6	-171.3	153.5	3.6	112.6	A251 I274	A251-R255 VanDerWaalsContact O-CB 3.27Å; A251-R255 WeakPolarHBondContact O-CB 3.31Å; A251-R255 WeakPolarHBondContact O-CD 3.24Å; A251-R255 WeakPolarHBondContact O-CG 3.5Å; A251-R255 PolarHBondContact O-N 3.45Å; R255-I274 HydrophobicContact CG-CG2 4.36Å
256	L	88.5	Confident	90.6	Very high	60 Å²	60	27.1 Å²	27.1	31%	0.314	14%	0.139	S	C	.	.	H	α-helix	trans	-74.2	-31.5	177.2	-68.2	171.9	0	0	0	112.6	V252 V253 L254 I259 E260	V252-L256 WeakPolarHBondContact O-CG 3.41Å; V253-L256 PolarHBondContact O-N 3.4Å; L254-L256 PolarHBondContact O-N 2.68Å; L256-I259 WeakPolarHBondContact O-CB 3.36Å; L256-I259 PolarHBondContact O-N 2.75Å; L256-E260 WeakPolarHBondContact O-CG 3.42Å; L256-E260 PolarHBondContact O-N 3.35Å
257	L	92.2	Very high	90.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.4	-51.4	-171.7	179.4	69	0	0	0	113.1	I51 R209 L254 I259 E260 L261 L317	I51-L257 HydrophobicContact CG2-CD2 4.21Å; R209-L257 HydrophobicContact CB-CB 4.49Å; R209-L257 HydrophobicContact CB-CD1 4.14Å; R209-L257 HydrophobicContact CG-CD1 4.45Å; L254-L257 PolarHBondContact O-N 3.12Å; L257-I259 PolarHBondContact O-N 2.92Å; L257-E260 CarbonylContact O-C 3.28Å; L257-E260 WeakPolarHBondContact O-CA 3.41Å; L257-E260 WeakPolarHBondContact O-CB 3.4Å; L257-E260 PolarHBondContact O-N 3.38Å; L257-L261 HydrophobicContact CD1-CD1 4.1Å; L257-L261 HydrophobicContact CD1-CD2 4.42Å; L257-L261 HydrophobicContact CD1-CG 4.16Å; L257-L261 HydrophobicContact CD2-CD1 4.5Å; L257-L261 HydrophobicContact CG-CD1 3.89Å; L257-L261 HydrophobicContact CG-CG 4.33Å; L257-L261 VanDerWaalsContact O-CG 3.29Å; L257-L261 WeakPolarHBondContact O-CG 3.46Å; L257-L261 PolarHBondContact O-N 2.99Å; L257-L317 HydrophobicContact CD2-CD1 3.43Å; L257-L317 VanDerWaalsContact CD2-CD1 3.43Å; L257-L317 HydrophobicContact CD2-CG 3.85Å
258	P	91.4	Very high	89.6	Confident	4 Å²	4	33.5 Å²	33.5	3%	0.026	17%	0.171	C	C	.	.	H	α-helix	trans	-58.5	-34.7	177.4	-28.5	37.9	0	0	0	113.8	V52 I55 L254 E260 L261 T262 F270 I274	V52-P258 HydrophobicContact CG2-CB 3.75Å; V52-P258 HydrophobicContact CG2-CG 3.85Å; I55-P258 HydrophobicContact CD1-CG 3.38Å; L254-P258 WeakPolarHBondContact O-CD 3.36Å; P258-E260 VanDerWaalsContact C-N 3.26Å; P258-E260 PolarHBondContact O-N 3.45Å; P258-L261 PolarHBondContact O-N 3.29Å; P258-T262 WeakPolarHBondContact O-CG2 3.45Å; P258-T262 PolarHBondContact O-N 3.46Å; P258-F270 HydrophobicContact CB-CB 4.37Å; P258-I274 HydrophobicContact CB-CD1 4.48Å; P258-I274 HydrophobicContact CG-CD1 3.96Å
259	I	88.9	Confident	89.2	Confident	45 Å²	45	40.2 Å²	40.2	23%	0.231	20%	0.197	C	C	.	.	H	α-helix	trans	-65.3	-34.4	176.5	-67	170	0	0	0	110.9	L256 L257 R267 R322	L256-I259 WeakPolarHBondContact O-CB 3.36Å; L256-I259 PolarHBondContact O-N 2.75Å; L257-I259 PolarHBondContact O-N 2.92Å; I259-R267 HydrophobicContact CG2-CG 4.05Å; I259-R267 PolarHBondContact O-NE 3.45Å; I259-R322 PolarHBondContact O-NH1 2.86Å
260	E	90.2	Very high	89	Confident	26 Å²	26	40.4 Å²	40.4	12%	0.121	20%	0.198	C	C	.	.	H	α-helix	trans	-78.9	-21.1	177.1	-68.6	173.8	-177.7	0	0	113.4	R209 L256 L257 P258 S320	R209-E260 IonicContact CZ-OE1 3.54Å; R209-E260 IonicContact NE-OE1 2.72Å; R209-E260 PolarHBondContact NE-OE1 3.48Å; R209-E260 IonicContact NE-OE2 3.44Å; R209-E260 PolarHBondContact NE-OE2 3.16Å; R209-E260 IonicContact NH2-OE1 3.62Å; R209-E260 PolarHBondContact NH2-OE1 3.19Å; R209-E260 VanDerWaalsContact NH2-OE1 3.17Å; L256-E260 WeakPolarHBondContact O-CG 3.42Å; L256-E260 PolarHBondContact O-N 3.35Å; L257-E260 CarbonylContact O-C 3.28Å; L257-E260 WeakPolarHBondContact O-CA 3.41Å; L257-E260 WeakPolarHBondContact O-CB 3.4Å; L257-E260 PolarHBondContact O-N 3.38Å; P258-E260 VanDerWaalsContact C-N 3.26Å; P258-E260 PolarHBondContact O-N 3.45Å; E260-S320 WeakPolarHBondContact CB-OG 3.16Å; E260-S320 WeakPolarHBondContact OE2-CB 3.37Å; E260-S320 PolarHBondContact OE2-OG 3.14Å
261	L	91.7	Very high	88.6	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	21%	0.212	C	C	.	.	S	Bend	trans	-93.5	0	179	-61.5	175.6	0	0	0	114.6	W47 Q48 I51 L257 P258 P318 P321	W47-L261 HydrophobicContact CH2-CD1 4.47Å; W47-L261 HydrophobicContact CH2-CD2 3.63Å; W47-L261 HydrophobicContact CH2-CG 4.43Å; W47-L261 HydrophobicContact CZ2-CD2 4.16Å; W47-L261 HydrophobicContact CZ3-CB 4.5Å; W47-L261 HydrophobicContact CZ3-CD2 4.37Å; Q48-L261 HydrophobicContact CG-CB 4.37Å; Q48-L261 PolarHBondContact NE2-O 3Å; I51-L261 HydrophobicContact CD1-CD1 3.46Å; I51-L261 VanDerWaalsContact CD1-CD1 3.46Å; I51-L261 HydrophobicContact CG2-CD1 4.33Å; L257-L261 HydrophobicContact CD1-CD1 4.1Å; L257-L261 HydrophobicContact CD1-CD2 4.42Å; L257-L261 HydrophobicContact CD1-CG 4.16Å; L257-L261 HydrophobicContact CD2-CD1 4.5Å; L257-L261 HydrophobicContact CG-CD1 3.89Å; L257-L261 HydrophobicContact CG-CG 4.33Å; L257-L261 VanDerWaalsContact O-CG 3.29Å; L257-L261 WeakPolarHBondContact O-CG 3.46Å; L257-L261 PolarHBondContact O-N 2.99Å; P258-L261 PolarHBondContact O-N 3.29Å; L261-P318 HydrophobicContact CD1-CG 3.88Å; L261-P318 HydrophobicContact CD2-CG 4.38Å; L261-P321 HydrophobicContact CD2-CG 4.01Å
262	T	91.4	Very high	88.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.221	C	C	.	.	S	Bend	trans	-136.6	166.5	-175.4	-164.6	0	0	0	0	113.1	E43 P258 R267 F270 R322	E43-T262 PolarHBondContact O-OG1 2.9Å; P258-T262 WeakPolarHBondContact O-CG2 3.45Å; P258-T262 PolarHBondContact O-N 3.46Å; T262-R267 HydrophobicContact CG2-CG 3.74Å; T262-F270 HydrophobicContact CG2-CD2 3.84Å; T262-F270 HydrophobicContact CG2-CE2 3.93Å; T262-F270 WeakPolarHBondContact OG1-CE2 3.25Å; T262-R322 PolarHBondContact O-NH2 3.29Å
263	N	87.9	Confident	88.2	Confident	12 Å²	12	46.5 Å²	46.5	6%	0.064	23%	0.229	C	C	.	.			trans	-80.7	153.1	175.5	-74.4	-2.2	0	0	0	111.7	D34 L37 E43 K265 Y266	D34-N263 WeakPolarHBondContact CA-OD1 3.34Å; D34-N263 PolarHBondContact O-ND2 2.69Å; L37-N263 WeakPolarHBondContact CD1-OD1 3.29Å; E43-N263 HydrophobicContact CB-CB 4.38Å; E43-N263 HydrophobicContact CG-CB 4.43Å; E43-N263 WeakPolarHBondContact CG-ND2 3.46Å; E43-N263 PolarHBondContact OE1-ND2 3.26Å; N263-K265 PolarHBondContact O-N 3.38Å; N263-Y266 PolarHBondContact O-N 2.77Å
264	A	82.4	Confident	88.2	Confident	63 Å²	63	46.8 Å²	46.8	52%	0.521	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-51.4	-37.4	-174.6	0	0	0	0	0	113.9	Y266 R267	A264-Y266 PolarHBondContact O-N 3.49Å; A264-R267 PolarHBondContact O-N 2.96Å
265	K	80.6	Confident	88	Confident	149 Å²	149	48.1 Å²	48.1	65%	0.648	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-57.3	-30.9	179.4	-172.6	179.5	177.6	-173.5	0	114.3	N263	N263-K265 PolarHBondContact O-N 3.38Å
266	Y	85.9	Confident	88	Confident	36 Å²	36	46.3 Å²	46.3	14%	0.141	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-108	-3.9	-173.5	-62.5	-78.7	0	0	0	114.4	E43 Y44 N263 A264 S268 Y269 F270	E43-Y266 HydrophobicContact CB-CD2 3.93Å; E43-Y266 HydrophobicContact CB-CE2 3.95Å; E43-Y266 VanDerWaalsContact OE2-CE2 3.31Å; E43-Y266 WeakPolarHBondContact OE2-CE2 3.32Å; Y44-Y266 AromaticContact CD1-CD1 3.95Å; Y44-Y266 HydrophobicContact CD1-CD1 3.95Å; Y44-Y266 AromaticContact CD1-CD2 3.98Å; Y44-Y266 HydrophobicContact CD1-CD2 3.98Å; Y44-Y266 AromaticContact CD1-CE1 3.57Å; Y44-Y266 HydrophobicContact CD1-CE1 3.57Å; Y44-Y266 AromaticContact CD1-CE2 3.62Å; Y44-Y266 HydrophobicContact CD1-CE2 3.62Å; Y44-Y266 HydrophobicContact CD1-CG 4.14Å; Y44-Y266 AromaticContact CD1-CZ 3.39Å; Y44-Y266 AromaticContact CE1-CE1 3.82Å; Y44-Y266 HydrophobicContact CE1-CE1 3.82Å; Y44-Y266 HydrophobicContact CE1-CE2 4.03Å; Y44-Y266 AromaticContact CE1-CZ 3.47Å; Y44-Y266 VanDerWaalsContact CE1-CZ 3.47Å; Y44-Y266 WeakPolarHBondContact CE1-OH 3.35Å; Y44-Y266 HydrophobicContact CG-CD1 4.18Å; Y44-Y266 HydrophobicContact CG-CE1 4.12Å; Y44-Y266 HydrophobicContact CG-CG 4.47Å; N263-Y266 PolarHBondContact O-N 2.77Å; A264-Y266 PolarHBondContact O-N 3.49Å; Y266-S268 VanDerWaalsContact C-N 3.25Å; Y266-S268 PolarHBondContact O-N 3.09Å; Y266-Y269 AromaticContact CD1-CD2 3.99Å; Y266-Y269 HydrophobicContact CD1-CD2 3.99Å; Y266-Y269 HydrophobicContact CD1-CE2 4.18Å; Y266-Y269 PolarHBondContact O-N 3.44Å; Y266-F270 PolarHBondContact O-N 3.43Å
267	R	87.2	Confident	88	Confident	83 Å²	83	44.1 Å²	44.1	31%	0.313	23%	0.229	S	C	.	.	H	α-helix	trans	-55.7	-39.4	-179.4	-68.9	175.2	180	168.9	7.6	112.5	I259 T262 A264 Y269 F270 T271	I259-R267 HydrophobicContact CG2-CG 4.05Å; I259-R267 PolarHBondContact O-NE 3.45Å; T262-R267 HydrophobicContact CG2-CG 3.74Å; A264-R267 PolarHBondContact O-N 2.96Å; R267-Y269 PolarHBondContact O-N 3.45Å; R267-F270 PolarHBondContact O-N 2.94Å; R267-T271 WeakPolarHBondContact O-CB 3.47Å; R267-T271 PolarHBondContact O-N 3.48Å; R267-T271 PolarHBondContact O-OG1 3.29Å; R267-T271 VanDerWaalsContact O-OG1 3.07Å
268	S	82	Confident	87.9	Confident	69 Å²	69	44.5 Å²	44.5	48%	0.483	23%	0.231	S	C	.	.	H	α-helix	trans	-62.6	-41.1	-179.5	54.4	0	0	0	0	112.6	Y266 T271 S272	Y266-S268 VanDerWaalsContact C-N 3.25Å; Y266-S268 PolarHBondContact O-N 3.09Å; S268-T271 PolarHBondContact O-N 3.03Å; S268-S272 VanDerWaalsContact O-CB 3.3Å; S268-S272 WeakPolarHBondContact O-CB 3.39Å; S268-S272 PolarHBondContact O-N 3.07Å; S268-S272 PolarHBondContact O-OG 2.97Å
269	Y	86.2	Confident	87.6	Confident	148 Å²	148	45.5 Å²	45.5	58%	0.58	24%	0.237	S	C	*	.	H	α-helix	trans	-63.4	-45.9	179.1	-64.9	-73.9	0	0	0	112.1	Y266 R267 S272 F273	Y266-Y269 AromaticContact CD1-CD2 3.99Å; Y266-Y269 HydrophobicContact CD1-CD2 3.99Å; Y266-Y269 HydrophobicContact CD1-CE2 4.18Å; Y266-Y269 PolarHBondContact O-N 3.44Å; R267-Y269 PolarHBondContact O-N 3.45Å; Y269-S272 PolarHBondContact O-N 2.89Å; Y269-F273 WeakPolarHBondContact O-CB 3.07Å; Y269-F273 PolarHBondContact O-N 3.45Å
270	F	89	Confident	87.8	Confident	3 Å²	3	46.4 Å²	46.4	1%	0.013	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-45.4	178.3	-66.3	-44.5	0	0	0	112	Q48 W49 V52 P258 T262 Y266 R267 S272 F273 I274	Q48-F270 HydrophobicContact CB-CE1 4.35Å; Q48-F270 HydrophobicContact CB-CE2 4.18Å; Q48-F270 HydrophobicContact CB-CZ 3.66Å; W49-F270 AromaticContact CD1-CE1 3.97Å; W49-F270 HydrophobicContact CD2-CD1 4.09Å; W49-F270 AromaticContact CD2-CE1 3.54Å; W49-F270 HydrophobicContact CD2-CE1 3.54Å; W49-F270 AromaticContact CE2-CE1 3.4Å; W49-F270 HydrophobicContact CE3-CD1 4.07Å; W49-F270 AromaticContact CE3-CE1 3.98Å; W49-F270 HydrophobicContact CE3-CE1 3.98Å; W49-F270 AromaticContact CG-CE1 3.91Å; W49-F270 HydrophobicContact CG-CE1 3.91Å; W49-F270 AromaticContact CH2-CD1 3.92Å; W49-F270 HydrophobicContact CH2-CD1 3.92Å; W49-F270 HydrophobicContact CH2-CE1 4.16Å; W49-F270 AromaticContact CZ2-CD1 3.94Å; W49-F270 HydrophobicContact CZ2-CD1 3.94Å; W49-F270 AromaticContact CZ2-CE1 3.74Å; W49-F270 HydrophobicContact CZ2-CE1 3.74Å; W49-F270 AromaticContact CZ3-CD1 3.98Å; W49-F270 HydrophobicContact CZ3-CD1 3.98Å; W49-F270 HydrophobicContact CZ3-CE1 4.26Å; W49-F270 AromaticContact NE1-CE1 3.68Å; V52-F270 HydrophobicContact CB-CD1 4.42Å; V52-F270 HydrophobicContact CG2-CB 4Å; V52-F270 HydrophobicContact CG2-CD1 3.63Å; V52-F270 HydrophobicContact CG2-CE1 4.24Å; V52-F270 HydrophobicContact CG2-CG 3.91Å; P258-F270 HydrophobicContact CB-CB 4.37Å; T262-F270 HydrophobicContact CG2-CD2 3.84Å; T262-F270 HydrophobicContact CG2-CE2 3.93Å; T262-F270 WeakPolarHBondContact OG1-CE2 3.25Å; Y266-F270 PolarHBondContact O-N 3.43Å; R267-F270 PolarHBondContact O-N 2.94Å; F270-S272 VanDerWaalsContact C-N 3.34Å; F270-S272 PolarHBondContact O-N 3.19Å; F270-F273 PolarHBondContact O-N 2.97Å; F270-I274 VanDerWaalsContact O-CG1 3.27Å; F270-I274 WeakPolarHBondContact O-CG1 3.36Å; F270-I274 PolarHBondContact O-N 3.31Å
271	T	87	Confident	87.8	Confident	53 Å²	53	46.3 Å²	46.3	33%	0.325	25%	0.245	S	C	.	.	H	α-helix	trans	-59.7	-45.4	176.5	-60.8	0	0	0	0	111.3	R267 S268 F273 I274 V275	R267-T271 WeakPolarHBondContact O-CB 3.47Å; R267-T271 PolarHBondContact O-N 3.48Å; R267-T271 PolarHBondContact O-OG1 3.29Å; R267-T271 VanDerWaalsContact O-OG1 3.07Å; S268-T271 PolarHBondContact O-N 3.03Å; T271-F273 PolarHBondContact O-N 3.02Å; T271-I274 PolarHBondContact O-N 3.44Å; T271-V275 HydrophobicContact CG2-CG2 4.46Å; T271-V275 VanDerWaalsContact O-CG2 3.31Å; T271-V275 WeakPolarHBondContact O-CG2 3.42Å; T271-V275 PolarHBondContact O-N 2.99Å
272	S	86.3	Confident	87.9	Confident	42 Å²	42	47.3 Å²	47.3	29%	0.294	25%	0.25	S	C	.	.	H	α-helix	trans	-61.9	-41.3	178	-67.4	0	0	0	0	112.5	S268 Y269 F270 V275 L276	S268-S272 VanDerWaalsContact O-CB 3.3Å; S268-S272 WeakPolarHBondContact O-CB 3.39Å; S268-S272 PolarHBondContact O-N 3.07Å; S268-S272 PolarHBondContact O-OG 2.97Å; Y269-S272 PolarHBondContact O-N 2.89Å; F270-S272 VanDerWaalsContact C-N 3.34Å; F270-S272 PolarHBondContact O-N 3.19Å; S272-V275 PolarHBondContact O-N 3.29Å; S272-L276 WeakPolarHBondContact O-CB 3.35Å; S272-L276 PolarHBondContact O-N 2.79Å
273	F	89.9	Confident	87.9	Confident	76 Å²	76	47.9 Å²	47.9	33%	0.333	25%	0.252	S	S	.	.	H	α-helix	trans	-66.3	-40.3	176.9	-171.1	-90.7	0	0	0	112.3	W49 V52 V56 Y269 F270 T271 V275 L276 G277	W49-F273 HydrophobicContact CH2-CB 4.25Å; W49-F273 HydrophobicContact CH2-CG 4.4Å; W49-F273 HydrophobicContact CZ3-CB 3.9Å; W49-F273 HydrophobicContact CZ3-CD1 4.05Å; W49-F273 AromaticContact CZ3-CD2 3.99Å; W49-F273 HydrophobicContact CZ3-CD2 3.99Å; W49-F273 AromaticContact CZ3-CG 3.71Å; W49-F273 HydrophobicContact CZ3-CG 3.71Å; V52-F273 HydrophobicContact CG1-CB 4.42Å; V52-F273 HydrophobicContact CG1-CD1 3.51Å; V52-F273 HydrophobicContact CG1-CE1 4.2Å; V52-F273 HydrophobicContact CG1-CG 4.33Å; V56-F273 HydrophobicContact CG2-CD1 3.99Å; V56-F273 HydrophobicContact CG2-CE1 4.06Å; Y269-F273 WeakPolarHBondContact O-CB 3.07Å; Y269-F273 PolarHBondContact O-N 3.45Å; F270-F273 PolarHBondContact O-N 2.97Å; T271-F273 PolarHBondContact O-N 3.02Å; F273-V275 VanDerWaalsContact C-N 3.35Å; F273-L276 PolarHBondContact O-N 3.44Å; F273-G277 PolarHBondContact O-N 3.15Å
274	I	90.8	Very high	88.1	Confident	6 Å²	6	48.2 Å²	48.2	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-46	175.1	-66.8	166.1	0	0	0	110.5	V52 I55 V56 R255 P258 F270 T271 G277 V278	V52-I274 HydrophobicContact CG1-CD1 4.47Å; V52-I274 HydrophobicContact CG1-CG1 3.88Å; V52-I274 HydrophobicContact CG2-CD1 4.47Å; I55-I274 HydrophobicContact CG2-CG2 4.33Å; V56-I274 HydrophobicContact CG2-CB 4.47Å; V56-I274 HydrophobicContact CG2-CG1 4.32Å; R255-I274 HydrophobicContact CG-CG2 4.36Å; P258-I274 HydrophobicContact CB-CD1 4.48Å; P258-I274 HydrophobicContact CG-CD1 3.96Å; F270-I274 VanDerWaalsContact O-CG1 3.27Å; F270-I274 WeakPolarHBondContact O-CG1 3.36Å; F270-I274 PolarHBondContact O-N 3.31Å; T271-I274 PolarHBondContact O-N 3.44Å; I274-G277 PolarHBondContact O-N 2.97Å; I274-V278 HydrophobicContact CG2-CG2 4.36Å; I274-V278 WeakPolarHBondContact O-CB 3.35Å; I274-V278 VanDerWaalsContact O-CG2 3.31Å; I274-V278 WeakPolarHBondContact O-CG2 3.42Å; I274-V278 PolarHBondContact O-N 3.33Å
275	V	88.2	Confident	88.6	Confident	30 Å²	30	49 Å²	49	18%	0.182	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-45.5	178.2	172.3	0	0	0	0	110.9	T271 S272 F273 G277 V278 V279 P450 I512	T271-V275 HydrophobicContact CG2-CG2 4.46Å; T271-V275 VanDerWaalsContact O-CG2 3.31Å; T271-V275 WeakPolarHBondContact O-CG2 3.42Å; T271-V275 PolarHBondContact O-N 2.99Å; S272-V275 PolarHBondContact O-N 3.29Å; F273-V275 VanDerWaalsContact C-N 3.35Å; V275-G277 PolarHBondContact O-N 2.95Å; V275-V278 PolarHBondContact O-N 3.34Å; V275-V279 HydrophobicContact CG1-CG2 3.96Å; V275-V279 VanDerWaalsContact O-CB 3.28Å; V275-V279 WeakPolarHBondContact O-CB 3.32Å; V275-V279 WeakPolarHBondContact O-CG2 3.45Å; V275-V279 PolarHBondContact O-N 3.1Å; V275-P450 HydrophobicContact CG1-CG 3.73Å; V275-I512 HydrophobicContact CG1-CD1 4.48Å
276	L	89.6	Confident	89.3	Confident	65 Å²	65	42.4 Å²	42.4	34%	0.34	23%	0.226	S	C	.	.	I	π-helix	trans	-58.5	-49.8	177	178.5	65.2	0	0	0	111.5	S272 F273 V278 F280 G281 I447	S272-L276 WeakPolarHBondContact O-CB 3.35Å; S272-L276 PolarHBondContact O-N 2.79Å; F273-L276 PolarHBondContact O-N 3.44Å; L276-V278 PolarHBondContact O-N 3.22Å; L276-F280 HydrophobicContact CD1-CB 4.09Å; L276-F280 HydrophobicContact CD1-CD1 4.23Å; L276-F280 HydrophobicContact CD1-CG 4.47Å; L276-F280 WeakPolarHBondContact O-CA 3.33Å; L276-F280 VanDerWaalsContact O-CB 3.32Å; L276-F280 WeakPolarHBondContact O-CB 3.44Å; L276-F280 PolarHBondContact O-N 3.04Å; L276-G281 PolarHBondContact O-N 2.88Å; L276-G281 VanDerWaalsContact O-N 3.09Å; L276-I447 HydrophobicContact CD1-CB 4.48Å; L276-I447 HydrophobicContact CD1-CD1 4.44Å; L276-I447 HydrophobicContact CD1-CG1 3.69Å
277	G	90.3	Very high	89.6	Confident	14 Å²	14	41 Å²	41	14%	0.144	22%	0.222	C	C	.	.	I	π-helix	trans	-63.6	-40.1	-179.8	0	0	0	0	0	113.5	F273 I274 V275 G281 H282	F273-G277 PolarHBondContact O-N 3.15Å; I274-G277 PolarHBondContact O-N 2.97Å; V275-G277 PolarHBondContact O-N 2.95Å; G277-G281 CarbonylContact O-C 3.38Å; G277-G281 WeakPolarHBondContact O-CA 3.46Å; G277-G281 PolarHBondContact O-N 3.14Å; G277-H282 PolarHBondContact O-N 3.24Å
278	V	88.4	Confident	90	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.055	22%	0.224	C	C	.	.	I	π-helix	trans	-80.6	-45.9	-178.2	176.1	0	0	0	0	112.7	L61 I274 V275 L276 H282	L61-V278 HydrophobicContact CB-CG1 4.46Å; L61-V278 HydrophobicContact CD1-CG1 4.44Å; I274-V278 HydrophobicContact CG2-CG2 4.36Å; I274-V278 WeakPolarHBondContact O-CB 3.35Å; I274-V278 VanDerWaalsContact O-CG2 3.31Å; I274-V278 WeakPolarHBondContact O-CG2 3.42Å; I274-V278 PolarHBondContact O-N 3.33Å; V275-V278 PolarHBondContact O-N 3.34Å; L276-V278 PolarHBondContact O-N 3.22Å; V278-H282 WeakPolarHBondContact O-CB 3.26Å
279	V	86.7	Confident	90.6	Very high	25 Å²	25	37 Å²	37	15%	0.152	21%	0.209	C	C	.	.	I	π-helix	trans	-80.1	-48.3	-174.8	-178.2	0	0	0	0	111	V275 R283	V275-V279 HydrophobicContact CG1-CG2 3.96Å; V275-V279 VanDerWaalsContact O-CB 3.28Å; V275-V279 WeakPolarHBondContact O-CB 3.32Å; V275-V279 WeakPolarHBondContact O-CG2 3.45Å; V275-V279 PolarHBondContact O-N 3.1Å; V279-R283 WeakPolarHBondContact O-CB 2.95Å; V279-R283 WeakPolarHBondContact O-CD 3.24Å; V279-R283 WeakPolarHBondContact O-CG 3.45Å
280	F	91.8	Very high	90.9	Very high	64 Å²	64	30 Å²	30	28%	0.281	18%	0.181	S	C	.	.	I	π-helix	trans	-85.4	-56.4	178.9	170.7	-107.6	0	0	0	110.9	L276 H282 R283 A284 I447	L276-F280 HydrophobicContact CD1-CB 4.09Å; L276-F280 HydrophobicContact CD1-CD1 4.23Å; L276-F280 HydrophobicContact CD1-CG 4.47Å; L276-F280 WeakPolarHBondContact O-CA 3.33Å; L276-F280 VanDerWaalsContact O-CB 3.32Å; L276-F280 WeakPolarHBondContact O-CB 3.44Å; L276-F280 PolarHBondContact O-N 3.04Å; F280-H282 PolarHBondContact O-N 3.41Å; F280-R283 PolarHBondContact O-N 2.93Å; F280-A284 HydrophobicContact CE2-CB 4.33Å; F280-A284 WeakPolarHBondContact O-CB 3.15Å; F280-A284 PolarHBondContact O-N 3.38Å; F280-I447 HydrophobicContact CB-CG1 4.14Å; F280-I447 HydrophobicContact CD1-CD1 4.04Å; F280-I447 HydrophobicContact CD1-CG1 4.32Å; F280-I447 HydrophobicContact CD2-CD1 3.89Å; F280-I447 HydrophobicContact CD2-CG1 4.08Å; F280-I447 HydrophobicContact CE1-CD1 4.07Å; F280-I447 HydrophobicContact CE2-CD1 3.91Å; F280-I447 HydrophobicContact CG-CD1 3.94Å; F280-I447 HydrophobicContact CG-CG1 3.91Å; F280-I447 HydrophobicContact CZ-CD1 4.01Å
281	G	91.5	Very high	91.1	Very high	23 Å²	23	37.3 Å²	37.3	24%	0.237	21%	0.21	C	C	.	.	I	π-helix	trans	-56.6	-57.2	-172.7	0	0	0	0	0	113.4	L276 G277 T285	L276-G281 PolarHBondContact O-N 2.88Å; L276-G281 VanDerWaalsContact O-N 3.09Å; G277-G281 CarbonylContact O-C 3.38Å; G277-G281 WeakPolarHBondContact O-CA 3.46Å; G277-G281 PolarHBondContact O-N 3.14Å; G281-T285 VanDerWaalsContact O-CB 3.3Å; G281-T285 WeakPolarHBondContact O-CB 3.46Å; G281-T285 PolarHBondContact O-N 2.9Å; G281-T285 PolarHBondContact O-OG1 2.76Å
282	H	92.2	Very high	91.5	Very high	24 Å²	24	41.4 Å²	41.4	11%	0.111	23%	0.23	C	C	.	.	I	π-helix	trans	-68.3	-38.6	-179.3	-82.4	-67.2	0	0	0	113.6	V56 S59 L61 G277 V278 F280 T285 M286	V56-H282 PolarHBondContact O-CD2 2.82Å; V56-H282 PolarHBondContact O-NE2 2.7Å; S59-H282 PolarHBondContact O-CD2 3.15Å; S59-H282 PolarHBondContact O-NE2 3.33Å; L61-H282 HydrophobicContact CB-CB 4.29Å; G277-H282 PolarHBondContact O-N 3.24Å; V278-H282 WeakPolarHBondContact O-CB 3.26Å; F280-H282 PolarHBondContact O-N 3.41Å; H282-T285 PolarHBondContact O-N 2.93Å; H282-M286 WeakPolarHBondContact O-CB 3.18Å; H282-M286 PolarHBondContact O-N 3.19Å
283	R	91.4	Very high	91.8	Very high	11 Å²	11	41.2 Å²	41.2	4%	0.042	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-46.8	176.4	-67.9	-173.7	-174	-159.4	-0.1	111.6	L61 T64 V279 F280 T285 M286 T287 N442 A443	L61-R283 HydrophobicContact CD2-CG 3.68Å; T64-R283 HydrophobicContact CG2-CG 4.09Å; V279-R283 WeakPolarHBondContact O-CB 2.95Å; V279-R283 WeakPolarHBondContact O-CD 3.24Å; V279-R283 WeakPolarHBondContact O-CG 3.45Å; F280-R283 PolarHBondContact O-N 2.93Å; R283-T285 VanDerWaalsContact C-N 3.34Å; R283-T285 PolarHBondContact O-N 3.37Å; R283-M286 PolarHBondContact O-N 3.26Å; R283-T287 PolarHBondContact O-N 2.96Å; R283-T287 PolarHBondContact O-OG1 3.36Å; R283-N442 PolarHBondContact NH1-OD1 3.36Å; R283-A443 HydrophobicContact CB-CB 3.57Å
284	A	93.7	Very high	91.8	Very high	19 Å²	19	43.4 Å²	43.4	16%	0.157	24%	0.238	C	C	.	.	H	α-helix	trans	-64.2	-40.4	178.7	0	0	0	0	0	111.6	F280 T287 G288 L440 A443	F280-A284 HydrophobicContact CE2-CB 4.33Å; F280-A284 WeakPolarHBondContact O-CB 3.15Å; F280-A284 PolarHBondContact O-N 3.38Å; A284-T287 PolarHBondContact O-N 3.03Å; A284-G288 PolarHBondContact O-N 2.85Å; A284-L440 HydrophobicContact CB-CD1 3.95Å; A284-A443 HydrophobicContact CB-CB 4.29Å
285	T	92.9	Very high	92	Very high	81 Å²	81	45.7 Å²	45.7	50%	0.497	25%	0.25	S	S	.	.	H	α-helix	trans	-62.6	-44.1	175.4	-56.2	0	0	0	0	111.2	G281 H282 R283 T287 G288 I289	G281-T285 VanDerWaalsContact O-CB 3.3Å; G281-T285 WeakPolarHBondContact O-CB 3.46Å; G281-T285 PolarHBondContact O-N 2.9Å; G281-T285 PolarHBondContact O-OG1 2.76Å; H282-T285 PolarHBondContact O-N 2.93Å; R283-T285 VanDerWaalsContact C-N 3.34Å; R283-T285 PolarHBondContact O-N 3.37Å; T285-T287 VanDerWaalsContact C-N 3.34Å; T285-T287 PolarHBondContact O-N 3.42Å; T285-G288 PolarHBondContact O-N 2.99Å; T285-G288 VanDerWaalsContact O-N 3.16Å; T285-I289 HydrophobicContact CG2-CD1 3.98Å; T285-I289 HydrophobicContact CG2-CG1 4.44Å; T285-I289 WeakPolarHBondContact O-CG1 3.2Å; T285-I289 PolarHBondContact O-N 3.41Å
286	M	93.6	Very high	92.3	Very high	9 Å²	9	44.3 Å²	44.3	4%	0.044	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-41.8	176.7	-168.7	-170.4	68.5	0	0	111.7	T64 F68 H282 R283 I289 A290	T64-M286 VanDerWaalsContact CB-CE 3.42Å; T64-M286 WeakPolarHBondContact OG1-CE 3.41Å; F68-M286 HydrophobicContact CD2-CE 3.91Å; F68-M286 HydrophobicContact CE2-CE 3.49Å; F68-M286 VanDerWaalsContact CE2-CE 3.49Å; H282-M286 WeakPolarHBondContact O-CB 3.18Å; H282-M286 PolarHBondContact O-N 3.19Å; R283-M286 PolarHBondContact O-N 3.26Å; M286-I289 PolarHBondContact O-N 2.96Å; M286-A290 WeakPolarHBondContact O-CB 3.49Å; M286-A290 PolarHBondContact O-N 3.28Å
287	T	93.8	Very high	92.7	Very high	8 Å²	8	43.5 Å²	43.5	5%	0.049	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-42.9	172.8	-64.7	0	0	0	0	111.9	F68 R283 A284 T285 A290 Y291 Y436 T439 L440	F68-T287 HydrophobicContact CZ-CG2 4.39Å; R283-T287 PolarHBondContact O-N 2.96Å; R283-T287 PolarHBondContact O-OG1 3.36Å; A284-T287 PolarHBondContact O-N 3.03Å; T285-T287 VanDerWaalsContact C-N 3.34Å; T285-T287 PolarHBondContact O-N 3.42Å; T287-A290 PolarHBondContact O-N 3.1Å; T287-Y291 PolarHBondContact O-N 3.12Å; T287-Y436 VanDerWaalsContact CG2-O 3.28Å; T287-Y436 WeakPolarHBondContact CG2-O 3.28Å; T287-T439 WeakPolarHBondContact CG2-OG1 3.3Å; T287-T439 WeakPolarHBondContact OG1-CB 3.46Å; T287-T439 PolarHBondContact OG1-OG1 2.9Å; T287-T439 VanDerWaalsContact OG1-OG1 3.04Å; T287-L440 HydrophobicContact CG2-CB 4.34Å
288	G	94.2	Very high	92.9	Very high	35 Å²	35	49.1 Å²	49.1	36%	0.361	26%	0.255	S	S	.	.	H	α-helix	trans	-62.5	-43.2	175.8	0	0	0	0	0	112.7	A284 T285 Y291 L292	A284-G288 PolarHBondContact O-N 2.85Å; T285-G288 PolarHBondContact O-N 2.99Å; T285-G288 VanDerWaalsContact O-N 3.16Å; G288-Y291 PolarHBondContact O-N 3.35Å; G288-L292 WeakPolarHBondContact O-CG 3.3Å; G288-L292 PolarHBondContact O-N 2.93Å
289	I	94.4	Very high	93.3	Very high	32 Å²	32	48.7 Å²	48.7	16%	0.164	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-43.1	174.9	-64.9	166.5	0	0	0	110.4	T285 M286 Y291 L292 V293 L299 L302	T285-I289 HydrophobicContact CG2-CD1 3.98Å; T285-I289 HydrophobicContact CG2-CG1 4.44Å; T285-I289 WeakPolarHBondContact O-CG1 3.2Å; T285-I289 PolarHBondContact O-N 3.41Å; M286-I289 PolarHBondContact O-N 2.96Å; I289-Y291 PolarHBondContact O-N 3.42Å; I289-L292 PolarHBondContact O-N 3.47Å; I289-L292 VanDerWaalsContact O-N 3.11Å; I289-V293 PolarHBondContact O-N 3.34Å; I289-L299 HydrophobicContact CB-CD1 4.06Å; I289-L299 HydrophobicContact CG2-CD1 3.64Å; I289-L302 HydrophobicContact CD1-CB 4.29Å; I289-L302 HydrophobicContact CG2-CB 3.72Å; I289-L302 HydrophobicContact CG2-CD1 3.82Å; I289-L302 HydrophobicContact CG2-CG 4.45Å
290	A	93.8	Very high	93.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.4	-31.2	177.9	0	0	0	0	0	112.6	F68 Y164 M286 T287 V293 L299 Y436	F68-A290 HydrophobicContact CD1-CB 3.8Å; F68-A290 HydrophobicContact CE1-CB 3.73Å; F68-A290 HydrophobicContact CG-CB 4.22Å; F68-A290 HydrophobicContact CZ-CB 4.12Å; Y164-A290 HydrophobicContact CD2-CB 4.37Å; Y164-A290 HydrophobicContact CE2-CB 4.09Å; Y164-A290 WeakPolarHBondContact CE2-O 3.35Å; M286-A290 WeakPolarHBondContact O-CB 3.49Å; M286-A290 PolarHBondContact O-N 3.28Å; T287-A290 PolarHBondContact O-N 3.1Å; A290-V293 VanDerWaalsContact O-O 3.12Å; A290-L299 HydrophobicContact CB-CD1 3.79Å; A290-L299 HydrophobicContact CB-CD2 3.87Å; A290-Y436 HydrophobicContact CB-CD1 4.4Å; A290-Y436 HydrophobicContact CB-CE1 4.02Å; A290-Y436 WeakPolarHBondContact O-CE1 3.35Å
291	Y	93.5	Very high	93.9	Very high	157 Å²	157	46.6 Å²	46.6	62%	0.616	25%	0.249	S	C	*	.	H	α-helix	trans	-70.5	-39	173.8	-179.8	-101.9	0	0	0	112.2	T287 G288 I289 Y436	T287-Y291 PolarHBondContact O-N 3.12Å; G288-Y291 PolarHBondContact O-N 3.35Å; I289-Y291 PolarHBondContact O-N 3.42Å; Y291-Y436 HydrophobicContact CD2-CD2 4.09Å; Y291-Y436 HydrophobicContact CD2-CE2 4.31Å; Y291-Y436 HydrophobicContact CD2-CG 4.26Å
292	L	94	Very high	94	Very high	140 Å²	140	48.4 Å²	48.4	73%	0.733	25%	0.253	S	S	*	.	H	α-helix	trans	-80.1	-32.9	-177.8	-65	173.4	0	0	0	113.4	G288 I289	G288-L292 WeakPolarHBondContact O-CG 3.3Å; G288-L292 PolarHBondContact O-N 2.93Å; I289-L292 PolarHBondContact O-N 3.47Å; I289-L292 VanDerWaalsContact O-N 3.11Å
293	V	92.9	Very high	94.1	Very high	38 Å²	38	47.7 Å²	47.7	23%	0.23	25%	0.251	C	S	.	.			trans	-123.2	115.8	-174.5	177.9	0	0	0	0	108.6	Y164 I289 A290 F298 L302	Y164-V293 WeakPolarHBondContact CE2-O 3.35Å; Y164-V293 PolarHBondContact OH-O 3.25Å; I289-V293 PolarHBondContact O-N 3.34Å; A290-V293 VanDerWaalsContact O-O 3.12Å; V293-F298 HydrophobicContact CG1-CB 3.57Å; V293-L302 HydrophobicContact CB-CD1 4.28Å; V293-L302 HydrophobicContact CG1-CD1 4.38Å; V293-L302 HydrophobicContact CG2-CD1 3.62Å
294	Q	91.1	Very high	94.1	Very high	122 Å²	122	47.6 Å²	47.6	57%	0.57	25%	0.251	S	S	*	.			trans	-97.8	14.1	-172.7	-73.6	-173.7	-1.4	0	0	113.6	Y164 P165 S166	Y164-Q294 VanDerWaalsContact OH-C 3.23Å; P165-Q294 HydrophobicContact CG-CB 3.58Å; P165-Q294 HydrophobicContact CG-CG 3.79Å; S166-Q294 WeakPolarHBondContact CB-O 3.32Å
295	D	94.5	Very high	94	Very high	54 Å²	54	51.2 Å²	51.2	29%	0.289	27%	0.267	S	S	.	.			trans	-111.9	125.4	174.9	-178.9	-69.3	0	0	0	110	Y164 R297 F298 L299	Y164-D295 PolarHBondContact OH-N 3.24Å; Y164-D295 VanDerWaalsContact OH-N 3.11Å; Y164-D295 PolarHBondContact OH-O 3.34Å; D295-R297 VanDerWaalsContact C-N 3.3Å; D295-R297 PolarHBondContact O-N 2.91Å; D295-R297 WeakPolarHBondContact OD1-CA 3.28Å; D295-R297 VanDerWaalsContact OD1-CB 3.26Å; D295-R297 WeakPolarHBondContact OD1-CB 3.49Å; D295-R297 PolarHBondContact OD1-N 2.9Å; D295-F298 HydrophobicContact CB-CB 4.33Å; D295-F298 HydrophobicContact CB-CD2 3.8Å; D295-F298 PolarHBondContact O-N 3.46Å; D295-F298 WeakPolarHBondContact OD1-CD2 3.38Å; D295-F298 PolarHBondContact OD1-N 2.77Å; D295-F298 VanDerWaalsContact OD1-N 3.11Å; D295-L299 VanDerWaalsContact O-CB 3.31Å; D295-L299 WeakPolarHBondContact O-CB 3.35Å; D295-L299 PolarHBondContact O-N 3.18Å
296	W	95.1	Very high	93.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.5	-28.5	-174	71	-93.7	0	0	0	113.8	V69 Y164 S166 V168 E171 F172 V227 Y236 N300	V69-W296 HydrophobicContact CB-CB 4.2Å; V69-W296 HydrophobicContact CG1-CB 3.61Å; Y164-W296 HydrophobicContact CE1-CB 4.03Å; Y164-W296 PolarHBondContact OH-N 3.3Å; S166-W296 WeakPolarHBondContact O-CB 3.37Å; V168-W296 HydrophobicContact CG2-CD2 3.5Å; V168-W296 VanDerWaalsContact CG2-CD2 3.5Å; V168-W296 HydrophobicContact CG2-CE3 3.62Å; V168-W296 HydrophobicContact CG2-CG 4.01Å; V168-W296 HydrophobicContact CG2-CH2 4.15Å; V168-W296 HydrophobicContact CG2-CZ2 4.03Å; V168-W296 HydrophobicContact CG2-CZ3 3.95Å; E171-W296 VanDerWaalsContact OE2-CZ2 3.28Å; E171-W296 WeakPolarHBondContact OE2-CZ2 3.31Å; E171-W296 PolarHBondContact OE2-NE1 3.13Å; F172-W296 HydrophobicContact CE2-CH2 4.44Å; F172-W296 HydrophobicContact CE2-CZ2 4.33Å; F172-W296 HydrophobicContact CZ-CH2 4.43Å; F172-W296 HydrophobicContact CZ-CZ2 4.23Å; V227-W296 HydrophobicContact CG1-CZ3 4.49Å; Y236-W296 HydrophobicContact CD2-CH2 4.15Å; Y236-W296 HydrophobicContact CD2-CZ3 4.03Å; Y236-W296 HydrophobicContact CE2-CH2 4.46Å; Y236-W296 AromaticContact CE2-CZ3 3.96Å; Y236-W296 HydrophobicContact CE2-CZ3 3.96Å; W296-N300 WeakPolarHBondContact O-CB 3.49Å; W296-N300 PolarHBondContact O-N 3.24Å
297	R	96.4	Very high	93.7	Very high	48 Å²	48	48.2 Å²	48.2	18%	0.181	25%	0.25	C	C	.	.	H	α-helix	trans	-70.7	-44.2	179.7	-60.8	176.7	171	-82.8	3.2	109.9	E171 S228 A230 D295 A301	E171-R297 IonicContact OE1-CZ 3.22Å; E171-R297 VanDerWaalsContact OE1-CZ 3.28Å; E171-R297 IonicContact OE1-NE 2.58Å; E171-R297 PolarHBondContact OE1-NE 2.98Å; E171-R297 VanDerWaalsContact OE1-NE 3.13Å; E171-R297 IonicContact OE1-NH2 3.87Å; E171-R297 PolarHBondContact OE1-NH2 2.92Å; E171-R297 IonicContact OE2-CZ 3.17Å; E171-R297 IonicContact OE2-NE 2.97Å; E171-R297 PolarHBondContact OE2-NE 3.08Å; E171-R297 IonicContact OE2-NH2 3.66Å; S228-R297 PolarHBondContact O-NH1 2.87Å; S228-R297 PolarHBondContact OG-O 3.41Å; A230-R297 VanDerWaalsContact O-CZ 3.29Å; A230-R297 PolarHBondContact O-NH1 3.37Å; A230-R297 PolarHBondContact O-NH2 3.1Å; D295-R297 VanDerWaalsContact C-N 3.3Å; D295-R297 PolarHBondContact O-N 2.91Å; D295-R297 WeakPolarHBondContact OD1-CA 3.28Å; D295-R297 VanDerWaalsContact OD1-CB 3.26Å; D295-R297 WeakPolarHBondContact OD1-CB 3.49Å; D295-R297 PolarHBondContact OD1-N 2.9Å; R297-A301 WeakPolarHBondContact O-CB 3.42Å; R297-A301 PolarHBondContact O-N 3.39Å
298	F	95.9	Very high	93.6	Very high	133 Å²	133	51.6 Å²	51.6	58%	0.583	27%	0.267	S	S	*	.	H	α-helix	trans	-69.5	-38.1	173.5	-72.1	-75	0	0	0	112	V293 D295 N300 A301 L302	V293-F298 HydrophobicContact CG1-CB 3.57Å; D295-F298 HydrophobicContact CB-CB 4.33Å; D295-F298 HydrophobicContact CB-CD2 3.8Å; D295-F298 PolarHBondContact O-N 3.46Å; D295-F298 WeakPolarHBondContact OD1-CD2 3.38Å; D295-F298 PolarHBondContact OD1-N 2.77Å; D295-F298 VanDerWaalsContact OD1-N 3.11Å; F298-N300 VanDerWaalsContact C-N 3.34Å; F298-N300 PolarHBondContact O-N 3.31Å; F298-A301 PolarHBondContact O-N 3.09Å; F298-L302 WeakPolarHBondContact O-CB 3.46Å; F298-L302 VanDerWaalsContact O-CG 3.3Å; F298-L302 WeakPolarHBondContact O-CG 2.84Å; F298-L302 PolarHBondContact O-N 2.93Å
299	L	95.5	Very high	93.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-56.9	-47.8	173	173.4	58.7	0	0	0	111.3	L65 F68 V69 Y164 I289 A290 D295 S303	L65-L299 HydrophobicContact CD1-CD2 4.21Å; L65-L299 HydrophobicContact CD1-CG 4.23Å; F68-L299 HydrophobicContact CB-CD2 4.16Å; F68-L299 HydrophobicContact CG-CD2 4.44Å; V69-L299 HydrophobicContact CG1-CD2 4.42Å; Y164-L299 HydrophobicContact CE1-CD2 4.21Å; Y164-L299 HydrophobicContact CE2-CD2 4.06Å; I289-L299 HydrophobicContact CB-CD1 4.06Å; I289-L299 HydrophobicContact CG2-CD1 3.64Å; A290-L299 HydrophobicContact CB-CD1 3.79Å; A290-L299 HydrophobicContact CB-CD2 3.87Å; D295-L299 VanDerWaalsContact O-CB 3.31Å; D295-L299 WeakPolarHBondContact O-CB 3.35Å; D295-L299 PolarHBondContact O-N 3.18Å; L299-S303 WeakPolarHBondContact O-CB 3.5Å; L299-S303 PolarHBondContact O-N 3.49Å; L299-S303 PolarHBondContact O-OG 2.74Å
300	N	95.6	Very high	92.8	Very high	2 Å²	2	50 Å²	50	1%	0.011	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-45.6	175.7	179.3	82	0	0	0	111.5	M62 L65 G224 S228 W296 F298 L302 S303 M304	M62-N300 WeakPolarHBondContact CE-OD1 3.4Å; L65-N300 HydrophobicContact CD2-CB 4.33Å; L65-N300 WeakPolarHBondContact CD2-OD1 3.22Å; G224-N300 PolarHBondContact O-ND2 2.98Å; S228-N300 PolarHBondContact N-ND2 2.69Å; S228-N300 PolarHBondContact OG-ND2 2.94Å; W296-N300 WeakPolarHBondContact O-CB 3.49Å; W296-N300 PolarHBondContact O-N 3.24Å; F298-N300 VanDerWaalsContact C-N 3.34Å; F298-N300 PolarHBondContact O-N 3.31Å; N300-L302 PolarHBondContact O-N 2.92Å; N300-S303 PolarHBondContact O-N 2.8Å; N300-M304 WeakPolarHBondContact O-CB 3.38Å; N300-M304 VanDerWaalsContact O-CG 3.3Å; N300-M304 WeakPolarHBondContact O-CG 3.21Å; N300-M304 PolarHBondContact O-N 3.46Å
301	A	95.4	Very high	92.6	Very high	42 Å²	42	54.9 Å²	54.9	35%	0.347	27%	0.273	S	S	.	.	H	α-helix	trans	-62	-45.6	-179.3	0	0	0	0	0	112.1	S228 R297 F298 M304 L305	S228-A301 PolarHBondContact OG-N 3.24Å; R297-A301 WeakPolarHBondContact O-CB 3.42Å; R297-A301 PolarHBondContact O-N 3.39Å; F298-A301 PolarHBondContact O-N 3.09Å; A301-M304 WeakPolarHBondContact O-CB 3.4Å; A301-M304 PolarHBondContact O-N 3.35Å; A301-L305 PolarHBondContact O-N 3.4Å; A301-L305 VanDerWaalsContact O-N 3.16Å
302	L	94.8	Very high	92.5	Very high	62 Å²	62	51.7 Å²	51.7	33%	0.325	27%	0.265	S	S	.	.	H	α-helix	trans	-67.6	-39.7	177.9	-70.7	172.1	0	0	0	111.8	I289 V293 F298 N300 M304 L305	I289-L302 HydrophobicContact CD1-CB 4.29Å; I289-L302 HydrophobicContact CG2-CB 3.72Å; I289-L302 HydrophobicContact CG2-CD1 3.82Å; I289-L302 HydrophobicContact CG2-CG 4.45Å; V293-L302 HydrophobicContact CB-CD1 4.28Å; V293-L302 HydrophobicContact CG1-CD1 4.38Å; V293-L302 HydrophobicContact CG2-CD1 3.62Å; F298-L302 WeakPolarHBondContact O-CB 3.46Å; F298-L302 VanDerWaalsContact O-CG 3.3Å; F298-L302 WeakPolarHBondContact O-CG 2.84Å; F298-L302 PolarHBondContact O-N 2.93Å; N300-L302 PolarHBondContact O-N 2.92Å; L302-M304 PolarHBondContact O-N 3.01Å; L302-L305 HydrophobicContact CD2-CD1 3.66Å; L302-L305 WeakPolarHBondContact O-CB 3.27Å; L302-L305 PolarHBondContact O-N 3.49Å
303	S	92.9	Very high	92.4	Very high	9 Å²	9	45 Å²	45	6%	0.063	23%	0.23	C	C	.	.	H	α-helix	trans	-66	-22.1	174.4	-57.4	0	0	0	0	112.7	P60 L299 N300 P306	P60-S303 VanDerWaalsContact CB-O 3.25Å; P60-S303 WeakPolarHBondContact CB-O 3.39Å; L299-S303 WeakPolarHBondContact O-CB 3.5Å; L299-S303 PolarHBondContact O-N 3.49Å; L299-S303 PolarHBondContact O-OG 2.74Å; N300-S303 PolarHBondContact O-N 2.8Å; S303-P306 VanDerWaalsContact O-CD 3.31Å; S303-P306 WeakPolarHBondContact O-CD 3.1Å
304	M	92.2	Very high	92.3	Very high	9 Å²	9	47.8 Å²	47.8	4%	0.044	24%	0.239	C	C	.	.	H	α-helix	trans	-88.8	-13.7	175.2	-78	-71.7	98.4	0	0	114.6	P60 M62 N300 A301 L302 P306 C307	P60-M304 HydrophobicContact CB-CE 3.82Å; P60-M304 HydrophobicContact CG-CE 3.35Å; M62-M304 HydrophobicContact CE-CE 3.69Å; M62-M304 HydrophobicContact CE-CG 4.09Å; M62-M304 HydrophobicContact CE-SD 4.44Å; M62-M304 HydrophobicContact CG-CE 3.12Å; M62-M304 HydrophobicContact CG-SD 4.47Å; M62-M304 HydrophobicContact SD-CE 3.36Å; M62-M304 WeakPolarHBondContact SD-CE 3.46Å; N300-M304 WeakPolarHBondContact O-CB 3.38Å; N300-M304 VanDerWaalsContact O-CG 3.3Å; N300-M304 WeakPolarHBondContact O-CG 3.21Å; N300-M304 PolarHBondContact O-N 3.46Å; A301-M304 WeakPolarHBondContact O-CB 3.4Å; A301-M304 PolarHBondContact O-N 3.35Å; L302-M304 PolarHBondContact O-N 3.01Å; M304-P306 VanDerWaalsContact C-N 3.25Å; M304-P306 VanDerWaalsContact O-N 3.14Å; M304-C307 WeakPolarHBondContact O-CB 3.34Å; M304-C307 PolarHBondContact O-N 2.81Å
305	L	91.9	Very high	92.3	Very high	94 Å²	94	45.9 Å²	45.9	49%	0.492	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-49.3	-39.6	176.2	-73.9	176.2	0	0	0	114.2	A301 L302 C307 L308	A301-L305 PolarHBondContact O-N 3.4Å; A301-L305 VanDerWaalsContact O-N 3.16Å; L302-L305 HydrophobicContact CD2-CD1 3.66Å; L302-L305 WeakPolarHBondContact O-CB 3.27Å; L302-L305 PolarHBondContact O-N 3.49Å; L305-C307 PolarHBondContact O-N 3.01Å; L305-L308 HydrophobicContact CD2-CD1 3.78Å; L305-L308 VanDerWaalsContact O-CB 3.29Å; L305-L308 WeakPolarHBondContact O-CB 3.36Å; L305-L308 PolarHBondContact O-N 2.89Å
306	P	90.6	Very high	92.2	Very high	27 Å²	27	47.1 Å²	47.1	18%	0.175	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-63.2	-24.6	178.9	-15.3	28.3	0	0	0	113.1	L57 S58 S303 M304 L308 T309	L57-P306 WeakPolarHBondContact O-CB 3.45Å; S58-P306 WeakPolarHBondContact CA-O 3.38Å; S303-P306 VanDerWaalsContact O-CD 3.31Å; S303-P306 WeakPolarHBondContact O-CD 3.1Å; M304-P306 VanDerWaalsContact C-N 3.25Å; M304-P306 VanDerWaalsContact O-N 3.14Å; P306-L308 PolarHBondContact O-N 3.38Å; P306-T309 WeakPolarHBondContact O-CB 3.45Å; P306-T309 PolarHBondContact O-N 3.01Å; P306-T309 VanDerWaalsContact O-N 3.13Å; P306-T309 PolarHBondContact O-OG1 3.22Å
307	C	90.1	Very high	92.1	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.007	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-61.3	-25.9	171.8	-75.5	0	0	0	0	113.2	P60 E220 L221 M304 L305 T309 C310	P60-C307 VanDerWaalsContact CD-SG 3.52Å; P60-C307 WeakPolarHBondContact CG-SG 3.35Å; E220-C307 PolarHBondContact OE1-SG 3.11Å; L221-C307 HydrophobicContact CD1-CB 4.21Å; M304-C307 WeakPolarHBondContact O-CB 3.34Å; M304-C307 PolarHBondContact O-N 2.81Å; L305-C307 PolarHBondContact O-N 3.01Å; C307-T309 PolarHBondContact O-N 3.49Å; C307-T309 VanDerWaalsContact O-N 3.16Å; C307-C310 WeakPolarHBondContact O-CB 3.42Å; C307-C310 PolarHBondContact O-N 3.24Å; C307-C310 PolarHBondContact O-SG 3.44Å
308	L	90.4	Very high	91.9	Very high	79 Å²	79	45.5 Å²	45.5	41%	0.414	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-62.6	-21.5	176.6	-66.8	171.1	0	0	0	112.4	L221 L305 P306 C310 F311	L221-L308 HydrophobicContact CD1-CD2 3.65Å; L221-L308 HydrophobicContact CD1-CG 4.22Å; L221-L308 HydrophobicContact CD2-CD2 3.99Å; L221-L308 HydrophobicContact CG-CD2 4.47Å; L305-L308 HydrophobicContact CD2-CD1 3.78Å; L305-L308 VanDerWaalsContact O-CB 3.29Å; L305-L308 WeakPolarHBondContact O-CB 3.36Å; L305-L308 PolarHBondContact O-N 2.89Å; P306-L308 PolarHBondContact O-N 3.38Å; L308-C310 PolarHBondContact O-N 3.43Å; L308-F311 HydrophobicContact CD2-CE2 4.2Å; L308-F311 VanDerWaalsContact O-CD2 3.23Å; L308-F311 WeakPolarHBondContact O-CD2 3.14Å; L308-F311 PolarHBondContact O-N 2.79Å
309	T	87.7	Confident	91.9	Very high	30 Å²	30	40 Å²	40	18%	0.184	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-67.2	-5.2	173.2	65.4	0	0	0	0	113.1	L57 S58 P306 C307 F311 M312	L57-T309 HydrophobicContact CD2-CG2 3.87Å; L57-T309 HydrophobicContact CG-CG2 3.99Å; S58-T309 WeakPolarHBondContact CA-OG1 3.47Å; S58-T309 WeakPolarHBondContact CB-OG1 3.47Å; P306-T309 WeakPolarHBondContact O-CB 3.45Å; P306-T309 PolarHBondContact O-N 3.01Å; P306-T309 VanDerWaalsContact O-N 3.13Å; P306-T309 PolarHBondContact O-OG1 3.22Å; C307-T309 PolarHBondContact O-N 3.49Å; C307-T309 VanDerWaalsContact O-N 3.16Å; T309-F311 PolarHBondContact O-N 2.83Å; T309-M312 VanDerWaalsContact O-CB 3.26Å; T309-M312 WeakPolarHBondContact O-CB 3.48Å; T309-M312 PolarHBondContact O-N 2.95Å
310	C	84.6	Confident	91.7	Very high	2 Å²	2	40 Å²	40	1%	0.014	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-59.2	-29.6	170.5	72.3	0	0	0	0	113.3	S217 C307 L308 M312 Y313	S217-C310 VanDerWaalsContact CB-CB 3.41Å; C307-C310 WeakPolarHBondContact O-CB 3.42Å; C307-C310 PolarHBondContact O-N 3.24Å; C307-C310 PolarHBondContact O-SG 3.44Å; L308-C310 PolarHBondContact O-N 3.43Å; C310-M312 PolarHBondContact O-N 2.68Å; C310-Y313 HydrophobicContact CB-CD2 4.42Å; C310-Y313 HydrophobicContact CB-CE2 4.44Å; C310-Y313 WeakPolarHBondContact O-CB 3.32Å; C310-Y313 VanDerWaalsContact O-CG 3.31Å; C310-Y313 PolarHBondContact O-N 3.41Å
311	F	90.3	Very high	91.6	Very high	103 Å²	103	40 Å²	40	45%	0.452	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-61.9	-29.8	175	-68.6	-71.8	0	0	0	111.7	F218 L221 L308 T309 Y313 F314	F218-F311 HydrophobicContact CE1-CD1 4.3Å; F218-F311 AromaticContact CE1-CE1 3.53Å; F218-F311 HydrophobicContact CE1-CE1 3.53Å; F218-F311 AromaticContact CE1-CZ 3.95Å; F218-F311 HydrophobicContact CE1-CZ 3.95Å; F218-F311 AromaticContact CZ-CD1 3.88Å; F218-F311 HydrophobicContact CZ-CD1 3.88Å; F218-F311 AromaticContact CZ-CE1 3.55Å; F218-F311 HydrophobicContact CZ-CE1 3.55Å; F218-F311 HydrophobicContact CZ-CZ 4.35Å; L221-F311 HydrophobicContact CD2-CE2 4Å; L221-F311 HydrophobicContact CD2-CZ 4.18Å; L308-F311 HydrophobicContact CD2-CE2 4.2Å; L308-F311 VanDerWaalsContact O-CD2 3.23Å; L308-F311 WeakPolarHBondContact O-CD2 3.14Å; L308-F311 PolarHBondContact O-N 2.79Å; T309-F311 PolarHBondContact O-N 2.83Å; F311-Y313 PolarHBondContact O-N 3.19Å; F311-F314 WeakPolarHBondContact O-CD2 2.96Å; F311-F314 PolarHBondContact O-N 3.13Å
312	M	91.4	Very high	91.3	Very high	91 Å²	91	40.7 Å²	40.7	45%	0.448	21%	0.209	S	C	.	.	H	α-helix	trans	-67.4	-18	175	-57.1	-57.2	-67.1	0	0	112.5	L54 T309 C310 F314 C315 L316	L54-M312 HydrophobicContact CD1-CB 3.99Å; T309-M312 VanDerWaalsContact O-CB 3.26Å; T309-M312 WeakPolarHBondContact O-CB 3.48Å; T309-M312 PolarHBondContact O-N 2.95Å; C310-M312 PolarHBondContact O-N 2.68Å; M312-F314 VanDerWaalsContact C-N 3.26Å; M312-F314 PolarHBondContact O-N 2.99Å; M312-C315 PolarHBondContact O-N 3.27Å; M312-L316 HydrophobicContact CB-CD1 4.2Å; M312-L316 HydrophobicContact CE-CD1 3.82Å; M312-L316 HydrophobicContact CE-CG 4.33Å; M312-L316 WeakPolarHBondContact O-CB 3.28Å; M312-L316 PolarHBondContact O-N 3.34Å
313	Y	91.5	Very high	91	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-31.9	178.2	-65.7	-2.2	0	0	0	112.4	L54 S58 A213 I214 S217 L254 C310 F311 C315 L317	L54-Y313 HydrophobicContact CD1-CD1 4.26Å; L54-Y313 HydrophobicContact CD1-CE1 4.12Å; L54-Y313 HydrophobicContact CD2-CD1 3.9Å; L54-Y313 HydrophobicContact CD2-CE1 4.2Å; L54-Y313 HydrophobicContact CG-CD1 4.06Å; L54-Y313 HydrophobicContact CG-CE1 3.86Å; S58-Y313 WeakPolarHBondContact CB-OH 3.46Å; S58-Y313 PolarHBondContact OG-OH 2.65Å; A213-Y313 HydrophobicContact CB-CD2 4.35Å; A213-Y313 HydrophobicContact CB-CE2 4.22Å; I214-Y313 HydrophobicContact CG1-CD2 4.26Å; S217-Y313 WeakPolarHBondContact OG-CE2 3.45Å; L254-Y313 HydrophobicContact CD1-CE2 4.04Å; L254-Y313 WeakPolarHBondContact CD1-OH 3.35Å; C310-Y313 HydrophobicContact CB-CD2 4.42Å; C310-Y313 HydrophobicContact CB-CE2 4.44Å; C310-Y313 WeakPolarHBondContact O-CB 3.32Å; C310-Y313 VanDerWaalsContact O-CG 3.31Å; C310-Y313 PolarHBondContact O-N 3.41Å; F311-Y313 PolarHBondContact O-N 3.19Å; Y313-C315 VanDerWaalsContact C-N 3.26Å; Y313-C315 PolarHBondContact O-N 2.78Å; Y313-L317 HydrophobicContact CD1-CD2 4.46Å; Y313-L317 HydrophobicContact CD2-CD2 4.02Å; Y313-L317 HydrophobicContact CG-CB 4.36Å; Y313-L317 HydrophobicContact CG-CD2 3.96Å; Y313-L317 VanDerWaalsContact O-CB 3.26Å; Y313-L317 WeakPolarHBondContact O-CB 3.45Å; Y313-L317 PolarHBondContact O-N 2.85Å
314	F	90.6	Very high	90.9	Very high	96 Å²	96	38.1 Å²	38.1	42%	0.421	19%	0.194	S	C	.	.	H	α-helix	trans	-60.2	-39.8	176.6	-71.3	-77	0	0	0	111.9	R210 I214 F218 F311 M312	R210-F314 PolarHBondContact NH2-O 2.67Å; I214-F314 HydrophobicContact CD1-CD1 4Å; I214-F314 HydrophobicContact CD1-CE1 4.09Å; I214-F314 HydrophobicContact CG2-CE1 3.89Å; I214-F314 HydrophobicContact CG2-CE2 4.26Å; I214-F314 HydrophobicContact CG2-CZ 3.62Å; F218-F314 AromaticContact CE2-CE2 3.39Å; F218-F314 HydrophobicContact CE2-CE2 3.39Å; F218-F314 AromaticContact CE2-CZ 3.48Å; F218-F314 HydrophobicContact CE2-CZ 3.48Å; F218-F314 VanDerWaalsContact CE2-CZ 3.48Å; F218-F314 AromaticContact CZ-CE2 3.6Å; F218-F314 HydrophobicContact CZ-CE2 3.6Å; F218-F314 AromaticContact CZ-CZ 3.95Å; F218-F314 HydrophobicContact CZ-CZ 3.95Å; F311-F314 WeakPolarHBondContact O-CD2 2.96Å; F311-F314 PolarHBondContact O-N 3.13Å; M312-F314 VanDerWaalsContact C-N 3.26Å; M312-F314 PolarHBondContact O-N 2.99Å
315	C	90.7	Very high	90.7	Very high	82 Å²	82	39.5 Å²	39.5	55%	0.554	20%	0.202	S	C	*	.	H	α-helix	trans	-91.7	-39.4	-174.4	-58.1	0	0	0	0	113.1	M312 Y313 R339	M312-C315 PolarHBondContact O-N 3.27Å; Y313-C315 VanDerWaalsContact C-N 3.26Å; Y313-C315 PolarHBondContact O-N 2.78Å; C315-R339 PolarHBondContact O-NH1 3Å; C315-R339 PolarHBondContact O-NH2 3.18Å
316	L	91.5	Very high	90.3	Very high	80 Å²	80	38.4 Å²	38.4	42%	0.419	20%	0.202	S	C	.	.	H	α-helix	trans	-104.1	-34.1	-167.1	-60.9	-176.5	0	0	0	114.2	L54 M312 P318	L54-L316 HydrophobicContact CD2-CB 3.85Å; L54-L316 HydrophobicContact CD2-CD1 4.34Å; M312-L316 HydrophobicContact CB-CD1 4.2Å; M312-L316 HydrophobicContact CE-CD1 3.82Å; M312-L316 HydrophobicContact CE-CG 4.33Å; M312-L316 WeakPolarHBondContact O-CB 3.28Å; M312-L316 PolarHBondContact O-N 3.34Å; L316-P318 WeakPolarHBondContact O-CD 3.31Å
317	L	93	Very high	90.1	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.016	21%	0.206	C	C	.	.			trans	-76.1	114.4	-173.5	-163.9	71.2	0	0	0	109.5	I51 R210 A213 L254 L257 Y313	I51-L317 HydrophobicContact CG2-CD1 4.15Å; R210-L317 WeakPolarHBondContact CD-O 3.48Å; R210-L317 HydrophobicContact CG-CB 4.46Å; R210-L317 HydrophobicContact CG-CD2 4.34Å; R210-L317 PolarHBondContact NE-O 3.36Å; R210-L317 VanDerWaalsContact NE-O 3.16Å; A213-L317 HydrophobicContact CB-CD2 3.87Å; L254-L317 HydrophobicContact CD2-CD1 4.05Å; L254-L317 HydrophobicContact CD2-CD2 3.8Å; L257-L317 HydrophobicContact CD2-CD1 3.43Å; L257-L317 VanDerWaalsContact CD2-CD1 3.43Å; L257-L317 HydrophobicContact CD2-CG 3.85Å; Y313-L317 HydrophobicContact CD1-CD2 4.46Å; Y313-L317 HydrophobicContact CD2-CD2 4.02Å; Y313-L317 HydrophobicContact CG-CB 4.36Å; Y313-L317 HydrophobicContact CG-CD2 3.96Å; Y313-L317 VanDerWaalsContact O-CB 3.26Å; Y313-L317 WeakPolarHBondContact O-CB 3.45Å; Y313-L317 PolarHBondContact O-N 2.85Å
318	P	94	Very high	89.7	Confident	11 Å²	11	45.3 Å²	45.3	7%	0.071	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-78.9	161.4	174	35.7	-35.8	0	0	0	110.5	W47 I51 L261 L316 I336	W47-P318 HydrophobicContact CZ2-CB 4.06Å; W47-P318 HydrophobicContact CZ2-CG 3.79Å; I51-P318 HydrophobicContact CD1-CG 3.47Å; I51-P318 VanDerWaalsContact CD1-CG 3.47Å; I51-P318 HydrophobicContact CG1-CG 4.44Å; L261-P318 HydrophobicContact CD1-CG 3.88Å; L261-P318 HydrophobicContact CD2-CG 4.38Å; L316-P318 WeakPolarHBondContact O-CD 3.31Å; P318-I336 HydrophobicContact CB-CG2 3.82Å
319	E	94.8	Very high	89.6	Confident	17 Å²	17	45.6 Å²	45.6	8%	0.079	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-79.5	158.2	163.2	-169.9	52.1	-97	0	0	110.3	G208 R209 R210 P321 W323 L324 I336	G208-E319 WeakPolarHBondContact CA-OE2 3.31Å; R209-E319 WeakPolarHBondContact CA-OE1 3.39Å; R209-E319 VanDerWaalsContact CB-OE1 3.31Å; R209-E319 WeakPolarHBondContact CB-OE1 3.09Å; R209-E319 VanDerWaalsContact N-CD 3.3Å; R209-E319 PolarHBondContact N-OE1 2.82Å; R209-E319 PolarHBondContact N-OE2 3.43Å; R209-E319 VanDerWaalsContact N-OE2 3.13Å; R210-E319 HydrophobicContact CB-CB 4.32Å; R210-E319 VanDerWaalsContact CB-OE2 3.3Å; R210-E319 WeakPolarHBondContact CB-OE2 3.43Å; R210-E319 PolarHBondContact N-OE1 3.5Å; R210-E319 PolarHBondContact N-OE2 3.23Å; E319-P321 WeakPolarHBondContact O-CD 3.41Å; E319-W323 HydrophobicContact CG-CE3 3.69Å; E319-W323 HydrophobicContact CG-CZ3 3.74Å; E319-L324 HydrophobicContact CB-CD1 4.18Å; E319-L324 HydrophobicContact CB-CG 4.49Å; E319-L324 HydrophobicContact CG-CD1 4.17Å; E319-L324 HydrophobicContact CG-CD2 4Å; E319-L324 HydrophobicContact CG-CG 3.94Å; E319-I336 HydrophobicContact CB-CD1 3.82Å; E319-I336 WeakPolarHBondContact O-CD1 3.42Å
320	S	92.3	Very high	89.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-71.5	120.9	179	168.4	0	0	0	0	112.3	E260 R322 W323 L324	E260-S320 WeakPolarHBondContact CB-OG 3.16Å; E260-S320 WeakPolarHBondContact OE2-CB 3.37Å; E260-S320 PolarHBondContact OE2-OG 3.14Å; S320-R322 VanDerWaalsContact C-N 3.28Å; S320-R322 PolarHBondContact O-N 2.72Å; S320-W323 PolarHBondContact O-N 3.3Å; S320-W323 PolarHBondContact OG-N 3.41Å; S320-L324 WeakPolarHBondContact O-CG 3.07Å; S320-L324 PolarHBondContact O-N 3.43Å
321	P	92.3	Very high	89.9	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-38.1	176.1	-23.1	33.6	0	0	0	112.2	V33 L261 E319 L324 L325 A333 I336 L337	V33-P321 HydrophobicContact CG1-CB 4.38Å; V33-P321 HydrophobicContact CG2-CB 4.44Å; L261-P321 HydrophobicContact CD2-CG 4.01Å; E319-P321 WeakPolarHBondContact O-CD 3.41Å; P321-L324 PolarHBondContact O-N 2.94Å; P321-L325 VanDerWaalsContact O-CG 3.29Å; P321-L325 WeakPolarHBondContact O-CG 3.3Å; P321-L325 PolarHBondContact O-N 2.77Å; P321-A333 HydrophobicContact CB-CB 4.42Å; P321-I336 HydrophobicContact CG-CG2 4.09Å; P321-L337 HydrophobicContact CB-CD1 4.29Å; P321-L337 HydrophobicContact CB-CD2 4.19Å; P321-L337 HydrophobicContact CB-CG 4.12Å; P321-L337 HydrophobicContact CG-CD2 3.95Å; P321-L337 HydrophobicContact CG-CG 4.15Å
322	R	90.2	Very high	90	Very high	57 Å²	57	50.2 Å²	50.2	22%	0.215	25%	0.245	C	C	.	.	H	α-helix	trans	-65.4	-41.2	178	-66.7	-171	-176	130.1	9.2	111.4	V33 D34 I259 T262 S320 S326	V33-R322 HydrophobicContact CB-CG 4.18Å; V33-R322 HydrophobicContact CG1-CG 4.26Å; V33-R322 HydrophobicContact CG2-CG 3.96Å; D34-R322 IonicContact OD1-CZ 3.88Å; D34-R322 IonicContact OD1-NE 3.78Å; D34-R322 IonicContact OD1-NH2 3.45Å; D34-R322 PolarHBondContact OD1-NH2 2.95Å; D34-R322 IonicContact OD2-NH2 3.03Å; I259-R322 PolarHBondContact O-NH1 2.86Å; T262-R322 PolarHBondContact O-NH2 3.29Å; S320-R322 VanDerWaalsContact C-N 3.28Å; S320-R322 PolarHBondContact O-N 2.72Å; R322-S326 PolarHBondContact O-N 3.5Å; R322-S326 VanDerWaalsContact O-N 3.08Å
323	W	88.7	Confident	90	Very high	17 Å²	17	45.9 Å²	45.9	6%	0.064	22%	0.224	C	C	.	.	H	α-helix	trans	-68.2	-39.8	175.3	-179.4	84.4	0	0	0	112.1	D205 G208 E319 S320 L325 S326 Q327	D205-W323 PolarHBondContact O-NE1 3.18Å; G208-W323 VanDerWaalsContact CA-CZ2 3.42Å; G208-W323 VanDerWaalsContact CA-CZ3 3.41Å; E319-W323 HydrophobicContact CG-CE3 3.69Å; E319-W323 HydrophobicContact CG-CZ3 3.74Å; S320-W323 PolarHBondContact O-N 3.3Å; S320-W323 PolarHBondContact OG-N 3.41Å; W323-L325 VanDerWaalsContact C-N 3.35Å; W323-L325 PolarHBondContact O-N 3.46Å; W323-S326 PolarHBondContact O-N 2.91Å; W323-S326 PolarHBondContact O-OG 2.87Å; W323-Q327 HydrophobicContact CD2-CG 4.05Å; W323-Q327 HydrophobicContact CE3-CG 4.47Å; W323-Q327 HydrophobicContact CH2-CG 4.33Å; W323-Q327 HydrophobicContact CZ2-CG 3.79Å; W323-Q327 WeakPolarHBondContact O-CG 3.46Å; W323-Q327 PolarHBondContact O-N 3.26Å
324	L	90.3	Very high	90	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.4	-42.6	175.8	-72.7	171	0	0	0	112.4	E319 S320 P321 S326 Q327 Y328 R329 E332 A333 I336	E319-L324 HydrophobicContact CB-CD1 4.18Å; E319-L324 HydrophobicContact CB-CG 4.49Å; E319-L324 HydrophobicContact CG-CD1 4.17Å; E319-L324 HydrophobicContact CG-CD2 4Å; E319-L324 HydrophobicContact CG-CG 3.94Å; S320-L324 WeakPolarHBondContact O-CG 3.07Å; S320-L324 PolarHBondContact O-N 3.43Å; P321-L324 PolarHBondContact O-N 2.94Å; L324-S326 VanDerWaalsContact C-N 3.33Å; L324-S326 PolarHBondContact O-N 3.44Å; L324-Q327 CarbonylContact O-C 3.35Å; L324-Q327 WeakPolarHBondContact O-CA 3.43Å; L324-Q327 PolarHBondContact O-N 2.61Å; L324-Q327 VanDerWaalsContact O-N 3.1Å; L324-Y328 PolarHBondContact O-N 2.75Å; L324-R329 HydrophobicContact CB-CB 4.41Å; L324-R329 HydrophobicContact CD2-CB 4.09Å; L324-R329 VanDerWaalsContact CD2-CZ 3.44Å; L324-R329 PolarHBondContact O-N 3.41Å; L324-E332 HydrophobicContact CD1-CB 3.91Å; L324-E332 HydrophobicContact CD2-CB 4.17Å; L324-E332 WeakPolarHBondContact CD2-OE2 3.34Å; L324-A333 HydrophobicContact CB-CB 3.88Å; L324-A333 HydrophobicContact CD1-CB 4.28Å; L324-I336 HydrophobicContact CD1-CD1 3.48Å; L324-I336 VanDerWaalsContact CD1-CD1 3.48Å
325	L	87.5	Confident	90.2	Very high	39 Å²	39	46.2 Å²	46.2	20%	0.204	23%	0.234	C	C	.	.	H	α-helix	trans	-64.5	-36.5	174.6	-67.7	173.7	0	0	0	112.3	L31 V33 P321 W323 Q327 Y328 V330 A333	L31-L325 HydrophobicContact CD2-CD1 4.18Å; L31-L325 HydrophobicContact CD2-CD2 3.86Å; V33-L325 HydrophobicContact CG2-CD1 3.35Å; P321-L325 VanDerWaalsContact O-CG 3.29Å; P321-L325 WeakPolarHBondContact O-CG 3.3Å; P321-L325 PolarHBondContact O-N 2.77Å; W323-L325 VanDerWaalsContact C-N 3.35Å; W323-L325 PolarHBondContact O-N 3.46Å; L325-Q327 PolarHBondContact O-N 2.89Å; L325-Y328 PolarHBondContact O-N 3.49Å; L325-Y328 VanDerWaalsContact O-N 3.15Å; L325-V330 HydrophobicContact CD2-CB 4.34Å; L325-V330 HydrophobicContact CD2-CG1 4.2Å; L325-V330 HydrophobicContact CD2-CG2 4.01Å; L325-A333 HydrophobicContact CD2-CB 3.97Å; L325-A333 HydrophobicContact CG-CB 3.99Å
326	S	83.4	Confident	90.3	Very high	70 Å²	70	43.7 Å²	43.7	49%	0.49	21%	0.214	S	C	.	.	H	α-helix	trans	-69	-20.8	173.8	84.1	0	0	0	0	113.2	R322 W323 L324	R322-S326 PolarHBondContact O-N 3.5Å; R322-S326 VanDerWaalsContact O-N 3.08Å; W323-S326 PolarHBondContact O-N 2.91Å; W323-S326 PolarHBondContact O-OG 2.87Å; L324-S326 VanDerWaalsContact C-N 3.33Å; L324-S326 PolarHBondContact O-N 3.44Å
327	Q	85.8	Confident	90.4	Very high	59 Å²	59	39.9 Å²	39.9	28%	0.276	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	13.8	172.7	-61.5	-52.2	-61.7	0	0	113.2	W323 L324 L325 R329	W323-Q327 HydrophobicContact CD2-CG 4.05Å; W323-Q327 HydrophobicContact CE3-CG 4.47Å; W323-Q327 HydrophobicContact CH2-CG 4.33Å; W323-Q327 HydrophobicContact CZ2-CG 3.79Å; W323-Q327 WeakPolarHBondContact O-CG 3.46Å; W323-Q327 PolarHBondContact O-N 3.26Å; L324-Q327 CarbonylContact O-C 3.35Å; L324-Q327 WeakPolarHBondContact O-CA 3.43Å; L324-Q327 PolarHBondContact O-N 2.61Å; L324-Q327 VanDerWaalsContact O-N 3.1Å; L325-Q327 PolarHBondContact O-N 2.89Å; Q327-R329 PolarHBondContact O-N 3.26Å; Q327-R329 VanDerWaalsContact O-N 3.15Å
328	Y	83.7	Confident	90.4	Very high	114 Å²	114	45.3 Å²	45.3	45%	0.447	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	20.8	-178.7	-56.8	-82.7	0	0	0	115.2	L324 L325 V330 R378	L324-Y328 PolarHBondContact O-N 2.75Å; L325-Y328 PolarHBondContact O-N 3.49Å; L325-Y328 VanDerWaalsContact O-N 3.15Å; Y328-V330 PolarHBondContact O-N 3.2Å; Y328-R378 HydrophobicContact CE2-CB 3.76Å; Y328-R378 WeakPolarHBondContact OH-CD 3.33Å
329	R	88.2	Confident	90.3	Very high	85 Å²	85	50.8 Å²	50.8	32%	0.321	23%	0.234	S	C	.	.			trans	-97.8	70.5	177.2	-73.6	-176.1	-70.3	167.6	-12.5	111.5	L324 Q327 E332 A333	L324-R329 HydrophobicContact CB-CB 4.41Å; L324-R329 HydrophobicContact CD2-CB 4.09Å; L324-R329 VanDerWaalsContact CD2-CZ 3.44Å; L324-R329 PolarHBondContact O-N 3.41Å; Q327-R329 PolarHBondContact O-N 3.26Å; Q327-R329 VanDerWaalsContact O-N 3.15Å; R329-E332 HydrophobicContact CB-CB 4.36Å; R329-E332 WeakPolarHBondContact CD-OE1 3.49Å; R329-E332 IonicContact CZ-OE2 2.68Å; R329-E332 IonicContact NE-OE2 2.98Å; R329-E332 IonicContact NH1-OE1 3.7Å; R329-E332 IonicContact NH1-OE2 2.84Å; R329-E332 PolarHBondContact NH1-OE2 3.44Å; R329-A333 PolarHBondContact O-N 2.92Å
330	V	88.1	Confident	90.2	Very high	27 Å²	27	50 Å²	50	16%	0.164	23%	0.23	C	C	.	.	H	α-helix	trans	-66.8	-44.4	-174	-175.2	0	0	0	0	112.3	L31 L325 Y328 E332 A333 I334 Y375	L31-V330 HydrophobicContact CD2-CG1 4.35Å; L325-V330 HydrophobicContact CD2-CB 4.34Å; L325-V330 HydrophobicContact CD2-CG1 4.2Å; L325-V330 HydrophobicContact CD2-CG2 4.01Å; Y328-V330 PolarHBondContact O-N 3.2Å; V330-E332 PolarHBondContact O-N 3.11Å; V330-A333 WeakPolarHBondContact O-CB 3.45Å; V330-A333 PolarHBondContact O-N 2.98Å; V330-A333 VanDerWaalsContact O-N 3.12Å; V330-I334 HydrophobicContact CG1-CD1 3.75Å; V330-I334 HydrophobicContact CG1-CG1 4.31Å; V330-I334 WeakPolarHBondContact O-CG1 3.42Å; V330-I334 PolarHBondContact O-N 3.2Å; V330-Y375 HydrophobicContact CG2-CE1 3.8Å
331	E	90.1	Very high	90.2	Very high	113 Å²	113	50 Å²	50	53%	0.528	23%	0.23	S	C	.	.	H	α-helix	trans	-60.5	-41.4	-179.7	-67.5	-60.9	158.1	0	0	113.1	I334 T335	E331-I334 PolarHBondContact O-N 3.04Å; E331-T335 WeakPolarHBondContact O-CB 3.35Å; E331-T335 PolarHBondContact O-N 2.87Å; E331-T335 PolarHBondContact O-OG1 3.32Å
332	E	91.3	Very high	90.2	Very high	92 Å²	92	57.9 Å²	57.9	43%	0.43	26%	0.26	S	S	.	.	H	α-helix	trans	-64.5	-43	175.1	-69	179.3	-153.7	0	0	110.8	L324 R329 V330 T335 I336	L324-E332 HydrophobicContact CD1-CB 3.91Å; L324-E332 HydrophobicContact CD2-CB 4.17Å; L324-E332 WeakPolarHBondContact CD2-OE2 3.34Å; R329-E332 HydrophobicContact CB-CB 4.36Å; R329-E332 WeakPolarHBondContact CD-OE1 3.49Å; R329-E332 IonicContact CZ-OE2 2.68Å; R329-E332 IonicContact NE-OE2 2.98Å; R329-E332 IonicContact NH1-OE1 3.7Å; R329-E332 IonicContact NH1-OE2 2.84Å; R329-E332 PolarHBondContact NH1-OE2 3.44Å; V330-E332 PolarHBondContact O-N 3.11Å; E332-T335 PolarHBondContact O-N 3.43Å; E332-I336 WeakPolarHBondContact O-CG1 3.29Å; E332-I336 PolarHBondContact O-N 3.06Å
333	A	91.2	Very high	90.2	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.2	-45	178.1	0	0	0	0	0	111.6	P321 L324 L325 R329 V330 T335 I336 L337	P321-A333 HydrophobicContact CB-CB 4.42Å; L324-A333 HydrophobicContact CB-CB 3.88Å; L324-A333 HydrophobicContact CD1-CB 4.28Å; L325-A333 HydrophobicContact CD2-CB 3.97Å; L325-A333 HydrophobicContact CG-CB 3.99Å; R329-A333 PolarHBondContact O-N 2.92Å; V330-A333 WeakPolarHBondContact O-CB 3.45Å; V330-A333 PolarHBondContact O-N 2.98Å; V330-A333 VanDerWaalsContact O-N 3.12Å; A333-T335 VanDerWaalsContact C-N 3.35Å; A333-T335 PolarHBondContact O-N 3.2Å; A333-I336 PolarHBondContact O-N 2.86Å; A333-L337 WeakPolarHBondContact O-CG 3.27Å; A333-L337 PolarHBondContact O-N 3.36Å
334	I	92.8	Very high	90.4	Very high	16 Å²	16	57.3 Å²	57.3	8%	0.082	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-44.6	176.2	-71.9	168.2	0	0	0	110.6	L31 V330 E331 I336 L337 R338 L361	L31-I334 HydrophobicContact CD2-CG1 4.33Å; V330-I334 HydrophobicContact CG1-CD1 3.75Å; V330-I334 HydrophobicContact CG1-CG1 4.31Å; V330-I334 WeakPolarHBondContact O-CG1 3.42Å; V330-I334 PolarHBondContact O-N 3.2Å; E331-I334 PolarHBondContact O-N 3.04Å; I334-I336 VanDerWaalsContact C-N 3.32Å; I334-I336 PolarHBondContact O-N 3.34Å; I334-L337 PolarHBondContact O-N 3.39Å; I334-R338 WeakPolarHBondContact O-CB 3.47Å; I334-R338 PolarHBondContact O-N 2.97Å; I334-L361 HydrophobicContact CB-CD2 4.42Å; I334-L361 HydrophobicContact CD1-CD2 3.98Å; I334-L361 HydrophobicContact CG1-CD2 4.04Å; I334-L361 HydrophobicContact CG2-CD1 3.5Å; I334-L361 HydrophobicContact CG2-CD2 3.52Å; I334-L361 HydrophobicContact CG2-CG 4.15Å
335	T	93.3	Very high	90.3	Very high	88 Å²	88	58 Å²	58	54%	0.54	27%	0.265	S	S	.	.	H	α-helix	trans	-60.4	-42.3	179.7	-61.8	0	0	0	0	111.7	E331 E332 A333 R338 R339	E331-T335 WeakPolarHBondContact O-CB 3.35Å; E331-T335 PolarHBondContact O-N 2.87Å; E331-T335 PolarHBondContact O-OG1 3.32Å; E332-T335 PolarHBondContact O-N 3.43Å; A333-T335 VanDerWaalsContact C-N 3.35Å; A333-T335 PolarHBondContact O-N 3.2Å; T335-R338 PolarHBondContact O-N 3.48Å; T335-R339 PolarHBondContact O-N 3.43Å
336	I	93.6	Very high	90.3	Very high	28 Å²	28	60.8 Å²	60.8	14%	0.144	28%	0.279	C	S	.	.	H	α-helix	trans	-66.4	-45.8	176.9	-67.5	175.6	0	0	0	111.1	W47 P318 E319 P321 L324 E332 A333 I334 R338 R339 G340	W47-I336 HydrophobicContact CH2-CG2 4.2Å; W47-I336 HydrophobicContact CZ2-CG2 3.99Å; P318-I336 HydrophobicContact CB-CG2 3.82Å; E319-I336 HydrophobicContact CB-CD1 3.82Å; E319-I336 WeakPolarHBondContact O-CD1 3.42Å; P321-I336 HydrophobicContact CG-CG2 4.09Å; L324-I336 HydrophobicContact CD1-CD1 3.48Å; L324-I336 VanDerWaalsContact CD1-CD1 3.48Å; E332-I336 WeakPolarHBondContact O-CG1 3.29Å; E332-I336 PolarHBondContact O-N 3.06Å; A333-I336 PolarHBondContact O-N 2.86Å; I334-I336 VanDerWaalsContact C-N 3.32Å; I334-I336 PolarHBondContact O-N 3.34Å; I336-R338 VanDerWaalsContact C-N 3.33Å; I336-R338 PolarHBondContact O-N 3.42Å; I336-R339 WeakPolarHBondContact O-CB 3.37Å; I336-R339 PolarHBondContact O-N 3.39Å; I336-G340 PolarHBondContact O-N 2.92Å
337	L	93.4	Very high	90.1	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-40.3	177.3	-70.1	169.4	0	0	0	111.5	V33 I36 L37 V41 P321 A333 I334 R339 G340 C341 F357	V33-L337 HydrophobicContact CG1-CD2 4.36Å; I36-L337 HydrophobicContact CD1-CD1 4.13Å; I36-L337 HydrophobicContact CG2-CB 4.45Å; I36-L337 HydrophobicContact CG2-CD1 4.09Å; L37-L337 HydrophobicContact CD2-CD2 4.15Å; V41-L337 HydrophobicContact CG2-CB 4.33Å; V41-L337 HydrophobicContact CG2-CD2 4.37Å; P321-L337 HydrophobicContact CB-CD1 4.29Å; P321-L337 HydrophobicContact CB-CD2 4.19Å; P321-L337 HydrophobicContact CB-CG 4.12Å; P321-L337 HydrophobicContact CG-CD2 3.95Å; P321-L337 HydrophobicContact CG-CG 4.15Å; A333-L337 WeakPolarHBondContact O-CG 3.27Å; A333-L337 PolarHBondContact O-N 3.36Å; I334-L337 PolarHBondContact O-N 3.39Å; L337-R339 PolarHBondContact O-N 3.25Å; L337-G340 PolarHBondContact O-N 3.44Å; L337-C341 WeakPolarHBondContact O-CB 3.48Å; L337-C341 PolarHBondContact O-N 3.06Å; L337-F357 HydrophobicContact CB-CZ 4.16Å
338	R	93.2	Very high	89.9	Confident	117 Å²	117	68.2 Å²	68.2	44%	0.442	31%	0.307	S	S	.	.	H	α-helix	trans	-60.6	-43.7	173.9	-163.2	175.9	-174.4	-162	-2.6	111.7	I334 T335 I336 C341 R342 L354 F357 D358	I334-R338 WeakPolarHBondContact O-CB 3.47Å; I334-R338 PolarHBondContact O-N 2.97Å; T335-R338 PolarHBondContact O-N 3.48Å; I336-R338 VanDerWaalsContact C-N 3.33Å; I336-R338 PolarHBondContact O-N 3.42Å; R338-C341 WeakPolarHBondContact O-CB 3.31Å; R338-C341 PolarHBondContact O-N 2.89Å; R338-R342 PolarHBondContact O-N 3.45Å; R338-L354 HydrophobicContact CG-CD1 4.16Å; R338-F357 HydrophobicContact CB-CD1 4.28Å; R338-F357 HydrophobicContact CB-CE1 3.77Å; R338-F357 HydrophobicContact CG-CD1 4.14Å; R338-F357 HydrophobicContact CG-CE1 4.11Å; R338-D358 IonicContact CZ-OD1 3.67Å; R338-D358 IonicContact CZ-OD2 2.78Å; R338-D358 IonicContact NE-OD1 3.8Å; R338-D358 PolarHBondContact NE-OD1 2.76Å; R338-D358 IonicContact NE-OD2 3.07Å; R338-D358 IonicContact NH2-OD1 2.78Å; R338-D358 PolarHBondContact NH2-OD1 2.96Å; R338-D358 VanDerWaalsContact NH2-OD1 3.07Å; R338-D358 IonicContact NH2-OD2 3.16Å; R338-D358 PolarHBondContact NH2-OD2 2.96Å
339	R	92.5	Very high	89.6	Confident	126 Å²	126	71.8 Å²	71.8	48%	0.475	33%	0.325	S	S	.	.	H	α-helix	trans	-62.3	-44.2	175.3	-177.2	177.4	178.2	-174.5	-3.4	111.4	C315 T335 I336 L337 R342 I343	C315-R339 PolarHBondContact O-NH1 3Å; C315-R339 PolarHBondContact O-NH2 3.18Å; T335-R339 PolarHBondContact O-N 3.43Å; I336-R339 WeakPolarHBondContact O-CB 3.37Å; I336-R339 PolarHBondContact O-N 3.39Å; L337-R339 PolarHBondContact O-N 3.25Å; R339-R342 PolarHBondContact O-N 3.45Å; R339-I343 HydrophobicContact CG-CD1 4Å; R339-I343 WeakPolarHBondContact O-CG1 3.19Å; R339-I343 PolarHBondContact O-N 3.49Å
340	G	92.4	Very high	89.1	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.3	-44.5	174.7	0	0	0	0	0	112.6	I336 L337 R342 I343 N344	I336-G340 PolarHBondContact O-N 2.92Å; L337-G340 PolarHBondContact O-N 3.44Å; G340-R342 PolarHBondContact O-N 3.34Å; G340-I343 PolarHBondContact O-N 2.88Å; G340-N344 WeakPolarHBondContact O-CB 3.41Å; G340-N344 PolarHBondContact O-N 2.89Å
341	C	92.3	Very high	88.8	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-58.3	-47.7	175.7	-174.2	0	0	0	0	111	V41 L337 R338 I343 N344 H345 L354	V41-C341 HydrophobicContact CB-CB 4.42Å; V41-C341 HydrophobicContact CG2-CB 4.04Å; L337-C341 WeakPolarHBondContact O-CB 3.48Å; L337-C341 PolarHBondContact O-N 3.06Å; R338-C341 WeakPolarHBondContact O-CB 3.31Å; R338-C341 PolarHBondContact O-N 2.89Å; C341-I343 PolarHBondContact O-N 3.19Å; C341-N344 PolarHBondContact O-N 2.86Å; C341-H345 PolarHBondContact O-CD2 3.19Å; C341-H345 PolarHBondContact O-N 2.85Å; C341-H345 VanDerWaalsContact O-N 3.16Å; C341-L354 HydrophobicContact CB-CD1 4.37Å
342	R	91.9	Very high	88.6	Confident	166 Å²	166	74.7 Å²	74.7	63%	0.626	35%	0.345	S	S	*	.	H	α-helix	trans	-57.7	-51	177	-175	179.4	173.9	175	-1.5	111.2	R338 R339 G340 H345 I346	R338-R342 PolarHBondContact O-N 3.45Å; R339-R342 PolarHBondContact O-N 3.45Å; G340-R342 PolarHBondContact O-N 3.34Å; R342-H345 PolarHBondContact O-N 2.89Å; R342-I346 HydrophobicContact CG-CD1 3.9Å; R342-I346 HydrophobicContact CG-CG1 4.28Å; R342-I346 WeakPolarHBondContact O-CB 3.44Å; R342-I346 WeakPolarHBondContact O-CD1 3.2Å; R342-I346 WeakPolarHBondContact O-CG1 3.38Å; R342-I346 PolarHBondContact O-N 3.18Å
343	I	91.5	Very high	88.3	Confident	51 Å²	51	73.3 Å²	73.3	26%	0.262	34%	0.338	S	S	.	.	H	α-helix	trans	-63.9	-44.3	-177.4	-65.8	168.3	0	0	0	111.8	W47 R339 G340 C341 H345 I346	W47-I343 HydrophobicContact CB-CB 4.04Å; W47-I343 HydrophobicContact CB-CG2 3.77Å; W47-I343 HydrophobicContact CG-CB 4.48Å; W47-I343 HydrophobicContact CG-CD1 4.45Å; W47-I343 HydrophobicContact CG-CG2 4.49Å; R339-I343 HydrophobicContact CG-CD1 4Å; R339-I343 WeakPolarHBondContact O-CG1 3.19Å; R339-I343 PolarHBondContact O-N 3.49Å; G340-I343 PolarHBondContact O-N 2.88Å; C341-I343 PolarHBondContact O-N 3.19Å; I343-H345 VanDerWaalsContact C-N 3.3Å; I343-H345 PolarHBondContact O-N 3.1Å; I343-I346 PolarHBondContact O-N 3.11Å
344	N	92.2	Very high	88.2	Confident	12 Å²	12	75.4 Å²	75.4	6%	0.064	35%	0.349	C	S	.	.	H	α-helix	trans	-65	-32.7	-178.4	-78.7	-13	0	0	0	113.5	V41 G45 V46 W47 Q48 G340 C341	V41-N344 WeakPolarHBondContact O-CB 3.32Å; V41-N344 PolarHBondContact O-ND2 3.12Å; G45-N344 VanDerWaalsContact C-OD1 3.3Å; G45-N344 VanDerWaalsContact CA-OD1 3.27Å; G45-N344 WeakPolarHBondContact CA-OD1 3.3Å; V46-N344 PolarHBondContact N-OD1 2.87Å; V46-N344 VanDerWaalsContact N-OD1 3.11Å; W47-N344 WeakPolarHBondContact CB-OD1 3.46Å; W47-N344 PolarHBondContact N-OD1 3.26Å; Q48-N344 PolarHBondContact OE1-ND2 3.38Å; Q48-N344 PolarHBondContact OE1-OD1 3.3Å; G340-N344 WeakPolarHBondContact O-CB 3.41Å; G340-N344 PolarHBondContact O-N 2.89Å; C341-N344 PolarHBondContact O-N 2.86Å
345	H	89.1	Confident	87.9	Confident	14 Å²	14	77.4 Å²	77.4	7%	0.065	36%	0.364	C	S	.	.	H	α-helix	trans	-99.6	-5.2	-178.8	-58.5	-54.6	0	0	0	114.3	Y40 C341 R342 I343 L347 K348 K349 D350 K353	Y40-H345 PolarHBondContact O-NE2 3.16Å; C341-H345 PolarHBondContact O-CD2 3.19Å; C341-H345 PolarHBondContact O-N 2.85Å; C341-H345 VanDerWaalsContact O-N 3.16Å; R342-H345 PolarHBondContact O-N 2.89Å; I343-H345 VanDerWaalsContact C-N 3.3Å; I343-H345 PolarHBondContact O-N 3.1Å; H345-L347 VanDerWaalsContact C-N 3.34Å; H345-L347 PolarHBondContact O-N 3.37Å; H345-K348 PolarHBondContact O-N 2.98Å; H345-K349 PolarHBondContact O-N 3.16Å; H345-K349 VanDerWaalsContact O-N 3.12Å; H345-D350 PolarHBondContact O-N 3.33Å; H345-K353 WeakPolarHBondContact CE1-CD 3.39Å; H345-K353 WeakPolarHBondContact NE2-CD 3.18Å
346	I	85.9	Confident	87.8	Confident	97 Å²	97	77.8 Å²	77.8	50%	0.497	36%	0.36	S	S	.	.	H	α-helix	trans	-55.5	-47.8	175.1	-89.2	158.8	0	0	0	111	R342 I343 K348 K349	R342-I346 HydrophobicContact CG-CD1 3.9Å; R342-I346 HydrophobicContact CG-CG1 4.28Å; R342-I346 WeakPolarHBondContact O-CB 3.44Å; R342-I346 WeakPolarHBondContact O-CD1 3.2Å; R342-I346 WeakPolarHBondContact O-CG1 3.38Å; R342-I346 PolarHBondContact O-N 3.18Å; I343-I346 PolarHBondContact O-N 3.11Å; I346-K348 VanDerWaalsContact C-N 3.3Å; I346-K348 PolarHBondContact O-N 3.27Å; I346-K349 PolarHBondContact O-N 2.93Å; I346-K349 VanDerWaalsContact O-N 3.13Å
347	L	80.3	Confident	87.6	Confident	130 Å²	130	76.5 Å²	76.5	68%	0.681	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-31	-177.8	-66.5	177.1	0	0	0	112.7	V46 H345 K349	V46-L347 HydrophobicContact CB-CD1 4.43Å; V46-L347 HydrophobicContact CG1-CD1 4.46Å; V46-L347 HydrophobicContact CG2-CD1 3.69Å; H345-L347 VanDerWaalsContact C-N 3.34Å; H345-L347 PolarHBondContact O-N 3.37Å; L347-K349 PolarHBondContact O-N 3.49Å
348	K	81.6	Confident	87.4	Confident	156 Å²	156	78 Å²	78	68%	0.678	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-8.3	176.4	-65	-176.8	178.7	-178.5	0	112.8	H345 I346 D350	H345-K348 PolarHBondContact O-N 2.98Å; I346-K348 VanDerWaalsContact C-N 3.3Å; I346-K348 PolarHBondContact O-N 3.27Å; K348-D350 HydrophobicContact CB-CB 4.16Å; K348-D350 PolarHBondContact O-N 2.87Å
349	K	77.4	Confident	87.3	Confident	189 Å²	189	76.5 Å²	76.5	82%	0.822	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	22.8	-170.3	-65.1	-178.3	177.6	177	0	113.5	H345 I346 L347 K351	H345-K349 PolarHBondContact O-N 3.16Å; H345-K349 VanDerWaalsContact O-N 3.12Å; I346-K349 PolarHBondContact O-N 2.93Å; I346-K349 VanDerWaalsContact O-N 3.13Å; L347-K349 PolarHBondContact O-N 3.49Å; K349-K351 PolarHBondContact O-N 3.48Å
350	D	77.6	Confident	87.1	Confident	52 Å²	52	73 Å²	73	28%	0.278	35%	0.35	S	S	.	.			trans	-89.3	92	-175.8	-176	7.5	0	0	0	110.2	H345 K348 S352	H345-D350 PolarHBondContact O-N 3.33Å; K348-D350 HydrophobicContact CB-CB 4.16Å; K348-D350 PolarHBondContact O-N 2.87Å; D350-S352 PolarHBondContact O-N 3.19Å; D350-S352 WeakPolarHBondContact OD1-CB 3.15Å; D350-S352 PolarHBondContact OD1-N 3.47Å; D350-S352 PolarHBondContact OD1-OG 3.08Å; D350-S352 PolarHBondContact OD2-OG 2.92Å
351	K	80.9	Confident	86.9	Confident	180 Å²	180	74 Å²	74	78%	0.783	36%	0.355	S	S	*	.	H	α-helix	trans	-74.4	-13.3	174.7	-69.5	-176	179.1	178.4	0	112.8	K349 L354 S355	K349-K351 PolarHBondContact O-N 3.48Å; K351-L354 PolarHBondContact O-N 3.16Å; K351-S355 PolarHBondContact O-N 3.39Å; K351-S355 VanDerWaalsContact O-N 3.1Å; K351-S355 PolarHBondContact O-OG 3.47Å
352	S	86.2	Confident	86.7	Confident	54 Å²	54	79.9 Å²	79.9	38%	0.378	38%	0.381	S	S	.	.	H	α-helix	trans	-63.9	-46.4	-174.6	75.9	0	0	0	0	111.2	D350 L354 S355 Q356	D350-S352 PolarHBondContact O-N 3.19Å; D350-S352 WeakPolarHBondContact OD1-CB 3.15Å; D350-S352 PolarHBondContact OD1-N 3.47Å; D350-S352 PolarHBondContact OD1-OG 3.08Å; D350-S352 PolarHBondContact OD2-OG 2.92Å; S352-L354 VanDerWaalsContact C-N 3.34Å; S352-L354 PolarHBondContact O-N 3.31Å; S352-S355 PolarHBondContact O-N 3.45Å; S352-S355 VanDerWaalsContact O-N 3.15Å; S352-S355 PolarHBondContact O-OG 2.89Å; S352-Q356 WeakPolarHBondContact O-CG 3.27Å; S352-Q356 PolarHBondContact O-N 3.29Å
353	K	85.9	Confident	86.4	Confident	63 Å²	63	75.9 Å²	75.9	27%	0.274	37%	0.372	S	S	.	.	H	α-helix	trans	-63.1	-37.7	179.3	-73.9	-163.9	170	-140.8	0	113.6	K39 H345 Q356 F357	K39-K353 PolarHBondContact O-NZ 2.8Å; H345-K353 WeakPolarHBondContact CE1-CD 3.39Å; H345-K353 WeakPolarHBondContact NE2-CD 3.18Å; K353-Q356 PolarHBondContact O-N 3.43Å; K353-F357 WeakPolarHBondContact O-CB 3.04Å; K353-F357 PolarHBondContact O-N 2.92Å
354	L	88.1	Confident	86.1	Confident	43 Å²	43	74.2 Å²	74.2	23%	0.225	36%	0.364	C	S	.	.	H	α-helix	trans	-65.8	-41.9	175.6	-173.8	63.6	0	0	0	111	R338 C341 K351 S352 F357 D358	R338-L354 HydrophobicContact CG-CD1 4.16Å; C341-L354 HydrophobicContact CB-CD1 4.37Å; K351-L354 PolarHBondContact O-N 3.16Å; S352-L354 VanDerWaalsContact C-N 3.34Å; S352-L354 PolarHBondContact O-N 3.31Å; L354-F357 PolarHBondContact O-N 2.88Å; L354-D358 PolarHBondContact O-N 3.32Å
355	S	87.7	Confident	85.6	Confident	58 Å²	58	77.5 Å²	77.5	41%	0.406	38%	0.381	S	S	.	.	H	α-helix	trans	-66.6	-36.9	175.7	68.6	0	0	0	0	113.2	K351 S352 F357 D358 N359	K351-S355 PolarHBondContact O-N 3.39Å; K351-S355 VanDerWaalsContact O-N 3.1Å; K351-S355 PolarHBondContact O-OG 3.47Å; S352-S355 PolarHBondContact O-N 3.45Å; S352-S355 VanDerWaalsContact O-N 3.15Å; S352-S355 PolarHBondContact O-OG 2.89Å; S355-F357 VanDerWaalsContact C-N 3.35Å; S355-D358 PolarHBondContact O-N 3Å; S355-N359 WeakPolarHBondContact O-CB 3.19Å; S355-N359 VanDerWaalsContact O-CG 3.27Å; S355-N359 PolarHBondContact O-N 3.3Å; S355-N359 PolarHBondContact O-ND2 3.18Å
356	Q	89.7	Confident	85.2	Confident	97 Å²	97	82.8 Å²	82.8	45%	0.453	40%	0.404	S	S	.	.	H	α-helix	trans	-63.6	-41.6	173	-72.2	174.7	7.7	0	0	111.4	Y40 S352 K353 N359 F360	Y40-Q356 HydrophobicContact CD1-CB 4.21Å; Y40-Q356 HydrophobicContact CE1-CB 4.1Å; S352-Q356 WeakPolarHBondContact O-CG 3.27Å; S352-Q356 PolarHBondContact O-N 3.29Å; K353-Q356 PolarHBondContact O-N 3.43Å; Q356-N359 PolarHBondContact O-N 3.34Å; Q356-F360 WeakPolarHBondContact O-CB 3.23Å; Q356-F360 PolarHBondContact O-N 3.02Å
357	F	89.6	Confident	84.6	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-63.5	-44.5	174.8	-171.8	-117.9	0	0	0	111.5	I36 Y40 L337 R338 K353 L354 S355 N359 F360 L361	I36-F357 HydrophobicContact CG2-CD2 4.26Å; I36-F357 HydrophobicContact CG2-CE2 3.46Å; I36-F357 VanDerWaalsContact CG2-CE2 3.46Å; I36-F357 HydrophobicContact CG2-CZ 4.07Å; Y40-F357 HydrophobicContact CD1-CB 4.22Å; Y40-F357 HydrophobicContact CD1-CD2 4.42Å; Y40-F357 AromaticContact CD2-CD2 3.74Å; Y40-F357 HydrophobicContact CD2-CD2 3.74Å; Y40-F357 HydrophobicContact CD2-CE2 4.33Å; Y40-F357 HydrophobicContact CE2-CD2 4.46Å; Y40-F357 HydrophobicContact CG-CB 4.2Å; Y40-F357 AromaticContact CG-CD2 3.71Å; Y40-F357 HydrophobicContact CG-CD2 3.71Å; Y40-F357 HydrophobicContact CG-CG 4.39Å; L337-F357 HydrophobicContact CB-CZ 4.16Å; R338-F357 HydrophobicContact CB-CD1 4.28Å; R338-F357 HydrophobicContact CB-CE1 3.77Å; R338-F357 HydrophobicContact CG-CD1 4.14Å; R338-F357 HydrophobicContact CG-CE1 4.11Å; K353-F357 WeakPolarHBondContact O-CB 3.04Å; K353-F357 PolarHBondContact O-N 2.92Å; L354-F357 PolarHBondContact O-N 2.88Å; S355-F357 VanDerWaalsContact C-N 3.35Å; F357-N359 VanDerWaalsContact C-N 3.31Å; F357-N359 PolarHBondContact O-N 3.47Å; F357-F360 HydrophobicContact CD2-CD1 4.3Å; F357-F360 HydrophobicContact CE2-CD1 4.25Å; F357-F360 WeakPolarHBondContact O-CB 3.43Å; F357-F360 PolarHBondContact O-N 2.88Å; F357-L361 HydrophobicContact CD1-CD1 4.01Å; F357-L361 HydrophobicContact CD1-CG 4.48Å; F357-L361 HydrophobicContact CE1-CD1 3.69Å; F357-L361 HydrophobicContact CE1-CD2 4.48Å; F357-L361 HydrophobicContact CE1-CG 4.22Å; F357-L361 HydrophobicContact CE2-CD2 4.38Å; F357-L361 HydrophobicContact CZ-CD1 4.13Å; F357-L361 HydrophobicContact CZ-CD2 4.08Å; F357-L361 HydrophobicContact CZ-CG 4.24Å; F357-L361 WeakPolarHBondContact O-CG 3.46Å; F357-L361 PolarHBondContact O-N 3.06Å
358	D	90.3	Very high	83.9	Confident	34 Å²	34	80.6 Å²	80.6	18%	0.182	39%	0.386	C	S	.	.	H	α-helix	trans	-63.4	-35.7	176.6	-72.9	-13.6	0	0	0	112.3	R338 L354 S355 L361 K362	R338-D358 IonicContact CZ-OD1 3.67Å; R338-D358 IonicContact CZ-OD2 2.78Å; R338-D358 IonicContact NE-OD1 3.8Å; R338-D358 PolarHBondContact NE-OD1 2.76Å; R338-D358 IonicContact NE-OD2 3.07Å; R338-D358 IonicContact NH2-OD1 2.78Å; R338-D358 PolarHBondContact NH2-OD1 2.96Å; R338-D358 VanDerWaalsContact NH2-OD1 3.07Å; R338-D358 IonicContact NH2-OD2 3.16Å; R338-D358 PolarHBondContact NH2-OD2 2.96Å; L354-D358 PolarHBondContact O-N 3.32Å; S355-D358 PolarHBondContact O-N 3Å; D358-L361 PolarHBondContact O-N 3.21Å; D358-K362 WeakPolarHBondContact O-CG 3.37Å; D358-K362 PolarHBondContact O-N 3.01Å
359	N	90.8	Very high	82.9	Confident	84 Å²	84	77.5 Å²	77.5	45%	0.449	38%	0.384	S	S	.	.	H	α-helix	trans	-67.5	-43.5	173.5	-72.2	-16.7	0	0	0	111.7	S355 Q356 F357 L361 K362 D363	S355-N359 WeakPolarHBondContact O-CB 3.19Å; S355-N359 VanDerWaalsContact O-CG 3.27Å; S355-N359 PolarHBondContact O-N 3.3Å; S355-N359 PolarHBondContact O-ND2 3.18Å; Q356-N359 PolarHBondContact O-N 3.34Å; F357-N359 VanDerWaalsContact C-N 3.31Å; F357-N359 PolarHBondContact O-N 3.47Å; N359-L361 VanDerWaalsContact C-N 3.31Å; N359-L361 PolarHBondContact O-N 2.96Å; N359-K362 WeakPolarHBondContact O-CB 3.37Å; N359-K362 PolarHBondContact O-N 3.38Å; N359-K362 VanDerWaalsContact O-N 3.14Å; N359-D363 PolarHBondContact O-N 3.46Å
360	F	88.6	Confident	81.8	Confident	54 Å²	54	76.3 Å²	76.3	24%	0.237	38%	0.381	C	S	.	.	H	α-helix	trans	-57.5	-43.4	173.5	170.3	-105.4	0	0	0	111.9	L31 I36 Y40 Q356 F357 K362 D363 L364	L31-F360 HydrophobicContact CD1-CE1 4.34Å; L31-F360 HydrophobicContact CD1-CZ 4.42Å; I36-F360 HydrophobicContact CD1-CE1 4.2Å; I36-F360 HydrophobicContact CG1-CE1 4.15Å; Y40-F360 HydrophobicContact CE1-CB 4.5Å; Y40-F360 HydrophobicContact CE2-CB 4.32Å; Y40-F360 HydrophobicContact CE2-CD1 4.02Å; Y40-F360 HydrophobicContact CE2-CD2 4.36Å; Y40-F360 HydrophobicContact CE2-CE1 4.42Å; Y40-F360 AromaticContact CE2-CG 3.97Å; Y40-F360 HydrophobicContact CE2-CG 3.97Å; Y40-F360 AromaticContact CZ-CG 4Å; Q356-F360 WeakPolarHBondContact O-CB 3.23Å; Q356-F360 PolarHBondContact O-N 3.02Å; F357-F360 HydrophobicContact CD2-CD1 4.3Å; F357-F360 HydrophobicContact CE2-CD1 4.25Å; F357-F360 WeakPolarHBondContact O-CB 3.43Å; F357-F360 PolarHBondContact O-N 2.88Å; F360-K362 PolarHBondContact O-N 3.34Å; F360-D363 PolarHBondContact O-N 3.25Å; F360-L364 HydrophobicContact CD1-CD1 3.98Å; F360-L364 HydrophobicContact CE1-CD1 3.41Å; F360-L364 VanDerWaalsContact CE1-CD1 3.41Å; F360-L364 HydrophobicContact CE1-CG 4.18Å; F360-L364 HydrophobicContact CE2-CD1 4.27Å; F360-L364 HydrophobicContact CE2-CD2 4.28Å; F360-L364 HydrophobicContact CE2-CG 4.2Å; F360-L364 HydrophobicContact CZ-CD1 3.58Å; F360-L364 HydrophobicContact CZ-CD2 4.12Å; F360-L364 HydrophobicContact CZ-CG 3.99Å; F360-L364 WeakPolarHBondContact O-CG 3.31Å; F360-L364 PolarHBondContact O-N 3.39Å
361	L	87.9	Confident	80.7	Confident	19 Å²	19	77.7 Å²	77.7	10%	0.099	39%	0.388	C	S	.	.	H	α-helix	trans	-63.4	-39.6	175.4	-66.4	177.8	0	0	0	112.4	I334 F357 D358 N359 D363 L364 N365	I334-L361 HydrophobicContact CB-CD2 4.42Å; I334-L361 HydrophobicContact CD1-CD2 3.98Å; I334-L361 HydrophobicContact CG1-CD2 4.04Å; I334-L361 HydrophobicContact CG2-CD1 3.5Å; I334-L361 HydrophobicContact CG2-CD2 3.52Å; I334-L361 HydrophobicContact CG2-CG 4.15Å; F357-L361 HydrophobicContact CD1-CD1 4.01Å; F357-L361 HydrophobicContact CD1-CG 4.48Å; F357-L361 HydrophobicContact CE1-CD1 3.69Å; F357-L361 HydrophobicContact CE1-CD2 4.48Å; F357-L361 HydrophobicContact CE1-CG 4.22Å; F357-L361 HydrophobicContact CE2-CD2 4.38Å; F357-L361 HydrophobicContact CZ-CD1 4.13Å; F357-L361 HydrophobicContact CZ-CD2 4.08Å; F357-L361 HydrophobicContact CZ-CG 4.24Å; F357-L361 WeakPolarHBondContact O-CG 3.46Å; F357-L361 PolarHBondContact O-N 3.06Å; D358-L361 PolarHBondContact O-N 3.21Å; N359-L361 VanDerWaalsContact C-N 3.31Å; N359-L361 PolarHBondContact O-N 2.96Å; L361-D363 VanDerWaalsContact C-N 3.33Å; L361-D363 PolarHBondContact O-N 3.28Å; L361-L364 HydrophobicContact CD2-CD1 4.27Å; L361-L364 PolarHBondContact O-N 2.86Å; L361-N365 PolarHBondContact O-N 2.96Å; L361-N365 PolarHBondContact O-OD1 3.22Å
362	K	87.7	Confident	78.9	Confident	124 Å²	124	71.2 Å²	71.2	54%	0.539	37%	0.372	S	S	.	.	H	α-helix	trans	-63.1	-39.7	174.1	-72.9	171.9	-176.3	175.3	0	112	D358 N359 F360 N365 K366	D358-K362 WeakPolarHBondContact O-CG 3.37Å; D358-K362 PolarHBondContact O-N 3.01Å; N359-K362 WeakPolarHBondContact O-CB 3.37Å; N359-K362 PolarHBondContact O-N 3.38Å; N359-K362 VanDerWaalsContact O-N 3.14Å; F360-K362 PolarHBondContact O-N 3.34Å; K362-N365 PolarHBondContact O-N 3.24Å; K362-K366 WeakPolarHBondContact O-CG 3.48Å; K362-K366 PolarHBondContact O-N 2.98Å
363	D	86.2	Confident	76.7	Confident	82 Å²	82	78 Å²	78	44%	0.439	39%	0.394	S	S	.	.	H	α-helix	trans	-68.6	-36.4	178	-68	-21.3	0	0	0	112	N359 F360 L361 K366 K367	N359-D363 PolarHBondContact O-N 3.46Å; F360-D363 PolarHBondContact O-N 3.25Å; L361-D363 VanDerWaalsContact C-N 3.33Å; L361-D363 PolarHBondContact O-N 3.28Å; D363-K366 PolarHBondContact O-N 2.79Å; D363-K367 WeakPolarHBondContact O-CG 3.26Å; D363-K367 PolarHBondContact O-N 3.36Å
364	L	83.5	Confident	74.5	Confident	17 Å²	17	79.1 Å²	79.1	9%	0.089	41%	0.41	C	S	.	.	H	α-helix	trans	-60.8	-49.7	170.5	-71.2	176.4	0	0	0	111.3	I29 L31 F360 L361 K366 K367 E368	I29-L364 HydrophobicContact CG2-CD2 3.64Å; L31-L364 HydrophobicContact CD1-CD1 3.72Å; F360-L364 HydrophobicContact CD1-CD1 3.98Å; F360-L364 HydrophobicContact CE1-CD1 3.41Å; F360-L364 VanDerWaalsContact CE1-CD1 3.41Å; F360-L364 HydrophobicContact CE1-CG 4.18Å; F360-L364 HydrophobicContact CE2-CD1 4.27Å; F360-L364 HydrophobicContact CE2-CD2 4.28Å; F360-L364 HydrophobicContact CE2-CG 4.2Å; F360-L364 HydrophobicContact CZ-CD1 3.58Å; F360-L364 HydrophobicContact CZ-CD2 4.12Å; F360-L364 HydrophobicContact CZ-CG 3.99Å; F360-L364 WeakPolarHBondContact O-CG 3.31Å; F360-L364 PolarHBondContact O-N 3.39Å; L361-L364 HydrophobicContact CD2-CD1 4.27Å; L361-L364 PolarHBondContact O-N 2.86Å; L364-K366 VanDerWaalsContact C-N 3.31Å; L364-K366 PolarHBondContact O-N 3.03Å; L364-K367 PolarHBondContact O-N 3.42Å; L364-K367 VanDerWaalsContact O-N 3.15Å; L364-E368 PolarHBondContact O-N 3.46Å
365	N	82.5	Confident	72.5	Confident	80 Å²	80	81.4 Å²	81.4	43%	0.428	42%	0.416	S	S	.	.	H	α-helix	trans	-63.5	-35.8	179.4	-70.6	1.6	0	0	0	112.5	L361 K362 E368 S369	L361-N365 PolarHBondContact O-N 2.96Å; L361-N365 PolarHBondContact O-OD1 3.22Å; K362-N365 PolarHBondContact O-N 3.24Å; N365-E368 PolarHBondContact O-N 2.97Å; N365-S369 PolarHBondContact O-N 3.11Å
366	K	80.1	Confident	70.1	Confident	126 Å²	126	83.5 Å²	83.5	55%	0.548	43%	0.427	S	S	.	.	H	α-helix	trans	-63.1	-47.9	172.5	-76.4	175	-177.8	176.3	0	111.2	K362 D363 L364 E368 S369 H370	K362-K366 WeakPolarHBondContact O-CG 3.48Å; K362-K366 PolarHBondContact O-N 2.98Å; D363-K366 PolarHBondContact O-N 2.79Å; L364-K366 VanDerWaalsContact C-N 3.31Å; L364-K366 PolarHBondContact O-N 3.03Å; K366-E368 VanDerWaalsContact C-N 3.3Å; K366-E368 PolarHBondContact O-N 3.28Å; K366-S369 PolarHBondContact O-N 3.26Å; K366-S369 VanDerWaalsContact O-N 3.16Å; K366-S369 PolarHBondContact O-OG 3.13Å; K366-H370 PolarHBondContact O-CD2 3Å; K366-H370 PolarHBondContact O-N 2.64Å; K366-H370 VanDerWaalsContact O-N 3.17Å
367	K	74.7	Confident	67.3	Low	126 Å²	126	87 Å²	87	55%	0.548	44%	0.443	S	S	.	.	H	α-helix	trans	-59.3	-41.5	176.2	-73.6	176.8	179.1	-177.1	0	111.6	I29 D363 L364 H370 I371	I29-K367 HydrophobicContact CD1-CB 4Å; D363-K367 WeakPolarHBondContact O-CG 3.26Å; D363-K367 PolarHBondContact O-N 3.36Å; L364-K367 PolarHBondContact O-N 3.42Å; L364-K367 VanDerWaalsContact O-N 3.15Å; K367-H370 PolarHBondContact O-N 2.64Å; K367-I371 WeakPolarHBondContact O-CD1 3.05Å; K367-I371 VanDerWaalsContact O-CG1 3.3Å; K367-I371 WeakPolarHBondContact O-CG1 3.43Å; K367-I371 PolarHBondContact O-N 3.16Å; K367-I371 VanDerWaalsContact O-N 3.12Å
368	E	64.6	Low	65	Low	55 Å²	55	95.2 Å²	95.2	26%	0.257	47%	0.474	S	S	.	.	H	α-helix	trans	-62.6	-40.2	174.4	-73.8	-171.4	164.9	0	0	112.8	I29 L364 N365 K366 H370 I371 G372 Y375	I29-E368 HydrophobicContact CD1-CG 4.02Å; L364-E368 PolarHBondContact O-N 3.46Å; N365-E368 PolarHBondContact O-N 2.97Å; K366-E368 VanDerWaalsContact C-N 3.3Å; K366-E368 PolarHBondContact O-N 3.28Å; E368-H370 VanDerWaalsContact C-N 3.27Å; E368-H370 PolarHBondContact O-N 3.23Å; E368-I371 PolarHBondContact O-N 3.34Å; E368-G372 PolarHBondContact O-N 3.27Å; E368-G372 VanDerWaalsContact O-N 3.14Å; E368-Y375 PolarHBondContact OE1-OH 2.76Å
369	S	60.8	Low	62.4	Low	90 Å²	90	101.5 Å²	101.5	63%	0.629	50%	0.502	S	S	*	.	H	α-helix	trans	-64.2	-31.3	177.5	71.7	0	0	0	0	113.2	N365 K366	N365-S369 PolarHBondContact O-N 3.11Å; K366-S369 PolarHBondContact O-N 3.26Å; K366-S369 VanDerWaalsContact O-N 3.16Å; K366-S369 PolarHBondContact O-OG 3.13Å
370	H	55.1	Low	60.1	Low	165 Å²	165	103 Å²	103	76%	0.764	52%	0.517	S	S	*	.	H	α-helix	trans	-80	-27.8	176.1	-75.5	-70.5	0	0	0	113.6	K366 K367 E368	K366-H370 PolarHBondContact O-CD2 3Å; K366-H370 PolarHBondContact O-N 2.64Å; K366-H370 VanDerWaalsContact O-N 3.17Å; K367-H370 PolarHBondContact O-N 2.64Å; E368-H370 VanDerWaalsContact C-N 3.27Å; E368-H370 PolarHBondContact O-N 3.23Å
371	I	54.3	Low	58.4	Low	81 Å²	81	104.7 Å²	104.7	42%	0.415	53%	0.527	S	S	.	.	H	α-helix	trans	-93.6	-9	-175	-64.9	166.5	0	0	0	112	I27 K367 E368	I27-I371 HydrophobicContact CB-CD1 4.37Å; K367-I371 WeakPolarHBondContact O-CD1 3.05Å; K367-I371 VanDerWaalsContact O-CG1 3.3Å; K367-I371 WeakPolarHBondContact O-CG1 3.43Å; K367-I371 PolarHBondContact O-N 3.16Å; K367-I371 VanDerWaalsContact O-N 3.12Å; E368-I371 PolarHBondContact O-N 3.34Å
372	G	42.7	Very low	56.2	Low	43 Å²	43	106.6 Å²	106.6	44%	0.443	54%	0.542	S	S	.	.			trans	72.1	151.4	-170.5	0	0	0	0	0	110.6	E368 S374	E368-G372 PolarHBondContact O-N 3.27Å; E368-G372 VanDerWaalsContact O-N 3.14Å; G372-S374 PolarHBondContact O-N 3.42Å
373	K	40.1	Very low	54.5	Low	196 Å²	196	106.9 Å²	106.9	85%	0.852	55%	0.548	S	S	*	.			trans	-67.2	77	-178.8	-70.2	-179.3	177.9	177.8	0	111	Y375	K373-Y375 PolarHBondContact O-N 3Å; K373-Y375 VanDerWaalsContact O-N 3.09Å
374	S	40.2	Very low	52.7	Low	88 Å²	88	106 Å²	106	62%	0.615	55%	0.548	S	S	*	.			trans	-86.7	57.6	171.1	-134.3	0	0	0	0	109.7	G372 V376	G372-S374 PolarHBondContact O-N 3.42Å; S374-V376 PolarHBondContact O-N 3.44Å
375	Y	44.9	Very low	51.1	Low	90 Å²	90	110 Å²	110	35%	0.353	57%	0.567	S	S	.	*			trans	-78.6	104.4	151.5	-69.2	-80.8	0	0	0	104.6	V330 E368 K373 H377	V330-Y375 HydrophobicContact CG2-CE1 3.8Å; E368-Y375 PolarHBondContact OE1-OH 2.76Å; K373-Y375 PolarHBondContact O-N 3Å; K373-Y375 VanDerWaalsContact O-N 3.09Å; Y375-H377 PolarHBondContact O-N 3.29Å
376	V	38	Very low	49.8	Very low	102 Å²	102	111.1 Å²	111.1	62%	0.618	57%	0.565	S	S	*	*			trans	-57.9	98.2	153.9	178.4	0	0	0	0	104.3	S374 R378	S374-V376 PolarHBondContact O-N 3.44Å; V376-R378 HydrophobicContact CG1-CG 4.31Å; V376-R378 PolarHBondContact O-N 3.19Å
377	H	30.9	Very low	48.3	Very low	171 Å²	171	110.6 Å²	110.6	79%	0.792	56%	0.563	S	S	*	*			trans	-60.1	85.1	163.4	-104.5	-64.5	0	0	0	105.2	Y375 Q379	Y375-H377 PolarHBondContact O-N 3.29Å; H377-Q379 VanDerWaalsContact C-N 3.29Å; H377-Q379 PolarHBondContact O-N 3.28Å
378	R	40.6	Very low	47.2	Very low	172 Å²	172	108 Å²	108	65%	0.649	55%	0.554	S	S	*	*			trans	-63.1	107.6	153.9	-84.5	-163.5	-178	-176.1	-2.2	103.9	Y328 V376	Y328-R378 HydrophobicContact CE2-CB 3.76Å; Y328-R378 WeakPolarHBondContact OH-CD 3.33Å; V376-R378 HydrophobicContact CG1-CG 4.31Å; V376-R378 PolarHBondContact O-N 3.19Å
379	Q	36	Very low	46.6	Very low	166 Å²	166	109.2 Å²	109.2	78%	0.776	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-49.9	138.1	165.3	-67.4	-172.4	1.8	0	0	107.3	H377 I381	H377-Q379 VanDerWaalsContact C-N 3.29Å; H377-Q379 PolarHBondContact O-N 3.28Å; Q379-I381 PolarHBondContact O-N 2.97Å
380	P	43.9	Very low	46.3	Very low	117 Å²	117	108.4 Å²	108.4	76%	0.76	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-54.3	121.5	173.6	23.4	-32	0	0	0	107.5	S382	P380-S382 PolarHBondContact O-N 3.13Å
381	I	52	Low	46.1	Very low	88 Å²	88	105 Å²	105	45%	0.451	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-46.8	127.2	176.3	-65	162.7	0	0	0	107.9	Q379 E385 R386	Q379-I381 PolarHBondContact O-N 2.97Å; I381-E385 HydrophobicContact CG2-CB 3.53Å; I381-R386 HydrophobicContact CG2-CB 4.31Å
382	S	41.3	Very low	45.9	Very low	60 Å²	60	107.4 Å²	107.4	42%	0.42	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-54.1	147.2	-177.3	169.7	0	0	0	0	111.3	P380 S384 E385 R386	P380-S382 PolarHBondContact O-N 3.13Å; S382-S384 PolarHBondContact O-N 3.33Å; S382-S384 PolarHBondContact OG-OG 3.45Å; S382-E385 CarbonylContact O-C 3.27Å; S382-E385 WeakPolarHBondContact O-CA 3.42Å; S382-E385 WeakPolarHBondContact O-CB 3.18Å; S382-E385 PolarHBondContact O-N 2.89Å; S382-R386 PolarHBondContact O-N 3.29Å
383	I	51.5	Low	46.5	Very low	129 Å²	129	108 Å²	108	66%	0.662	54%	0.543	S	S	*	.	H	α-helix	trans	-51.8	-42.7	-177	-62.8	166.6	0	0	0	111.4	F387	I383-F387 PolarHBondContact O-N 3.25Å; I383-F387 VanDerWaalsContact O-N 3.17Å
384	S	49.7	Very low	47	Very low	64 Å²	64	101.7 Å²	101.7	45%	0.448	52%	0.52	S	S	.	.	H	α-helix	trans	-68.7	-42	177.5	58.3	0	0	0	0	110.9	S382 R386 F387 I388	S382-S384 PolarHBondContact O-N 3.33Å; S382-S384 PolarHBondContact OG-OG 3.45Å; S384-R386 PolarHBondContact O-N 3.04Å; S384-F387 PolarHBondContact O-N 3.41Å; S384-I388 WeakPolarHBondContact O-CA 3.33Å; S384-I388 WeakPolarHBondContact O-CB 3.28Å; S384-I388 WeakPolarHBondContact O-CD1 3.03Å; S384-I388 WeakPolarHBondContact O-CG1 3.23Å; S384-I388 PolarHBondContact O-N 3.44Å
385	E	50.2	Low	47.3	Very low	102 Å²	102	105.1 Å²	105.1	48%	0.477	52%	0.524	S	S	.	.	H	α-helix	trans	-66	-35.8	177.1	-72.4	179.1	160.6	0	0	112.6	I381 S382 N389	I381-E385 HydrophobicContact CG2-CB 3.53Å; S382-E385 CarbonylContact O-C 3.27Å; S382-E385 WeakPolarHBondContact O-CA 3.42Å; S382-E385 WeakPolarHBondContact O-CB 3.18Å; S382-E385 PolarHBondContact O-N 2.89Å; E385-N389 WeakPolarHBondContact O-CA 3.49Å; E385-N389 WeakPolarHBondContact O-CB 3.33Å; E385-N389 PolarHBondContact O-N 2.61Å; E385-N389 PolarHBondContact O-ND2 2.8Å; E385-N389 VanDerWaalsContact O-ND2 3.13Å; E385-N389 PolarHBondContact O-OD1 3.19Å
386	R	54.1	Low	47.4	Very low	102 Å²	102	109 Å²	109	39%	0.385	54%	0.543	S	S	.	.	H	α-helix	trans	-68.7	-40.9	175.5	-138.1	-177.7	-156.6	-159.3	8.5	111.3	I381 S382 S384 L390	I381-R386 HydrophobicContact CG2-CB 4.31Å; S382-R386 PolarHBondContact O-N 3.29Å; S384-R386 PolarHBondContact O-N 3.04Å; R386-L390 VanDerWaalsContact O-CB 3.29Å; R386-L390 WeakPolarHBondContact O-CB 3.46Å; R386-L390 WeakPolarHBondContact O-CD1 3.23Å; R386-L390 WeakPolarHBondContact O-CG 3.19Å; R386-L390 PolarHBondContact O-N 3.4Å
387	F	48.1	Very low	48.1	Very low	115 Å²	115	105.5 Å²	105.5	50%	0.504	52%	0.523	S	S	.	.	H	α-helix	trans	-71.7	-42	177.5	-148.7	-100.2	0	0	0	111.6	I383 S384 L390 L391	I383-F387 PolarHBondContact O-N 3.25Å; I383-F387 VanDerWaalsContact O-N 3.17Å; S384-F387 PolarHBondContact O-N 3.41Å; F387-L390 PolarHBondContact O-N 3.1Å; F387-L391 HydrophobicContact CD1-CD1 3.38Å; F387-L391 HydrophobicContact CD1-CG 4.44Å; F387-L391 HydrophobicContact CE1-CD1 3.59Å; F387-L391 HydrophobicContact CG-CD1 4.43Å; F387-L391 VanDerWaalsContact O-CB 3.29Å; F387-L391 WeakPolarHBondContact O-CB 3.24Å; F387-L391 WeakPolarHBondContact O-CD1 3.4Å; F387-L391 PolarHBondContact O-N 3.29Å
388	I	51.6	Low	48.9	Very low	72 Å²	72	102.1 Å²	102.1	37%	0.369	51%	0.51	S	S	.	.	H	α-helix	trans	-66.2	-38.2	173.7	-70.1	166.1	0	0	0	110.1	S384 L391 K392	S384-I388 WeakPolarHBondContact O-CA 3.33Å; S384-I388 WeakPolarHBondContact O-CB 3.28Å; S384-I388 WeakPolarHBondContact O-CD1 3.03Å; S384-I388 WeakPolarHBondContact O-CG1 3.23Å; S384-I388 PolarHBondContact O-N 3.44Å; I388-L391 CarbonylContact O-C 3.56Å; I388-L391 PolarHBondContact O-N 3.07Å; I388-K392 HydrophobicContact CG2-CD 3.58Å; I388-K392 HydrophobicContact CG2-CG 3.96Å; I388-K392 WeakPolarHBondContact O-CA 3.47Å; I388-K392 WeakPolarHBondContact O-CB 3.26Å; I388-K392 WeakPolarHBondContact O-CG 3.47Å; I388-K392 PolarHBondContact O-N 3.46Å
389	N	53	Low	49.1	Very low	80 Å²	80	99.1 Å²	99.1	43%	0.428	51%	0.514	S	S	.	.	H	α-helix	trans	-73.7	-32.7	175.1	-70.2	-19	0	0	0	111.3	E385 S393	E385-N389 WeakPolarHBondContact O-CA 3.49Å; E385-N389 WeakPolarHBondContact O-CB 3.33Å; E385-N389 PolarHBondContact O-N 2.61Å; E385-N389 PolarHBondContact O-ND2 2.8Å; E385-N389 VanDerWaalsContact O-ND2 3.13Å; E385-N389 PolarHBondContact O-OD1 3.19Å; N389-S393 VanDerWaalsContact O-CA 3.3Å; N389-S393 WeakPolarHBondContact O-CA 3.42Å; N389-S393 WeakPolarHBondContact O-CB 3.49Å; N389-S393 PolarHBondContact O-N 3.23Å
390	L	53.6	Low	49.9	Very low	74 Å²	74	94.1 Å²	94.1	39%	0.387	50%	0.497	S	S	.	.	H	α-helix	trans	-65.5	-43.5	168	-91.2	152.6	0	0	0	111.2	R386 F387 T394	R386-L390 VanDerWaalsContact O-CB 3.29Å; R386-L390 WeakPolarHBondContact O-CB 3.46Å; R386-L390 WeakPolarHBondContact O-CD1 3.23Å; R386-L390 WeakPolarHBondContact O-CG 3.19Å; R386-L390 PolarHBondContact O-N 3.4Å; F387-L390 PolarHBondContact O-N 3.1Å; L390-T394 WeakPolarHBondContact O-CB 3.36Å; L390-T394 VanDerWaalsContact O-CG2 3.23Å; L390-T394 WeakPolarHBondContact O-CG2 3.45Å; L390-T394 PolarHBondContact O-N 2.87Å; L390-T394 PolarHBondContact O-OG1 2.98Å; L390-T394 VanDerWaalsContact O-OG1 3.05Å
391	L	50.6	Low	51.4	Low	94 Å²	94	91.1 Å²	91.1	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-72.2	-34.4	177.6	-85.7	154.2	0	0	0	113.4	F387 I388 T394 K395	F387-L391 HydrophobicContact CD1-CD1 3.38Å; F387-L391 HydrophobicContact CD1-CG 4.44Å; F387-L391 HydrophobicContact CE1-CD1 3.59Å; F387-L391 HydrophobicContact CG-CD1 4.43Å; F387-L391 VanDerWaalsContact O-CB 3.29Å; F387-L391 WeakPolarHBondContact O-CB 3.24Å; F387-L391 WeakPolarHBondContact O-CD1 3.4Å; F387-L391 PolarHBondContact O-N 3.29Å; I388-L391 CarbonylContact O-C 3.56Å; I388-L391 PolarHBondContact O-N 3.07Å; L391-T394 VanDerWaalsContact C-OG1 3.28Å; L391-T394 WeakPolarHBondContact CA-OG1 3.18Å; L391-T394 PolarHBondContact O-OG1 3.14Å; L391-K395 WeakPolarHBondContact O-CB 3.37Å; L391-K395 PolarHBondContact O-N 3.02Å
392	K	50.4	Low	52.8	Low	131 Å²	131	92.7 Å²	92.7	57%	0.57	49%	0.492	S	S	*	.	H	α-helix	trans	-78.5	-35.8	174.4	-75.7	179.6	-179.1	173.4	0	110.6	I388 K395 K396	I388-K392 HydrophobicContact CG2-CD 3.58Å; I388-K392 HydrophobicContact CG2-CG 3.96Å; I388-K392 WeakPolarHBondContact O-CA 3.47Å; I388-K392 WeakPolarHBondContact O-CB 3.26Å; I388-K392 WeakPolarHBondContact O-CG 3.47Å; I388-K392 PolarHBondContact O-N 3.46Å; K392-K395 CarbonylContact O-C 3.6Å; K392-K395 PolarHBondContact O-N 2.97Å; K392-K396 VanDerWaalsContact O-CB 3.28Å; K392-K396 WeakPolarHBondContact O-CB 3.43Å; K392-K396 PolarHBondContact O-N 3.27Å
393	S	55.5	Low	54.7	Low	56 Å²	56	91.6 Å²	91.6	39%	0.392	48%	0.481	S	S	.	.	H	α-helix	trans	-69	-37.3	170.8	-178.9	0	0	0	0	110.2	N389 K396 S397	N389-S393 VanDerWaalsContact O-CA 3.3Å; N389-S393 WeakPolarHBondContact O-CA 3.42Å; N389-S393 WeakPolarHBondContact O-CB 3.49Å; N389-S393 PolarHBondContact O-N 3.23Å; S393-K396 PolarHBondContact O-N 2.98Å; S393-S397 WeakPolarHBondContact O-CA 3.31Å; S393-S397 WeakPolarHBondContact O-CB 3.29Å; S393-S397 PolarHBondContact O-N 2.84Å
394	T	50.5	Low	56.3	Low	62 Å²	62	87.2 Å²	87.2	38%	0.38	46%	0.459	S	S	.	.	H	α-helix	trans	-65.5	-44.7	168.3	54	0	0	0	0	110	L390 L391 K396 S397 I398	L390-T394 WeakPolarHBondContact O-CB 3.36Å; L390-T394 VanDerWaalsContact O-CG2 3.23Å; L390-T394 WeakPolarHBondContact O-CG2 3.45Å; L390-T394 PolarHBondContact O-N 2.87Å; L390-T394 PolarHBondContact O-OG1 2.98Å; L390-T394 VanDerWaalsContact O-OG1 3.05Å; L391-T394 VanDerWaalsContact C-OG1 3.28Å; L391-T394 WeakPolarHBondContact CA-OG1 3.18Å; L391-T394 PolarHBondContact O-OG1 3.14Å; T394-K396 PolarHBondContact O-N 3.09Å; T394-S397 PolarHBondContact O-N 3.25Å; T394-I398 WeakPolarHBondContact O-CA 3.28Å; T394-I398 WeakPolarHBondContact O-CB 3.48Å; T394-I398 WeakPolarHBondContact O-CD1 3.39Å; T394-I398 WeakPolarHBondContact O-CG1 3.44Å; T394-I398 PolarHBondContact O-N 3.41Å
395	K	46.6	Very low	58.3	Low	160 Å²	160	89.3 Å²	89.3	70%	0.696	46%	0.46	S	S	*	.	H	α-helix	trans	-58.6	-38	173.1	-97.3	-176.7	172.8	-178	0	114.5	L391 K392 I398 C399	L391-K395 WeakPolarHBondContact O-CB 3.37Å; L391-K395 PolarHBondContact O-N 3.02Å; K392-K395 CarbonylContact O-C 3.6Å; K392-K395 PolarHBondContact O-N 2.97Å; K395-I398 WeakPolarHBondContact O-CB 3.5Å; K395-C399 PolarHBondContact O-N 2.99Å
396	K	46.7	Very low	60.3	Low	171 Å²	171	85 Å²	85	74%	0.743	44%	0.441	S	S	*	.	H	α-helix	trans	-84.8	-32	-179.4	-161.6	176.5	-177.2	-177.2	0	112.5	K392 S393 T394 I398 C399	K392-K396 VanDerWaalsContact O-CB 3.28Å; K392-K396 WeakPolarHBondContact O-CB 3.43Å; K392-K396 PolarHBondContact O-N 3.27Å; S393-K396 PolarHBondContact O-N 2.98Å; T394-K396 PolarHBondContact O-N 3.09Å; K396-I398 VanDerWaalsContact C-N 3.26Å; K396-C399 WeakPolarHBondContact O-CB 3.44Å; K396-C399 PolarHBondContact O-N 3.07Å; K396-C399 VanDerWaalsContact O-N 3.12Å
397	S	52.9	Low	62.1	Low	30 Å²	30	82.2 Å²	82.2	21%	0.21	43%	0.434	C	S	.	.	H	α-helix	trans	-66.9	-31.7	166.8	-174.9	0	0	0	0	110.5	S393 T394 C399 C400 N404 M526	S393-S397 WeakPolarHBondContact O-CA 3.31Å; S393-S397 WeakPolarHBondContact O-CB 3.29Å; S393-S397 PolarHBondContact O-N 2.84Å; T394-S397 PolarHBondContact O-N 3.25Å; S397-C399 PolarHBondContact O-N 3.27Å; S397-C400 PolarHBondContact O-N 3.4Å; S397-N404 PolarHBondContact O-OD1 2.91Å; S397-M526 VanDerWaalsContact OG-CE 3.3Å; S397-M526 WeakPolarHBondContact OG-CE 3.34Å
398	I	47.9	Very low	64.3	Low	99 Å²	99	81.7 Å²	81.7	51%	0.508	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-24.8	171.1	-73.7	159.8	0	0	0	111.2	T394 K395 K396 N404	T394-I398 WeakPolarHBondContact O-CA 3.28Å; T394-I398 WeakPolarHBondContact O-CB 3.48Å; T394-I398 WeakPolarHBondContact O-CD1 3.39Å; T394-I398 WeakPolarHBondContact O-CG1 3.44Å; T394-I398 PolarHBondContact O-N 3.41Å; K395-I398 WeakPolarHBondContact O-CB 3.5Å; K396-I398 VanDerWaalsContact C-N 3.26Å; I398-N404 VanDerWaalsContact CA-ND2 3.28Å; I398-N404 WeakPolarHBondContact CA-ND2 3.38Å; I398-N404 WeakPolarHBondContact CA-OD1 3.43Å; I398-N404 PolarHBondContact O-ND2 3.28Å
399	C	44.2	Very low	66.4	Low	109 Å²	109	79.1 Å²	79.1	74%	0.736	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-20.5	176.9	-86.6	0	0	0	0	114.4	K395 K396 S397 G401	K395-C399 PolarHBondContact O-N 2.99Å; K396-C399 WeakPolarHBondContact O-CB 3.44Å; K396-C399 PolarHBondContact O-N 3.07Å; K396-C399 VanDerWaalsContact O-N 3.12Å; S397-C399 PolarHBondContact O-N 3.27Å; C399-G401 PolarHBondContact O-N 2.88Å; C399-G401 VanDerWaalsContact O-N 3.16Å
400	C	54.4	Low	68.4	Low	62 Å²	62	75.5 Å²	75.5	42%	0.419	40%	0.403	S	S	.	.			trans	-86.2	90	175.6	-154.9	0	0	0	0	108.9	S397 Q402 M403 N404	S397-C400 PolarHBondContact O-N 3.4Å; C400-Q402 PolarHBondContact O-N 3.26Å; C400-M403 HydrophobicContact CB-CB 4.24Å; C400-M403 HydrophobicContact CB-CG 3.94Å; C400-M403 HydrophobicContact CB-SD 4.13Å; C400-M403 PolarHBondContact O-N 3.27Å; C400-N404 PolarHBondContact O-N 2.93Å
401	G	75.5	Confident	70.5	Confident	54 Å²	54	73.2 Å²	73.2	56%	0.557	39%	0.392	S	S	*	.	H	α-helix	trans	-50.3	-31.9	-174.1	0	0	0	0	0	114.5	C399 K405	C399-G401 PolarHBondContact O-N 2.88Å; C399-G401 VanDerWaalsContact O-N 3.16Å; G401-K405 WeakPolarHBondContact O-CB 3.5Å; G401-K405 PolarHBondContact O-N 3.45Å; G401-K405 VanDerWaalsContact O-N 3.12Å
402	Q	79.7	Confident	72.7	Confident	120 Å²	120	71.5 Å²	71.5	56%	0.561	38%	0.383	S	S	*	.	H	α-helix	trans	-69.3	-38.7	176.4	-173.7	62.1	14.2	0	0	113.5	C400 T406	C400-Q402 PolarHBondContact O-N 3.26Å; Q402-T406 PolarHBondContact O-N 3.45Å; Q402-T406 VanDerWaalsContact O-N 3.1Å; Q402-T406 PolarHBondContact O-OG1 2.79Å
403	M	82.4	Confident	74.9	Confident	38 Å²	38	65.2 Å²	65.2	19%	0.187	36%	0.355	C	S	.	.	H	α-helix	trans	-72	-39.1	179.8	-60.3	-169.7	87.5	0	0	111.1	C400 T406 L407 P523 M526	C400-M403 HydrophobicContact CB-CB 4.24Å; C400-M403 HydrophobicContact CB-CG 3.94Å; C400-M403 HydrophobicContact CB-SD 4.13Å; C400-M403 PolarHBondContact O-N 3.27Å; M403-T406 WeakPolarHBondContact O-CB 3.35Å; M403-T406 PolarHBondContact O-N 2.92Å; M403-L407 WeakPolarHBondContact O-CB 3.32Å; M403-L407 PolarHBondContact O-N 2.97Å; M403-P523 HydrophobicContact CE-CG 3.73Å; M403-M526 HydrophobicContact CE-CE 3.63Å; M403-M526 HydrophobicContact CE-CG 4.5Å; M403-M526 HydrophobicContact CE-SD 3.26Å; M403-M526 WeakPolarHBondContact CE-SD 3.44Å; M403-M526 HydrophobicContact SD-CE 3.99Å; M403-M526 HydrophobicContact SD-SD 4.32Å
404	N	85.6	Confident	76.9	Confident	37 Å²	37	63.3 Å²	63.3	20%	0.198	34%	0.34	C	S	.	.	H	α-helix	trans	-62.5	-44.6	173.4	-76.7	-6.3	0	0	0	112.3	S397 I398 C400 T406 L407 I408	S397-N404 PolarHBondContact O-OD1 2.91Å; I398-N404 VanDerWaalsContact CA-ND2 3.28Å; I398-N404 WeakPolarHBondContact CA-ND2 3.38Å; I398-N404 WeakPolarHBondContact CA-OD1 3.43Å; I398-N404 PolarHBondContact O-ND2 3.28Å; C400-N404 PolarHBondContact O-N 2.93Å; N404-T406 VanDerWaalsContact C-N 3.26Å; N404-T406 PolarHBondContact O-N 3.15Å; N404-L407 PolarHBondContact O-N 3.35Å; N404-I408 VanDerWaalsContact O-CG1 3.31Å; N404-I408 WeakPolarHBondContact O-CG1 3.29Å; N404-I408 PolarHBondContact O-N 3.48Å
405	K	90.3	Very high	79.2	Confident	107 Å²	107	62.6 Å²	62.6	47%	0.465	33%	0.333	S	S	.	.	H	α-helix	trans	-56.9	-45.1	176.1	-176.8	-179.2	177.4	-177.8	0	110.7	G401 I408 I409	G401-K405 WeakPolarHBondContact O-CB 3.5Å; G401-K405 PolarHBondContact O-N 3.45Å; G401-K405 VanDerWaalsContact O-N 3.12Å; K405-I408 PolarHBondContact O-N 3.14Å; K405-I409 HydrophobicContact CG-CD1 3.95Å; K405-I409 VanDerWaalsContact O-CG1 3.28Å; K405-I409 WeakPolarHBondContact O-CG1 3.25Å; K405-I409 PolarHBondContact O-N 3.29Å
406	T	92.2	Very high	81.7	Confident	13 Å²	13	55.6 Å²	55.6	8%	0.08	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-44.7	176.7	-56.3	0	0	0	0	111.6	Q402 M403 N404 I409 C410 L521 F522 L578	Q402-T406 PolarHBondContact O-N 3.45Å; Q402-T406 VanDerWaalsContact O-N 3.1Å; Q402-T406 PolarHBondContact O-OG1 2.79Å; M403-T406 WeakPolarHBondContact O-CB 3.35Å; M403-T406 PolarHBondContact O-N 2.92Å; N404-T406 VanDerWaalsContact C-N 3.26Å; N404-T406 PolarHBondContact O-N 3.15Å; T406-I409 PolarHBondContact O-N 3.04Å; T406-C410 WeakPolarHBondContact O-CB 3.36Å; T406-C410 PolarHBondContact O-N 3.22Å; T406-C410 PolarHBondContact O-SG 2.7Å; T406-L521 HydrophobicContact CG2-CB 3.9Å; T406-L521 HydrophobicContact CG2-CD1 4.17Å; T406-L521 HydrophobicContact CG2-CD2 4.47Å; T406-L521 HydrophobicContact CG2-CG 4.41Å; T406-F522 HydrophobicContact CG2-CE1 4.2Å; T406-F522 HydrophobicContact CG2-CZ 4.09Å; T406-L578 HydrophobicContact CG2-CD2 3.94Å
407	L	93.1	Very high	84.1	Confident	43 Å²	43	48 Å²	48	23%	0.225	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-46.1	177.2	-177.6	66.1	0	0	0	112.6	M403 N404 C410 V411 F522 A530	M403-L407 WeakPolarHBondContact O-CB 3.32Å; M403-L407 PolarHBondContact O-N 2.97Å; N404-L407 PolarHBondContact O-N 3.35Å; L407-C410 WeakPolarHBondContact O-CB 3.24Å; L407-C410 PolarHBondContact O-N 2.99Å; L407-V411 VanDerWaalsContact O-CG2 3.27Å; L407-V411 WeakPolarHBondContact O-CG2 3.28Å; L407-V411 PolarHBondContact O-N 3.43Å; L407-F522 HydrophobicContact CB-CE1 4.23Å; L407-F522 HydrophobicContact CB-CZ 4.24Å; L407-F522 HydrophobicContact CD1-CE1 4.42Å; L407-F522 HydrophobicContact CD1-CZ 4.04Å; L407-A530 HydrophobicContact CD1-CB 4.2Å
408	I	94.5	Very high	86.2	Confident	104 Å²	104	46.8 Å²	46.8	53%	0.533	26%	0.262	S	S	.	.	H	α-helix	trans	-61.8	-46.6	178.9	-68.2	166.6	0	0	0	110.3	N404 K405 C410 V411 L412	N404-I408 VanDerWaalsContact O-CG1 3.31Å; N404-I408 WeakPolarHBondContact O-CG1 3.29Å; N404-I408 PolarHBondContact O-N 3.48Å; K405-I408 PolarHBondContact O-N 3.14Å; I408-C410 VanDerWaalsContact C-N 3.33Å; I408-C410 PolarHBondContact O-N 3.04Å; I408-V411 PolarHBondContact O-N 2.85Å; I408-L412 HydrophobicContact CG2-CD1 4.29Å; I408-L412 WeakPolarHBondContact O-CG 3.48Å; I408-L412 PolarHBondContact O-N 3.1Å
409	I	95.5	Very high	88.6	Confident	17 Å²	17	42.9 Å²	42.9	9%	0.087	24%	0.242	C	C	.	.	H	α-helix	trans	-63.7	-40.3	177.5	-63.8	167.9	0	0	0	110.6	K405 T406 L412 I413 L574 F577 L578	K405-I409 HydrophobicContact CG-CD1 3.95Å; K405-I409 VanDerWaalsContact O-CG1 3.28Å; K405-I409 WeakPolarHBondContact O-CG1 3.25Å; K405-I409 PolarHBondContact O-N 3.29Å; T406-I409 PolarHBondContact O-N 3.04Å; I409-L412 PolarHBondContact O-N 3.43Å; I409-I413 HydrophobicContact CG2-CD1 3.84Å; I409-I413 HydrophobicContact CG2-CG1 4.4Å; I409-I413 WeakPolarHBondContact O-CG1 3.4Å; I409-I413 PolarHBondContact O-N 3.02Å; I409-L574 HydrophobicContact CG2-CB 4.24Å; I409-F577 HydrophobicContact CD1-CB 3.97Å; I409-L578 HydrophobicContact CB-CD2 4.07Å; I409-L578 HydrophobicContact CB-CG 4.42Å; I409-L578 HydrophobicContact CD1-CD2 4.41Å; I409-L578 HydrophobicContact CG2-CD1 3.89Å; I409-L578 HydrophobicContact CG2-CD2 3.93Å; I409-L578 HydrophobicContact CG2-CG 3.72Å
410	C	95.2	Very high	91.1	Very high	4 Å²	4	37.7 Å²	37.7	3%	0.027	21%	0.206	C	C	.	.	H	α-helix	trans	-60.2	-46.5	174.3	-72.9	0	0	0	0	112	T406 L407 I408 L412 I413 F414 L521	T406-C410 WeakPolarHBondContact O-CB 3.36Å; T406-C410 PolarHBondContact O-N 3.22Å; T406-C410 PolarHBondContact O-SG 2.7Å; L407-C410 WeakPolarHBondContact O-CB 3.24Å; L407-C410 PolarHBondContact O-N 2.99Å; I408-C410 VanDerWaalsContact C-N 3.33Å; I408-C410 PolarHBondContact O-N 3.04Å; C410-L412 VanDerWaalsContact C-N 3.31Å; C410-L412 PolarHBondContact O-N 2.63Å; C410-I413 PolarHBondContact O-N 3.09Å; C410-F414 VanDerWaalsContact O-CD2 3.31Å; C410-F414 WeakPolarHBondContact O-CD2 3.26Å; C410-F414 PolarHBondContact O-N 3.18Å; C410-L521 VanDerWaalsContact SG-CD1 3.51Å
411	V	96.1	Very high	93.1	Very high	26 Å²	26	36 Å²	36	16%	0.158	19%	0.192	C	C	.	.	H	α-helix	trans	-57.4	-45.4	176.1	171.7	0	0	0	0	110.6	L407 I408 F414 M415 L537	L407-V411 VanDerWaalsContact O-CG2 3.27Å; L407-V411 WeakPolarHBondContact O-CG2 3.28Å; L407-V411 PolarHBondContact O-N 3.43Å; I408-V411 PolarHBondContact O-N 2.85Å; V411-F414 PolarHBondContact O-N 3.38Å; V411-M415 WeakPolarHBondContact O-CB 3.39Å; V411-M415 PolarHBondContact O-N 2.85Å; V411-L537 HydrophobicContact CG1-CB 3.76Å; V411-L537 HydrophobicContact CG1-CD1 4.33Å; V411-L537 HydrophobicContact CG2-CD1 4.33Å
412	L	97.5	Very high	94.1	Very high	58 Å²	58	33.6 Å²	33.6	30%	0.304	17%	0.167	S	C	.	.	H	α-helix	trans	-63.7	-41.7	178.2	-69.2	174.1	0	0	0	112.5	I408 I409 C410 M415 L416 L574	I408-L412 HydrophobicContact CG2-CD1 4.29Å; I408-L412 WeakPolarHBondContact O-CG 3.48Å; I408-L412 PolarHBondContact O-N 3.1Å; I409-L412 PolarHBondContact O-N 3.43Å; C410-L412 VanDerWaalsContact C-N 3.31Å; C410-L412 PolarHBondContact O-N 2.63Å; L412-M415 HydrophobicContact CD2-CE 4.16Å; L412-M415 WeakPolarHBondContact O-CB 3.49Å; L412-M415 PolarHBondContact O-N 3.44Å; L412-L416 VanDerWaalsContact O-CG 3.3Å; L412-L416 WeakPolarHBondContact O-CG 3.46Å; L412-L416 PolarHBondContact O-N 3.13Å; L412-L574 HydrophobicContact CB-CD1 3.81Å
413	I	97.6	Very high	94.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.7	-46	176.4	-67.6	165.7	0	0	0	110.5	I409 C410 M415 L416 H417 L514 L574 L575 L578	I409-I413 HydrophobicContact CG2-CD1 3.84Å; I409-I413 HydrophobicContact CG2-CG1 4.4Å; I409-I413 WeakPolarHBondContact O-CG1 3.4Å; I409-I413 PolarHBondContact O-N 3.02Å; C410-I413 PolarHBondContact O-N 3.09Å; I413-M415 PolarHBondContact O-N 3.22Å; I413-L416 PolarHBondContact O-N 3.3Å; I413-H417 WeakPolarHBondContact O-CB 3.07Å; I413-H417 PolarHBondContact O-N 2.97Å; I413-L514 HydrophobicContact CG2-CD1 3.66Å; I413-L514 HydrophobicContact CG2-CD2 3.91Å; I413-L514 HydrophobicContact CG2-CG 4.47Å; I413-L574 HydrophobicContact CD1-CB 4.14Å; I413-L574 HydrophobicContact CG1-CB 3.83Å; I413-L574 HydrophobicContact CG1-CD1 4.15Å; I413-L575 HydrophobicContact CD1-CD2 3.79Å; I413-L575 HydrophobicContact CD1-CG 4.03Å; I413-L578 HydrophobicContact CD1-CD1 3.54Å
414	F	97.4	Very high	95.6	Very high	15 Å²	15	26.3 Å²	26.3	7%	0.066	13%	0.132	C	C	.	.	H	α-helix	trans	-62.3	-33.7	174.8	-87.6	-75.8	0	0	0	112.3	C410 V411 S418 L514 S518 S534 N535	C410-F414 VanDerWaalsContact O-CD2 3.31Å; C410-F414 WeakPolarHBondContact O-CD2 3.26Å; C410-F414 PolarHBondContact O-N 3.18Å; V411-F414 PolarHBondContact O-N 3.38Å; F414-S418 WeakPolarHBondContact O-CB 3.45Å; F414-S418 PolarHBondContact O-N 2.7Å; F414-L514 HydrophobicContact CD1-CD2 3.77Å; F414-L514 HydrophobicContact CD1-CG 4.45Å; F414-L514 HydrophobicContact CD2-CD2 4.32Å; F414-L514 HydrophobicContact CE1-CD2 3.75Å; F414-L514 HydrophobicContact CE1-CG 3.99Å; F414-L514 HydrophobicContact CE2-CD2 4.32Å; F414-L514 HydrophobicContact CE2-CG 4.12Å; F414-L514 HydrophobicContact CG-CD2 4.07Å; F414-L514 HydrophobicContact CZ-CD2 4.04Å; F414-L514 HydrophobicContact CZ-CG 3.82Å; F414-S518 WeakPolarHBondContact CZ-OG 3.32Å; F414-S534 WeakPolarHBondContact CB-O 3.4Å; F414-N535 HydrophobicContact CD1-CB 4.3Å; F414-N535 HydrophobicContact CE1-CB 4.24Å
415	M	97.9	Very high	96	Very high	47 Å²	47	24.7 Å²	24.7	23%	0.232	12%	0.123	C	C	.	.	H	α-helix	trans	-61.8	-56.2	174.5	-168	-175.2	74.9	0	0	111.2	V411 L412 I413 H417 S418 L419 G538 I540 G541	V411-M415 WeakPolarHBondContact O-CB 3.39Å; V411-M415 PolarHBondContact O-N 2.85Å; L412-M415 HydrophobicContact CD2-CE 4.16Å; L412-M415 WeakPolarHBondContact O-CB 3.49Å; L412-M415 PolarHBondContact O-N 3.44Å; I413-M415 PolarHBondContact O-N 3.22Å; M415-H417 VanDerWaalsContact C-N 3.28Å; M415-H417 PolarHBondContact O-N 3.37Å; M415-S418 PolarHBondContact O-N 2.86Å; M415-L419 WeakPolarHBondContact O-CB 3.28Å; M415-L419 PolarHBondContact O-N 3.36Å; M415-G538 VanDerWaalsContact CA-O 3.29Å; M415-G538 WeakPolarHBondContact CA-O 3.19Å; M415-I540 HydrophobicContact CG-CB 4.37Å; M415-I540 HydrophobicContact SD-CB 4.42Å; M415-I540 HydrophobicContact SD-CG2 4.14Å; M415-G541 WeakPolarHBondContact O-CA 3.44Å
416	L	98.2	Very high	96.3	Very high	14 Å²	14	20 Å²	20	7%	0.073	10%	0.104	C	C	.	.	H	α-helix	trans	-64.4	-35.1	179.5	-62.1	162.1	0	0	0	111.8	L412 I413 L419 A420 F570 Q571 L574	L412-L416 VanDerWaalsContact O-CG 3.3Å; L412-L416 WeakPolarHBondContact O-CG 3.46Å; L412-L416 PolarHBondContact O-N 3.13Å; I413-L416 PolarHBondContact O-N 3.3Å; L416-L419 WeakPolarHBondContact O-CB 3.34Å; L416-L419 PolarHBondContact O-N 3.4Å; L416-A420 PolarHBondContact O-N 3.05Å; L416-A420 VanDerWaalsContact O-N 3.11Å; L416-F570 HydrophobicContact CD1-CB 4.44Å; L416-F570 HydrophobicContact CD1-CD1 3.37Å; L416-F570 HydrophobicContact CD1-CE1 3.95Å; L416-F570 HydrophobicContact CD1-CG 4.24Å; L416-F570 HydrophobicContact CD2-CD1 4.01Å; L416-F570 HydrophobicContact CG-CD1 4.31Å; L416-Q571 HydrophobicContact CB-CG 3.37Å; L416-Q571 VanDerWaalsContact CB-NE2 3.27Å; L416-Q571 HydrophobicContact CD1-CG 3.75Å; L416-Q571 HydrophobicContact CG-CG 4.22Å; L416-Q571 PolarHBondContact O-NE2 2.92Å; L416-L574 HydrophobicContact CD1-CD1 3.62Å
417	H	98.2	Very high	96.4	Very high	12 Å²	12	19.4 Å²	19.4	6%	0.056	10%	0.1	C	C	.	.	H	α-helix	trans	-63.5	-48.2	174.7	-177.6	97.8	0	0	0	111.2	I413 M415 L419 A420 F421 Y471 Y507 S510 T511 L514	I413-H417 WeakPolarHBondContact O-CB 3.07Å; I413-H417 PolarHBondContact O-N 2.97Å; M415-H417 VanDerWaalsContact C-N 3.28Å; M415-H417 PolarHBondContact O-N 3.37Å; H417-L419 VanDerWaalsContact C-N 3.29Å; H417-L419 PolarHBondContact O-N 2.86Å; H417-A420 PolarHBondContact O-N 3.31Å; H417-F421 VanDerWaalsContact O-CB 3.25Å; H417-F421 WeakPolarHBondContact O-CB 3.33Å; H417-F421 PolarHBondContact O-N 3.37Å; H417-Y471 AromaticContact ND1-CE1 3.84Å; H417-Y471 AromaticContact ND1-CZ 3.9Å; H417-Y471 PolarHBondContact ND1-OH 2.77Å; H417-Y507 AromaticContact CE1-CD1 3.78Å; H417-Y507 PolarHBondContact CE1-O 3.44Å; H417-Y507 AromaticContact ND1-CD1 3.75Å; H417-S510 PolarHBondContact CE1-OG 2.83Å; H417-S510 PolarHBondContact ND1-OG 3.42Å; H417-T511 PolarHBondContact CE1-N 3.5Å; H417-T511 PolarHBondContact CE1-OG1 3.49Å; H417-T511 PolarHBondContact NE2-OG1 3.02Å; H417-L514 HydrophobicContact CB-CD2 4.14Å
418	S	96.9	Very high	96.3	Very high	3 Å²	3	17.6 Å²	17.6	2%	0.021	9%	0.091	C	C	.	.	H	α-helix	trans	-65.6	-33.7	177.2	-168.7	0	0	0	0	112.1	F414 M415 L422 G538 R539 G542	F414-S418 WeakPolarHBondContact O-CB 3.45Å; F414-S418 PolarHBondContact O-N 2.7Å; M415-S418 PolarHBondContact O-N 2.86Å; S418-L422 VanDerWaalsContact O-CB 3.3Å; S418-L422 WeakPolarHBondContact O-CB 3.39Å; S418-L422 PolarHBondContact O-N 3.12Å; S418-L422 VanDerWaalsContact O-N 3.13Å; S418-L422 WeakPolarHBondContact OG-CD1 3.41Å; S418-G538 VanDerWaalsContact CB-O 3.23Å; S418-G538 WeakPolarHBondContact CB-O 3.47Å; S418-R539 PolarHBondContact OG-NH1 2.75Å; S418-G542 PolarHBondContact OG-N 3.06Å
419	L	97.9	Very high	96.1	Very high	17 Å²	17	13.9 Å²	13.9	9%	0.089	7%	0.071	C	C	.	.	H	α-helix	trans	-58	-54.2	174.6	172.7	64.8	0	0	0	111.1	M415 L416 H417 G423 G541 I544 S545 V548 Y564	M415-L419 WeakPolarHBondContact O-CB 3.28Å; M415-L419 PolarHBondContact O-N 3.36Å; L416-L419 WeakPolarHBondContact O-CB 3.34Å; L416-L419 PolarHBondContact O-N 3.4Å; H417-L419 VanDerWaalsContact C-N 3.29Å; H417-L419 PolarHBondContact O-N 2.86Å; L419-G423 VanDerWaalsContact O-CA 3.24Å; L419-G423 WeakPolarHBondContact O-CA 3.43Å; L419-G423 PolarHBondContact O-N 2.91Å; L419-G541 VanDerWaalsContact CA-O 3.25Å; L419-G541 WeakPolarHBondContact CA-O 3.38Å; L419-G541 WeakPolarHBondContact CB-O 3.47Å; L419-G541 VanDerWaalsContact CD1-O 3.3Å; L419-G541 WeakPolarHBondContact CD1-O 3.4Å; L419-I544 HydrophobicContact CD1-CB 4.1Å; L419-I544 HydrophobicContact CD1-CG2 3.84Å; L419-S545 WeakPolarHBondContact O-CB 3.46Å; L419-V548 HydrophobicContact CD1-CG2 4.17Å; L419-Y564 HydrophobicContact CD1-CE1 3.97Å; L419-Y564 HydrophobicContact CG-CD1 4.19Å; L419-Y564 HydrophobicContact CG-CE1 4.05Å; L419-Y564 WeakPolarHBondContact O-CE1 3.3Å
420	A	97.9	Very high	95.8	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-73.7	-46.8	-178.9	0	0	0	0	0	112.7	L416 H417 G423 I424 Y507 Y564	L416-A420 PolarHBondContact O-N 3.05Å; L416-A420 VanDerWaalsContact O-N 3.11Å; H417-A420 PolarHBondContact O-N 3.31Å; A420-G423 PolarHBondContact O-N 2.83Å; A420-I424 HydrophobicContact CB-CD1 4.48Å; A420-I424 WeakPolarHBondContact O-CB 3.47Å; A420-I424 WeakPolarHBondContact O-CD1 3.47Å; A420-I424 WeakPolarHBondContact O-CG1 3.32Å; A420-I424 PolarHBondContact O-N 3.33Å; A420-Y507 HydrophobicContact CB-CD1 4.45Å; A420-Y507 HydrophobicContact CB-CE1 3.68Å; A420-Y507 HydrophobicContact CB-CE2 3.76Å; A420-Y507 VanDerWaalsContact CB-OH 3.23Å; A420-Y507 WeakPolarHBondContact CB-OH 3.5Å; A420-Y564 HydrophobicContact CB-CD1 4.29Å; A420-Y564 HydrophobicContact CB-CG 4.42Å
421	F	96.6	Very high	95.6	Very high	27 Å²	27	14.3 Å²	14.3	12%	0.118	7%	0.072	C	C	.	.	H	α-helix	trans	-64.3	-49.3	-175.5	178.7	-104.4	0	0	0	112.8	H417 T425 L504 Y507	H417-F421 VanDerWaalsContact O-CB 3.25Å; H417-F421 WeakPolarHBondContact O-CB 3.33Å; H417-F421 PolarHBondContact O-N 3.37Å; F421-T425 WeakPolarHBondContact O-CB 3.41Å; F421-T425 PolarHBondContact O-N 2.68Å; F421-T425 PolarHBondContact O-OG1 3.03Å; F421-L504 HydrophobicContact CD2-CD1 3.56Å; F421-L504 HydrophobicContact CE2-CD1 3.61Å; F421-Y507 HydrophobicContact CB-CD1 4.41Å
422	L	95.6	Very high	95.2	Very high	4 Å²	4	17.1 Å²	17.1	2%	0.021	9%	0.086	C	C	.	.	H	α-helix	trans	-73.2	-35.6	175.9	-63.9	-177.3	0	0	0	111.1	V63 I190 S418 T425 L426	V63-L422 HydrophobicContact CG2-CD2 3.94Å; I190-L422 HydrophobicContact CD1-CD1 4.07Å; I190-L422 HydrophobicContact CG1-CD1 4.41Å; S418-L422 VanDerWaalsContact O-CB 3.3Å; S418-L422 WeakPolarHBondContact O-CB 3.39Å; S418-L422 PolarHBondContact O-N 3.12Å; S418-L422 VanDerWaalsContact O-N 3.13Å; S418-L422 WeakPolarHBondContact OG-CD1 3.41Å; L422-T425 PolarHBondContact O-N 3.32Å; L422-L426 WeakPolarHBondContact O-CB 3.33Å; L422-L426 VanDerWaalsContact O-CG 3.26Å; L422-L426 WeakPolarHBondContact O-CG 3.26Å; L422-L426 PolarHBondContact O-N 3.12Å
423	G	96.8	Very high	94.7	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-54.1	-59.3	174.4	0	0	0	0	0	112.6	L419 A420 T425 L426 F427 S545 N549 Y564	L419-G423 VanDerWaalsContact O-CA 3.24Å; L419-G423 WeakPolarHBondContact O-CA 3.43Å; L419-G423 PolarHBondContact O-N 2.91Å; A420-G423 PolarHBondContact O-N 2.83Å; G423-T425 VanDerWaalsContact C-N 3.32Å; G423-T425 PolarHBondContact O-N 3.49Å; G423-L426 PolarHBondContact O-N 3.07Å; G423-F427 VanDerWaalsContact O-CB 3.27Å; G423-F427 WeakPolarHBondContact O-CB 3.41Å; G423-F427 PolarHBondContact O-N 3.49Å; G423-S545 PolarHBondContact N-OG 3.36Å; G423-N549 PolarHBondContact O-ND2 3.21Å; G423-N549 PolarHBondContact O-OD1 3.02Å; G423-Y564 VanDerWaalsContact CA-CZ 3.48Å; G423-Y564 WeakPolarHBondContact CA-OH 3.4Å
424	I	96.7	Very high	94.4	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.021	10%	0.097	C	C	.	.	H	α-helix	trans	-60.3	-40.8	178.8	-63.4	162.2	0	0	0	111.3	A420 L426 F427 L478 C500 L504 Y507 Y564	A420-I424 HydrophobicContact CB-CD1 4.48Å; A420-I424 WeakPolarHBondContact O-CB 3.47Å; A420-I424 WeakPolarHBondContact O-CD1 3.47Å; A420-I424 WeakPolarHBondContact O-CG1 3.32Å; A420-I424 PolarHBondContact O-N 3.33Å; I424-L426 PolarHBondContact O-N 2.88Å; I424-F427 PolarHBondContact O-N 3.18Å; I424-L478 HydrophobicContact CD1-CD1 3.98Å; I424-L478 HydrophobicContact CD1-CD2 3.78Å; I424-L478 HydrophobicContact CG1-CD2 4.26Å; I424-C500 HydrophobicContact CG2-CB 4.03Å; I424-L504 HydrophobicContact CG2-CB 4.36Å; I424-L504 HydrophobicContact CG2-CD1 4.48Å; I424-Y507 HydrophobicContact CD1-CD2 4.19Å; I424-Y507 HydrophobicContact CD1-CE2 4.28Å; I424-Y564 HydrophobicContact CG1-CD2 3.8Å; I424-Y564 HydrophobicContact CG1-CE2 4.33Å; I424-Y564 HydrophobicContact CG1-CG 4.39Å
425	T	94.9	Very high	94.1	Very high	3 Å²	3	19.9 Å²	19.9	2%	0.018	10%	0.096	C	C	.	.	H	α-helix	trans	-63.7	-41.3	177.8	-60.4	0	0	0	0	112.2	T64 F421 L422 G423 S428	T64-T425 HydrophobicContact CG2-CG2 3.92Å; F421-T425 WeakPolarHBondContact O-CB 3.41Å; F421-T425 PolarHBondContact O-N 2.68Å; F421-T425 PolarHBondContact O-OG1 3.03Å; L422-T425 PolarHBondContact O-N 3.32Å; G423-T425 VanDerWaalsContact C-N 3.32Å; G423-T425 PolarHBondContact O-N 3.49Å; T425-S428 PolarHBondContact O-OG 3.19Å
426	L	95.2	Very high	93.9	Very high	10 Å²	10	19 Å²	19	5%	0.052	9%	0.09	C	C	.	.	H	α-helix	trans	-81.2	-21.3	179.6	-66.8	174.5	0	0	0	112.6	P66 V67 T186 L422 G423 I424 S428 K429 T546	P66-L426 HydrophobicContact CB-CD2 4.16Å; P66-L426 HydrophobicContact CG-CD2 4.29Å; V67-L426 HydrophobicContact CG2-CD2 4.14Å; T186-L426 HydrophobicContact CG2-CD1 3.92Å; L422-L426 WeakPolarHBondContact O-CB 3.33Å; L422-L426 VanDerWaalsContact O-CG 3.26Å; L422-L426 WeakPolarHBondContact O-CG 3.26Å; L422-L426 PolarHBondContact O-N 3.12Å; G423-L426 PolarHBondContact O-N 3.07Å; I424-L426 PolarHBondContact O-N 2.88Å; L426-S428 PolarHBondContact O-N 3.39Å; L426-K429 WeakPolarHBondContact O-CG 3.49Å; L426-T546 HydrophobicContact CD1-CG2 4.24Å
427	F	94.6	Very high	93.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-66.8	-18.5	176.4	-171.3	-106.4	0	0	0	112.4	G423 I424 K429 Y430 I431 L496 N549 D552 P560 V561	G423-F427 VanDerWaalsContact O-CB 3.27Å; G423-F427 WeakPolarHBondContact O-CB 3.41Å; G423-F427 PolarHBondContact O-N 3.49Å; I424-F427 PolarHBondContact O-N 3.18Å; F427-K429 PolarHBondContact O-N 2.87Å; F427-Y430 AromaticContact CD2-CD2 3.8Å; F427-Y430 HydrophobicContact CD2-CD2 3.8Å; F427-Y430 HydrophobicContact CD2-CG 4.39Å; F427-Y430 HydrophobicContact CE2-CD2 4.18Å; F427-Y430 HydrophobicContact CE2-CG 4.39Å; F427-Y430 WeakPolarHBondContact O-CB 2.95Å; F427-Y430 PolarHBondContact O-N 3.15Å; F427-I431 HydrophobicContact CD1-CD1 4.35Å; F427-I431 HydrophobicContact CD1-CG1 4.01Å; F427-I431 HydrophobicContact CE1-CG1 3.99Å; F427-L496 HydrophobicContact CE1-CD2 4.02Å; F427-L496 HydrophobicContact CZ-CD2 4.48Å; F427-N549 WeakPolarHBondContact CB-OD1 3.46Å; F427-N549 HydrophobicContact CD2-CB 4.47Å; F427-N549 WeakPolarHBondContact CD2-OD1 3.28Å; F427-N549 PolarHBondContact N-ND2 2.8Å; F427-D552 HydrophobicContact CE2-CB 4.14Å; F427-D552 WeakPolarHBondContact CE2-OD1 3.18Å; F427-D552 WeakPolarHBondContact CZ-OD1 3.26Å; F427-P560 HydrophobicContact CD2-CB 4.3Å; F427-P560 HydrophobicContact CD2-CG 4.28Å; F427-P560 HydrophobicContact CE2-CB 4.23Å; F427-P560 HydrophobicContact CE2-CG 3.85Å; F427-V561 HydrophobicContact CD1-CG2 4.22Å; F427-V561 HydrophobicContact CE1-CG2 3.95Å; F427-V561 HydrophobicContact CZ-CG2 4.33Å
428	S	92.1	Very high	93.5	Very high	4 Å²	4	21 Å²	21	3%	0.028	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-23.5	176.2	-65	0	0	0	0	114.8	T425 L426 Y430	T425-S428 PolarHBondContact O-OG 3.19Å; L426-S428 PolarHBondContact O-N 3.39Å; S428-Y430 VanDerWaalsContact C-N 3.28Å; S428-Y430 PolarHBondContact O-N 3.13Å
429	K	89.8	Confident	93.3	Very high	26 Å²	26	21.4 Å²	21.4	11%	0.113	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-12.8	175.9	76.5	-175.9	-171.3	163.1	0	114.4	V67 N70 L426 F427	V67-K429 HydrophobicContact CG1-CB 4.24Å; V67-K429 WeakPolarHBondContact O-CB 2.98Å; N70-K429 PolarHBondContact O-NZ 3.23Å; L426-K429 WeakPolarHBondContact O-CG 3.49Å; F427-K429 PolarHBondContact O-N 2.87Å
430	Y	89.3	Confident	93.2	Very high	20 Å²	20	24.4 Å²	24.4	8%	0.078	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-11.9	-178.4	-61.3	-57.7	0	0	0	113.1	F427 S428 N432 N549 F553 H557	F427-Y430 AromaticContact CD2-CD2 3.8Å; F427-Y430 HydrophobicContact CD2-CD2 3.8Å; F427-Y430 HydrophobicContact CD2-CG 4.39Å; F427-Y430 HydrophobicContact CE2-CD2 4.18Å; F427-Y430 HydrophobicContact CE2-CG 4.39Å; F427-Y430 WeakPolarHBondContact O-CB 2.95Å; F427-Y430 PolarHBondContact O-N 3.15Å; S428-Y430 VanDerWaalsContact C-N 3.28Å; S428-Y430 PolarHBondContact O-N 3.13Å; Y430-N432 PolarHBondContact O-N 3.05Å; Y430-N549 HydrophobicContact CD2-CB 4.25Å; Y430-N549 HydrophobicContact CE2-CB 3.77Å; Y430-F553 HydrophobicContact CD1-CD2 4.33Å; Y430-F553 AromaticContact CD1-CE2 3.19Å; Y430-F553 HydrophobicContact CD1-CE2 3.19Å; Y430-F553 AromaticContact CD1-CZ 3.66Å; Y430-F553 HydrophobicContact CD1-CZ 3.66Å; Y430-F553 AromaticContact CE1-CD2 3.92Å; Y430-F553 HydrophobicContact CE1-CD2 3.92Å; Y430-F553 AromaticContact CE1-CE2 3.01Å; Y430-F553 HydrophobicContact CE1-CE2 3.01Å; Y430-F553 AromaticContact CE1-CZ 3.64Å; Y430-F553 HydrophobicContact CE1-CZ 3.64Å; Y430-F553 HydrophobicContact CG-CE2 4.18Å; Y430-F553 AromaticContact CZ-CE2 3.93Å; Y430-H557 PolarHBondContact O-CE1 3.45Å; Y430-H557 VanDerWaalsContact O-CE1 3.28Å
431	I	91.1	Very high	93.1	Very high	11 Å²	11	27.7 Å²	27.7	6%	0.056	14%	0.135	C	C	.	.	S	Bend	trans	-70.2	125.3	175.7	-62.8	-179.8	0	0	0	108.6	F427 Y433 V438 D493 N497	F427-I431 HydrophobicContact CD1-CD1 4.35Å; F427-I431 HydrophobicContact CD1-CG1 4.01Å; F427-I431 HydrophobicContact CE1-CG1 3.99Å; I431-Y433 PolarHBondContact O-N 3.15Å; I431-V438 HydrophobicContact CB-CG2 4.45Å; I431-V438 HydrophobicContact CD1-CG1 3.92Å; I431-V438 HydrophobicContact CG2-CG2 4.04Å; I431-D493 HydrophobicContact CG2-CB 3.77Å; I431-N497 HydrophobicContact CD1-CB 4.4Å; I431-N497 HydrophobicContact CG2-CB 4.14Å
432	N	86.8	Confident	93	Very high	84 Å²	84	26.7 Å²	26.7	45%	0.449	13%	0.131	S	C	.	.	S	Bend	trans	-74.5	67	176.4	-59.2	-64.5	0	0	0	111	Y430 D493	Y430-N432 PolarHBondContact O-N 3.05Å; N432-D493 WeakPolarHBondContact CA-OD2 3.06Å; N432-D493 WeakPolarHBondContact CB-OD2 3.31Å; N432-D493 PolarHBondContact N-OD2 3.4Å; N432-D493 PolarHBondContact ND2-OD2 3.5Å
433	Y	86.7	Confident	92.9	Very high	87 Å²	87	26.5 Å²	26.5	34%	0.341	13%	0.13	S	C	.	.	S	Bend	trans	-151.8	169.1	174	-164.6	-120.5	0	0	0	109.3	I431 I435 I437 V438	I431-Y433 PolarHBondContact O-N 3.15Å; Y433-I435 PolarHBondContact O-N 3.24Å; Y433-I435 VanDerWaalsContact O-N 3.09Å; Y433-I437 HydrophobicContact CD1-CB 4.31Å; Y433-I437 HydrophobicContact CD1-CG2 4.41Å; Y433-I437 HydrophobicContact CE1-CB 3.83Å; Y433-I437 HydrophobicContact CE1-CD1 4.15Å; Y433-I437 HydrophobicContact CE1-CG2 3.62Å; Y433-V438 HydrophobicContact CD1-CG2 3.71Å; Y433-V438 HydrophobicContact CG-CG2 4.23Å
434	N	91.2	Very high	92.8	Very high	39 Å²	39	28.6 Å²	28.6	21%	0.209	15%	0.145	C	C	.	.			trans	-58.7	118.2	-179.8	-173.8	-53.8	0	0	0	111.2	F162 Y436 I437 V438	F162-N434 HydrophobicContact CD1-CB 4.1Å; N434-Y436 PolarHBondContact O-N 3.45Å; N434-Y436 VanDerWaalsContact OD1-CB 3.32Å; N434-Y436 WeakPolarHBondContact OD1-CB 3.37Å; N434-Y436 WeakPolarHBondContact OD1-CD2 3.48Å; N434-Y436 PolarHBondContact OD1-N 3.19Å; N434-I437 HydrophobicContact CB-CB 4.32Å; N434-I437 HydrophobicContact CB-CD1 3.95Å; N434-I437 HydrophobicContact CB-CG1 3.99Å; N434-I437 PolarHBondContact O-N 2.92Å; N434-I437 PolarHBondContact OD1-N 3.34Å; N434-V438 WeakPolarHBondContact O-CG2 3.39Å; N434-V438 PolarHBondContact O-N 3.44Å
435	I	92.2	Very high	92.6	Very high	6 Å²	6	28.7 Å²	28.7	3%	0.031	15%	0.145	C	C	.	.	H	α-helix	trans	-57.5	-35.3	-175.4	-166	169.6	0	0	0	112.9	V67 F68 F162 Y433 T439	V67-I435 HydrophobicContact CG1-CD1 4.01Å; V67-I435 HydrophobicContact CG1-CG1 4.11Å; V67-I435 VanDerWaalsContact O-CD1 3.26Å; V67-I435 WeakPolarHBondContact O-CD1 3.29Å; F68-I435 HydrophobicContact CD1-CD1 4.12Å; F68-I435 HydrophobicContact CD1-CG1 4.38Å; F68-I435 HydrophobicContact CD1-CG2 4.45Å; F68-I435 HydrophobicContact CE1-CG1 4.28Å; F68-I435 HydrophobicContact CE1-CG2 4.37Å; F162-I435 VanDerWaalsContact O-CB 3.3Å; F162-I435 WeakPolarHBondContact O-CB 3.46Å; F162-I435 WeakPolarHBondContact O-CG2 3.3Å; F162-I435 PolarHBondContact O-N 3.32Å; Y433-I435 PolarHBondContact O-N 3.24Å; Y433-I435 VanDerWaalsContact O-N 3.09Å; I435-T439 HydrophobicContact CG1-CG2 4.25Å; I435-T439 VanDerWaalsContact O-CB 3.32Å; I435-T439 WeakPolarHBondContact O-CB 3.28Å; I435-T439 VanDerWaalsContact O-CG2 3.24Å; I435-T439 WeakPolarHBondContact O-CG2 3.01Å; I435-T439 PolarHBondContact O-N 3.46Å; I435-T439 PolarHBondContact O-OG1 3.43Å
436	Y	93.4	Very high	92.4	Very high	27 Å²	27	28.6 Å²	28.6	11%	0.106	15%	0.145	C	C	.	.	H	α-helix	trans	-66.8	-41.2	178.3	-51.1	-70.5	0	0	0	110.7	F68 Y164 T287 A290 Y291 N434 T439 L440	F68-Y436 HydrophobicContact CD1-CE1 4.36Å; F68-Y436 AromaticContact CE1-CD1 3.86Å; F68-Y436 HydrophobicContact CE1-CD1 3.86Å; F68-Y436 HydrophobicContact CE1-CE1 4.06Å; Y164-Y436 HydrophobicContact CD2-CE1 4.24Å; T287-Y436 VanDerWaalsContact CG2-O 3.28Å; T287-Y436 WeakPolarHBondContact CG2-O 3.28Å; A290-Y436 HydrophobicContact CB-CD1 4.4Å; A290-Y436 HydrophobicContact CB-CE1 4.02Å; A290-Y436 WeakPolarHBondContact O-CE1 3.35Å; Y291-Y436 HydrophobicContact CD2-CD2 4.09Å; Y291-Y436 HydrophobicContact CD2-CE2 4.31Å; Y291-Y436 HydrophobicContact CD2-CG 4.26Å; N434-Y436 PolarHBondContact O-N 3.45Å; N434-Y436 VanDerWaalsContact OD1-CB 3.32Å; N434-Y436 WeakPolarHBondContact OD1-CB 3.37Å; N434-Y436 WeakPolarHBondContact OD1-CD2 3.48Å; N434-Y436 PolarHBondContact OD1-N 3.19Å; Y436-T439 PolarHBondContact O-OG1 3.4Å; Y436-T439 VanDerWaalsContact O-OG1 3.09Å; Y436-L440 VanDerWaalsContact O-CB 3.26Å; Y436-L440 WeakPolarHBondContact O-CB 3.37Å; Y436-L440 PolarHBondContact O-N 3.24Å
437	I	93.4	Very high	92.3	Very high	70 Å²	70	31.2 Å²	31.2	36%	0.359	16%	0.158	S	C	.	.	H	α-helix	trans	-71	-46.3	178.3	-54.9	178.4	0	0	0	110.5	Y433 N434 T439 L440 I441	Y433-I437 HydrophobicContact CD1-CB 4.31Å; Y433-I437 HydrophobicContact CD1-CG2 4.41Å; Y433-I437 HydrophobicContact CE1-CB 3.83Å; Y433-I437 HydrophobicContact CE1-CD1 4.15Å; Y433-I437 HydrophobicContact CE1-CG2 3.62Å; N434-I437 HydrophobicContact CB-CB 4.32Å; N434-I437 HydrophobicContact CB-CD1 3.95Å; N434-I437 HydrophobicContact CB-CG1 3.99Å; N434-I437 PolarHBondContact O-N 2.92Å; N434-I437 PolarHBondContact OD1-N 3.34Å; I437-T439 VanDerWaalsContact C-N 3.31Å; I437-T439 PolarHBondContact O-N 3.38Å; I437-L440 PolarHBondContact O-N 3.42Å; I437-I441 HydrophobicContact CG2-CD1 3.85Å; I437-I441 HydrophobicContact CG2-CG1 4.32Å; I437-I441 VanDerWaalsContact O-CG1 3.31Å; I437-I441 WeakPolarHBondContact O-CG1 3.25Å; I437-I441 PolarHBondContact O-N 3.07Å
438	V	94.3	Very high	92.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.6	-47.3	177.4	176.2	0	0	0	0	110.7	I431 Y433 N434 I441 N442	I431-V438 HydrophobicContact CB-CG2 4.45Å; I431-V438 HydrophobicContact CD1-CG1 3.92Å; I431-V438 HydrophobicContact CG2-CG2 4.04Å; Y433-V438 HydrophobicContact CD1-CG2 3.71Å; Y433-V438 HydrophobicContact CG-CG2 4.23Å; N434-V438 WeakPolarHBondContact O-CG2 3.39Å; N434-V438 PolarHBondContact O-N 3.44Å; V438-I441 PolarHBondContact O-N 2.98Å; V438-N442 WeakPolarHBondContact O-CB 3.34Å; V438-N442 PolarHBondContact O-N 3.34Å
439	T	93.6	Very high	92.3	Very high	11 Å²	11	33.2 Å²	33.2	7%	0.067	17%	0.171	C	C	.	.	H	α-helix	trans	-69.4	-32.4	-179.8	53.1	0	0	0	0	113	V67 F68 T287 I435 Y436 I437 N442 A443	V67-T439 HydrophobicContact CB-CG2 4.37Å; V67-T439 HydrophobicContact CG1-CG2 3.45Å; V67-T439 VanDerWaalsContact CG1-CG2 3.45Å; F68-T439 HydrophobicContact CE1-CG2 4.39Å; F68-T439 HydrophobicContact CE2-CG2 4.11Å; F68-T439 HydrophobicContact CZ-CG2 3.75Å; F68-T439 WeakPolarHBondContact CZ-OG1 3.34Å; T287-T439 WeakPolarHBondContact CG2-OG1 3.3Å; T287-T439 WeakPolarHBondContact OG1-CB 3.46Å; T287-T439 PolarHBondContact OG1-OG1 2.9Å; T287-T439 VanDerWaalsContact OG1-OG1 3.04Å; I435-T439 HydrophobicContact CG1-CG2 4.25Å; I435-T439 VanDerWaalsContact O-CB 3.32Å; I435-T439 WeakPolarHBondContact O-CB 3.28Å; I435-T439 VanDerWaalsContact O-CG2 3.24Å; I435-T439 WeakPolarHBondContact O-CG2 3.01Å; I435-T439 PolarHBondContact O-N 3.46Å; I435-T439 PolarHBondContact O-OG1 3.43Å; Y436-T439 PolarHBondContact O-OG1 3.4Å; Y436-T439 VanDerWaalsContact O-OG1 3.09Å; I437-T439 VanDerWaalsContact C-N 3.31Å; I437-T439 PolarHBondContact O-N 3.38Å; T439-N442 WeakPolarHBondContact O-CB 3.26Å; T439-N442 PolarHBondContact O-N 2.86Å; T439-A443 WeakPolarHBondContact O-CB 3.32Å; T439-A443 PolarHBondContact O-N 2.97Å
440	L	94.7	Very high	92.4	Very high	80 Å²	80	32.4 Å²	32.4	42%	0.419	17%	0.169	S	C	.	.	H	α-helix	trans	-69.3	-41.2	174.3	-173.4	64.1	0	0	0	112.1	A284 T287 Y436 I437 N442 A443 S444	A284-L440 HydrophobicContact CB-CD1 3.95Å; T287-L440 HydrophobicContact CG2-CB 4.34Å; Y436-L440 VanDerWaalsContact O-CB 3.26Å; Y436-L440 WeakPolarHBondContact O-CB 3.37Å; Y436-L440 PolarHBondContact O-N 3.24Å; I437-L440 PolarHBondContact O-N 3.42Å; L440-N442 VanDerWaalsContact C-N 3.33Å; L440-A443 PolarHBondContact O-N 2.84Å; L440-S444 WeakPolarHBondContact O-CB 3.14Å; L440-S444 PolarHBondContact O-N 3.37Å; L440-S444 PolarHBondContact O-OG 3.47Å
441	I	95.3	Very high	92.5	Very high	68 Å²	68	36.1 Å²	36.1	35%	0.349	19%	0.189	S	C	.	.	H	α-helix	trans	-62.8	-44.3	172.8	-64	169.7	0	0	0	109.4	I437 V438 A443 S444 T445 N501	I437-I441 HydrophobicContact CG2-CD1 3.85Å; I437-I441 HydrophobicContact CG2-CG1 4.32Å; I437-I441 VanDerWaalsContact O-CG1 3.31Å; I437-I441 WeakPolarHBondContact O-CG1 3.25Å; I437-I441 PolarHBondContact O-N 3.07Å; V438-I441 PolarHBondContact O-N 2.98Å; I441-A443 PolarHBondContact O-N 2.96Å; I441-S444 WeakPolarHBondContact O-CB 3.3Å; I441-S444 PolarHBondContact O-N 3.26Å; I441-S444 VanDerWaalsContact O-N 3.1Å; I441-T445 PolarHBondContact O-N 3.05Å; I441-N501 HydrophobicContact CG2-CB 4.06Å
442	N	94.5	Very high	92.6	Very high	6 Å²	6	38 Å²	38	3%	0.032	20%	0.201	C	C	.	.	H	α-helix	trans	-56.7	-47.3	174.7	-174.7	-75	0	0	0	111.9	R283 V438 T439 L440 S444 T445 N501 L504	R283-N442 PolarHBondContact NH1-OD1 3.36Å; V438-N442 WeakPolarHBondContact O-CB 3.34Å; V438-N442 PolarHBondContact O-N 3.34Å; T439-N442 WeakPolarHBondContact O-CB 3.26Å; T439-N442 PolarHBondContact O-N 2.86Å; L440-N442 VanDerWaalsContact C-N 3.33Å; N442-S444 VanDerWaalsContact C-N 3.28Å; N442-S444 PolarHBondContact O-N 3.11Å; N442-T445 WeakPolarHBondContact O-CB 3.49Å; N442-T445 WeakPolarHBondContact O-CG2 3.4Å; N442-T445 PolarHBondContact O-N 3.11Å; N442-T445 PolarHBondContact O-OG1 3.38Å; N442-N501 VanDerWaalsContact CA-OD1 3.26Å; N442-N501 WeakPolarHBondContact CA-OD1 3.38Å; N442-N501 PolarHBondContact N-OD1 2.81Å; N442-L504 HydrophobicContact CB-CD2 4.34Å; N442-L504 VanDerWaalsContact CG-CD2 3.43Å; N442-L504 WeakPolarHBondContact ND2-CD2 3.21Å
443	A	94.1	Very high	92.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-40.3	176	0	0	0	0	0	111.8	R283 A284 T439 L440 I441 T445 G446	R283-A443 HydrophobicContact CB-CB 3.57Å; A284-A443 HydrophobicContact CB-CB 4.29Å; T439-A443 WeakPolarHBondContact O-CB 3.32Å; T439-A443 PolarHBondContact O-N 2.97Å; L440-A443 PolarHBondContact O-N 2.84Å; I441-A443 PolarHBondContact O-N 2.96Å; A443-T445 PolarHBondContact O-N 3.46Å; A443-G446 PolarHBondContact O-N 3.24Å
444	S	94.4	Very high	93	Very high	45 Å²	45	32.9 Å²	32.9	32%	0.315	19%	0.185	S	C	.	.	H	α-helix	trans	-62.5	-24	-179.5	-58.3	0	0	0	0	113.1	L440 I441 N442 G446 I447 P448	L440-S444 WeakPolarHBondContact O-CB 3.14Å; L440-S444 PolarHBondContact O-N 3.37Å; L440-S444 PolarHBondContact O-OG 3.47Å; I441-S444 WeakPolarHBondContact O-CB 3.3Å; I441-S444 PolarHBondContact O-N 3.26Å; I441-S444 VanDerWaalsContact O-N 3.1Å; N442-S444 VanDerWaalsContact C-N 3.28Å; N442-S444 PolarHBondContact O-N 3.11Å; S444-G446 PolarHBondContact O-N 3.27Å; S444-G446 VanDerWaalsContact O-N 3.14Å; S444-I447 PolarHBondContact O-N 3.15Å; S444-I447 VanDerWaalsContact O-N 3.08Å; S444-P448 WeakPolarHBondContact O-CD 3.25Å
445	T	93.6	Very high	93	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.031	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.2	174.2	70.6	0	0	0	0	113.5	I441 N442 A443 I447 P448 G449 N501 L504 I505	I441-T445 PolarHBondContact O-N 3.05Å; N442-T445 WeakPolarHBondContact O-CB 3.49Å; N442-T445 WeakPolarHBondContact O-CG2 3.4Å; N442-T445 PolarHBondContact O-N 3.11Å; N442-T445 PolarHBondContact O-OG1 3.38Å; A443-T445 PolarHBondContact O-N 3.46Å; T445-I447 PolarHBondContact O-N 3.33Å; T445-I447 VanDerWaalsContact O-N 3.16Å; T445-P448 WeakPolarHBondContact O-CD 3.48Å; T445-G449 PolarHBondContact O-N 3.29Å; T445-N501 HydrophobicContact CG2-CB 4.3Å; T445-L504 HydrophobicContact CG2-CB 4.18Å; T445-L504 HydrophobicContact CG2-CD2 3.94Å; T445-L504 HydrophobicContact CG2-CG 4.19Å; T445-L504 WeakPolarHBondContact OG1-CD2 3.19Å; T445-I505 HydrophobicContact CG2-CG1 3.77Å
446	G	90.1	Very high	93	Very high	1 Å²	1	36 Å²	36	1%	0.01	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-8	173.4	0	0	0	0	0	115.1	A443 S444 P450	A443-G446 PolarHBondContact O-N 3.24Å; S444-G446 PolarHBondContact O-N 3.27Å; S444-G446 VanDerWaalsContact O-N 3.14Å; G446-P450 WeakPolarHBondContact O-CD 3.44Å; G446-P450 VanDerWaalsContact O-CG 3.27Å; G446-P450 WeakPolarHBondContact O-CG 3.44Å
447	I	92.6	Very high	92.8	Very high	65 Å²	65	36.6 Å²	36.6	33%	0.333	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-62.1	175.5	-52.2	177.9	0	0	0	111.8	L276 F280 S444 T445 G449 P450 I451	L276-I447 HydrophobicContact CD1-CB 4.48Å; L276-I447 HydrophobicContact CD1-CD1 4.44Å; L276-I447 HydrophobicContact CD1-CG1 3.69Å; F280-I447 HydrophobicContact CB-CG1 4.14Å; F280-I447 HydrophobicContact CD1-CD1 4.04Å; F280-I447 HydrophobicContact CD1-CG1 4.32Å; F280-I447 HydrophobicContact CD2-CD1 3.89Å; F280-I447 HydrophobicContact CD2-CG1 4.08Å; F280-I447 HydrophobicContact CE1-CD1 4.07Å; F280-I447 HydrophobicContact CE2-CD1 3.91Å; F280-I447 HydrophobicContact CG-CD1 3.94Å; F280-I447 HydrophobicContact CG-CG1 3.91Å; F280-I447 HydrophobicContact CZ-CD1 4.01Å; S444-I447 PolarHBondContact O-N 3.15Å; S444-I447 VanDerWaalsContact O-N 3.08Å; T445-I447 PolarHBondContact O-N 3.33Å; T445-I447 VanDerWaalsContact O-N 3.16Å; I447-G449 VanDerWaalsContact C-N 3.31Å; I447-G449 PolarHBondContact O-N 3.36Å; I447-P450 WeakPolarHBondContact O-CD 3.39Å; I447-I451 HydrophobicContact CG2-CD1 3.96Å; I447-I451 WeakPolarHBondContact O-CD1 3.39Å; I447-I451 VanDerWaalsContact O-CG1 3.3Å; I447-I451 WeakPolarHBondContact O-CG1 3.37Å; I447-I451 PolarHBondContact O-N 2.93Å
448	P	94.1	Very high	92.5	Very high	46 Å²	46	43.9 Å²	43.9	30%	0.299	23%	0.231	S	C	.	.	H	α-helix	trans	-68.9	-27.3	-177.9	29.7	-36.6	0	0	0	112.9	S444 T445 I451 T452 I505	S444-P448 WeakPolarHBondContact O-CD 3.25Å; T445-P448 WeakPolarHBondContact O-CD 3.48Å; P448-I451 PolarHBondContact O-N 3.42Å; P448-T452 VanDerWaalsContact O-CB 3.28Å; P448-T452 WeakPolarHBondContact O-CB 3.26Å; P448-T452 PolarHBondContact O-N 2.87Å; P448-T452 PolarHBondContact O-OG1 3.22Å; P448-I505 HydrophobicContact CB-CG2 4.01Å; P448-I505 HydrophobicContact CG-CD1 3.8Å; P448-I505 HydrophobicContact CG-CG1 3.81Å; P448-I505 HydrophobicContact CG-CG2 3.94Å
449	G	93.6	Very high	92.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.5	-58.7	178.9	0	0	0	0	0	112.8	T445 I447 I451 T452 A453 I505 A509	T445-G449 PolarHBondContact O-N 3.29Å; I447-G449 VanDerWaalsContact C-N 3.31Å; I447-G449 PolarHBondContact O-N 3.36Å; G449-I451 VanDerWaalsContact C-N 3.32Å; G449-I451 PolarHBondContact O-N 2.77Å; G449-T452 WeakPolarHBondContact O-CB 3.36Å; G449-T452 PolarHBondContact O-N 3.42Å; G449-A453 PolarHBondContact O-N 2.89Å; G449-I505 WeakPolarHBondContact CA-O 3.42Å; G449-A509 WeakPolarHBondContact O-CA 3.41Å; G449-A509 VanDerWaalsContact O-CB 3.23Å; G449-A509 WeakPolarHBondContact O-CB 3.49Å
450	P	90.7	Very high	92.1	Very high	9 Å²	9	53.9 Å²	53.9	6%	0.058	28%	0.282	C	S	.	.	H	α-helix	trans	-61.3	-35	176.3	-26.5	36.2	0	0	0	114.6	V275 G446 I447 A453 S454 I512	V275-P450 HydrophobicContact CG1-CG 3.73Å; G446-P450 WeakPolarHBondContact O-CD 3.44Å; G446-P450 VanDerWaalsContact O-CG 3.27Å; G446-P450 WeakPolarHBondContact O-CG 3.44Å; I447-P450 WeakPolarHBondContact O-CD 3.39Å; P450-A453 PolarHBondContact O-N 3.27Å; P450-S454 WeakPolarHBondContact O-CB 3.38Å; P450-S454 PolarHBondContact O-N 2.98Å; P450-S454 PolarHBondContact O-OG 3.16Å; P450-I512 HydrophobicContact CB-CD1 3.55Å; P450-I512 HydrophobicContact CG-CD1 3.73Å
451	I	91.6	Very high	91.8	Very high	98 Å²	98	56.8 Å²	56.8	50%	0.503	29%	0.291	S	S	.	.	H	α-helix	trans	-62.8	-47.2	174.2	-65.6	170	0	0	0	109.8	I447 P448 G449 A453 S454 V455	I447-I451 HydrophobicContact CG2-CD1 3.96Å; I447-I451 WeakPolarHBondContact O-CD1 3.39Å; I447-I451 VanDerWaalsContact O-CG1 3.3Å; I447-I451 WeakPolarHBondContact O-CG1 3.37Å; I447-I451 PolarHBondContact O-N 2.93Å; P448-I451 PolarHBondContact O-N 3.42Å; G449-I451 VanDerWaalsContact C-N 3.32Å; G449-I451 PolarHBondContact O-N 2.77Å; I451-A453 PolarHBondContact O-N 2.87Å; I451-S454 PolarHBondContact O-N 3.3Å; I451-V455 HydrophobicContact CG2-CG2 4.37Å; I451-V455 WeakPolarHBondContact O-CG2 3.3Å; I451-V455 PolarHBondContact O-N 3.34Å
452	T	93	Very high	91.6	Very high	51 Å²	51	60 Å²	60	31%	0.313	30%	0.3	S	S	.	.	H	α-helix	trans	-59.2	-47.7	177.3	-57.7	0	0	0	0	110.9	P448 G449 S454 V455 V456 A509	P448-T452 VanDerWaalsContact O-CB 3.28Å; P448-T452 WeakPolarHBondContact O-CB 3.26Å; P448-T452 PolarHBondContact O-N 2.87Å; P448-T452 PolarHBondContact O-OG1 3.22Å; G449-T452 WeakPolarHBondContact O-CB 3.36Å; G449-T452 PolarHBondContact O-N 3.42Å; T452-S454 VanDerWaalsContact C-N 3.3Å; T452-S454 PolarHBondContact O-N 3.39Å; T452-V455 PolarHBondContact O-N 3.45Å; T452-V456 HydrophobicContact CG2-CG2 4.02Å; T452-V456 VanDerWaalsContact O-CB 3.26Å; T452-V456 WeakPolarHBondContact O-CB 3.3Å; T452-V456 WeakPolarHBondContact O-CG2 3.28Å; T452-V456 PolarHBondContact O-N 3.14Å; T452-A509 HydrophobicContact CG2-CB 4.24Å
453	A	92.2	Very high	91.4	Very high	3 Å²	3	61.6 Å²	61.6	3%	0.025	31%	0.305	C	S	.	.	H	α-helix	trans	-56.7	-44.3	176.1	0	0	0	0	0	112.3	G449 P450 I451 Y457 A509 I512 M513	G449-A453 PolarHBondContact O-N 2.89Å; P450-A453 PolarHBondContact O-N 3.27Å; I451-A453 PolarHBondContact O-N 2.87Å; A453-Y457 WeakPolarHBondContact O-CB 3.44Å; A453-Y457 PolarHBondContact O-N 3.49Å; A453-A509 HydrophobicContact CB-CB 4.15Å; A453-I512 HydrophobicContact CB-CB 4.1Å; A453-I512 HydrophobicContact CB-CD1 4.47Å; A453-I512 HydrophobicContact CB-CG2 4.22Å; A453-M513 HydrophobicContact CB-CG 3.84Å; A453-M513 HydrophobicContact CB-SD 4.29Å
454	S	89.7	Confident	91.5	Very high	60 Å²	60	64.8 Å²	64.8	42%	0.42	32%	0.317	S	S	.	.	H	α-helix	trans	-66.9	-42.2	-178.7	-57.5	0	0	0	0	112.4	P450 I451 T452 R458	P450-S454 WeakPolarHBondContact O-CB 3.38Å; P450-S454 PolarHBondContact O-N 2.98Å; P450-S454 PolarHBondContact O-OG 3.16Å; I451-S454 PolarHBondContact O-N 3.3Å; T452-S454 VanDerWaalsContact C-N 3.3Å; T452-S454 PolarHBondContact O-N 3.39Å; S454-R458 WeakPolarHBondContact O-CB 3.31Å; S454-R458 PolarHBondContact O-N 3.47Å
455	V	91.7	Very high	91.5	Very high	82 Å²	82	68.3 Å²	68.3	50%	0.497	33%	0.327	S	S	.	.	H	α-helix	trans	-68.3	-47.4	177.5	172.2	0	0	0	0	110.3	I451 T452 R458 C459	I451-V455 HydrophobicContact CG2-CG2 4.37Å; I451-V455 WeakPolarHBondContact O-CG2 3.3Å; I451-V455 PolarHBondContact O-N 3.34Å; T452-V455 PolarHBondContact O-N 3.45Å; V455-R458 PolarHBondContact O-N 2.97Å; V455-C459 PolarHBondContact O-N 3.45Å; V455-C459 PolarHBondContact O-SG 3.09Å
456	V	92.3	Very high	91.5	Very high	30 Å²	30	68.3 Å²	68.3	18%	0.182	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-50.7	-177	171	0	0	0	0	111.6	T452 R458 C459 Y460 P466 M513	T452-V456 HydrophobicContact CG2-CG2 4.02Å; T452-V456 VanDerWaalsContact O-CB 3.26Å; T452-V456 WeakPolarHBondContact O-CB 3.3Å; T452-V456 WeakPolarHBondContact O-CG2 3.28Å; T452-V456 PolarHBondContact O-N 3.14Å; V456-R458 PolarHBondContact O-N 3.18Å; V456-C459 PolarHBondContact O-N 2.93Å; V456-Y460 HydrophobicContact CG1-CD2 4.2Å; V456-Y460 WeakPolarHBondContact O-CD2 3.38Å; V456-Y460 PolarHBondContact O-N 3.03Å; V456-P466 HydrophobicContact CG1-CB 3.24Å; V456-P466 HydrophobicContact CG1-CG 4.16Å; V456-M513 HydrophobicContact CG1-CE 3.86Å
457	Y	89.2	Confident	91.8	Very high	39 Å²	39	68.3 Å²	68.3	15%	0.153	33%	0.327	C	S	.	.	H	α-helix	trans	-72.1	-13.1	178.4	-82.9	5.4	0	0	0	114.2	A453 R463 P466 M513 I516	A453-Y457 WeakPolarHBondContact O-CB 3.44Å; A453-Y457 PolarHBondContact O-N 3.49Å; Y457-R463 HydrophobicContact CE1-CB 4.17Å; Y457-R463 HydrophobicContact CE1-CG 4.27Å; Y457-R463 HydrophobicContact CE2-CG 4.4Å; Y457-R463 PolarHBondContact OH-O 2.91Å; Y457-P466 HydrophobicContact CE1-CB 4.48Å; Y457-M513 HydrophobicContact CD1-CE 3.74Å; Y457-M513 HydrophobicContact CD1-CG 4.15Å; Y457-M513 HydrophobicContact CD2-CB 4.47Å; Y457-M513 HydrophobicContact CD2-CG 4.12Å; Y457-M513 HydrophobicContact CE1-CB 4.06Å; Y457-M513 HydrophobicContact CE1-CE 3.25Å; Y457-M513 HydrophobicContact CE1-CG 3.85Å; Y457-M513 HydrophobicContact CE1-SD 4.37Å; Y457-M513 VanDerWaalsContact CE2-CA 3.47Å; Y457-M513 HydrophobicContact CE2-CB 3.68Å; Y457-M513 HydrophobicContact CE2-CG 3.8Å; Y457-M513 HydrophobicContact CG-CG 4.3Å; Y457-M513 VanDerWaalsContact CZ-CB 3.44Å; Y457-M513 WeakPolarHBondContact OH-CB 3.23Å; Y457-M513 PolarHBondContact OH-O 3.06Å; Y457-I516 HydrophobicContact CD2-CD1 4.28Å; Y457-I516 HydrophobicContact CE2-CD1 4.5Å
458	R	88.1	Confident	92	Very high	222 Å²	222	67 Å²	67	84%	0.838	32%	0.32	S	S	*	.	H	α-helix	trans	-83.2	-37.2	169.9	-176.3	174.8	180	179.7	-1.3	112.3	S454 V455 V456	S454-R458 WeakPolarHBondContact O-CB 3.31Å; S454-R458 PolarHBondContact O-N 3.47Å; V455-R458 PolarHBondContact O-N 2.97Å; V456-R458 PolarHBondContact O-N 3.18Å
459	C	89.7	Confident	92.2	Very high	98 Å²	98	66.8 Å²	66.8	66%	0.662	32%	0.319	S	S	*	.	H	α-helix	trans	-80.2	-31.1	-178.9	-66.8	0	0	0	0	113	V455 V456	V455-C459 PolarHBondContact O-N 3.45Å; V455-C459 PolarHBondContact O-SG 3.09Å; V456-C459 PolarHBondContact O-N 2.93Å
460	Y	89.3	Confident	92.3	Very high	124 Å²	124	67.1 Å²	67.1	49%	0.486	32%	0.322	S	S	.	.			trans	-108	123.7	-177.5	-69.2	-90.6	0	0	0	111.4	V456 P466	V456-Y460 HydrophobicContact CG1-CD2 4.2Å; V456-Y460 WeakPolarHBondContact O-CD2 3.38Å; V456-Y460 PolarHBondContact O-N 3.03Å; Y460-P466 VanDerWaalsContact CB-CG 3.49Å; Y460-P466 HydrophobicContact CD1-CG 4.17Å; Y460-P466 HydrophobicContact CD2-CG 4.15Å; Y460-P466 HydrophobicContact CG-CG 3.69Å
461	K	87.4	Confident	92.6	Very high	141 Å²	141	66.7 Å²	66.7	61%	0.613	32%	0.319	S	S	*	.	S	Bend	trans	-66	-41.8	177.3	-175.9	179.8	179.7	-178.3	0	112.4
462	Y	91.4	Very high	92.9	Very high	134 Å²	134	66 Å²	66	53%	0.525	32%	0.315	S	S	.	.			trans	-88.8	143.1	179.5	-63.4	-73	0	0	0	110.9	P466 D580	Y462-P466 WeakPolarHBondContact O-CD 3.32Å; Y462-P466 WeakPolarHBondContact O-CG 3.13Å; Y462-D580 HydrophobicContact CD1-CB 4.42Å
463	R	91.6	Very high	93.2	Very high	40 Å²	40	67.5 Å²	67.5	15%	0.151	32%	0.32	C	S	.	.	S	Bend	trans	-103.3	-26.9	-166.3	-69.8	172.8	169.8	-146.2	16.7	114.4	Y457 L467 Y517 E520 D580 T581 G583	Y457-R463 HydrophobicContact CE1-CB 4.17Å; Y457-R463 HydrophobicContact CE1-CG 4.27Å; Y457-R463 HydrophobicContact CE2-CG 4.4Å; Y457-R463 PolarHBondContact OH-O 2.91Å; R463-L467 WeakPolarHBondContact O-CB 3.18Å; R463-L467 PolarHBondContact O-N 3.46Å; R463-Y517 HydrophobicContact CB-CD2 3.91Å; R463-E520 WeakPolarHBondContact CD-OE2 3.37Å; R463-E520 IonicContact CZ-OE1 3.57Å; R463-E520 IonicContact CZ-OE2 2.67Å; R463-E520 IonicContact NE-OE1 3.3Å; R463-E520 IonicContact NE-OE2 3.66Å; R463-E520 PolarHBondContact NE-OE2 2.93Å; R463-E520 IonicContact NH1-OE1 2.7Å; R463-E520 PolarHBondContact NH1-OE1 3.01Å; R463-E520 IonicContact NH1-OE2 2.86Å; R463-E520 PolarHBondContact NH1-OE2 3.38Å; R463-E520 IonicContact NH2-OE1 3.46Å; R463-E520 PolarHBondContact NH2-OE1 2.9Å; R463-E520 IonicContact NH2-OE2 3.94Å; R463-D580 PolarHBondContact N-OD1 3.37Å; R463-D580 VanDerWaalsContact N-OD1 3.13Å; R463-T581 VanDerWaalsContact CD-OG1 3.27Å; R463-T581 WeakPolarHBondContact CD-OG1 3.34Å; R463-T581 PolarHBondContact N-O 3.45Å; R463-G583 VanDerWaalsContact NH2-CA 3.33Å
464	R	94.5	Very high	93.5	Very high	67 Å²	67	67.3 Å²	67.3	25%	0.253	32%	0.319	S	S	.	.	H	α-helix	trans	-68.1	-49.9	-179.4	-178.1	-179	60.7	167.3	6.9	111.8	L467 M468 Y517 L575 Y576 L578 D580	R464-L467 WeakPolarHBondContact O-CB 3.48Å; R464-L467 PolarHBondContact O-N 2.85Å; R464-M468 HydrophobicContact CG-CG 4.45Å; R464-M468 HydrophobicContact CG-SD 3.99Å; R464-M468 WeakPolarHBondContact O-CG 3.24Å; R464-M468 PolarHBondContact O-N 3.1Å; R464-Y517 HydrophobicContact CB-CE2 4.29Å; R464-L575 VanDerWaalsContact CD-O 3.26Å; R464-L575 WeakPolarHBondContact CD-O 3.41Å; R464-L575 HydrophobicContact CG-CB 4.5Å; R464-Y576 PolarHBondContact NH1-O 3.42Å; R464-L578 WeakPolarHBondContact CD-O 3.29Å; R464-L578 PolarHBondContact NH1-O 3.21Å; R464-D580 HydrophobicContact CB-CB 4.32Å; R464-D580 VanDerWaalsContact CB-OD1 3.24Å; R464-D580 WeakPolarHBondContact CB-OD1 3.32Å; R464-D580 PolarHBondContact N-OD1 3.33Å; R464-D580 IonicContact NE-OD2 3.15Å; R464-D580 IonicContact NH2-OD2 2.8Å
465	F	94.7	Very high	93.9	Very high	119 Å²	119	64.8 Å²	64.8	52%	0.522	30%	0.301	S	S	.	.	H	α-helix	trans	-59.5	-50.5	-176	174.7	-97	0	0	0	113.1	L467 M468 C469	F465-L467 VanDerWaalsContact C-N 3.28Å; F465-L467 PolarHBondContact O-N 2.81Å; F465-M468 WeakPolarHBondContact O-CB 3.36Å; F465-M468 PolarHBondContact O-N 2.94Å; F465-M468 VanDerWaalsContact O-N 3.15Å; F465-C469 PolarHBondContact O-N 3.46Å; F465-C469 PolarHBondContact O-SG 3.32Å; F465-C469 VanDerWaalsContact O-SG 3.34Å
466	P	95.1	Very high	94.2	Very high	6 Å²	6	65.3 Å²	65.3	4%	0.039	30%	0.3	C	S	.	.	H	α-helix	trans	-64.3	-33.6	178.5	-17.7	29.6	0	0	0	113.1	V456 Y457 Y460 Y462 C469 T470 M513	V456-P466 HydrophobicContact CG1-CB 3.24Å; V456-P466 HydrophobicContact CG1-CG 4.16Å; Y457-P466 HydrophobicContact CE1-CB 4.48Å; Y460-P466 VanDerWaalsContact CB-CG 3.49Å; Y460-P466 HydrophobicContact CD1-CG 4.17Å; Y460-P466 HydrophobicContact CD2-CG 4.15Å; Y460-P466 HydrophobicContact CG-CG 3.69Å; Y462-P466 WeakPolarHBondContact O-CD 3.32Å; Y462-P466 WeakPolarHBondContact O-CG 3.13Å; P466-C469 WeakPolarHBondContact O-CB 3.43Å; P466-C469 PolarHBondContact O-N 2.92Å; P466-T470 PolarHBondContact O-N 3.32Å; P466-T470 VanDerWaalsContact O-N 3.12Å; P466-M513 HydrophobicContact CB-CE 3.96Å
467	L	96	Very high	94.5	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-64	-43.6	174	-178.1	61.7	0	0	0	111.3	R463 R464 F465 C469 T470 Y471 M513 L514 Y517 L575	R463-L467 WeakPolarHBondContact O-CB 3.18Å; R463-L467 PolarHBondContact O-N 3.46Å; R464-L467 WeakPolarHBondContact O-CB 3.48Å; R464-L467 PolarHBondContact O-N 2.85Å; F465-L467 VanDerWaalsContact C-N 3.28Å; F465-L467 PolarHBondContact O-N 2.81Å; L467-C469 VanDerWaalsContact C-N 3.34Å; L467-C469 PolarHBondContact O-N 2.86Å; L467-T470 PolarHBondContact O-N 3.49Å; L467-T470 PolarHBondContact O-OG1 2.85Å; L467-Y471 HydrophobicContact CD1-CD2 4.44Å; L467-Y471 HydrophobicContact CD1-CE2 3.71Å; L467-Y471 HydrophobicContact CD2-CE2 4.45Å; L467-Y471 HydrophobicContact CG-CD2 4.34Å; L467-Y471 HydrophobicContact CG-CE2 3.79Å; L467-Y471 WeakPolarHBondContact O-CD2 3.26Å; L467-Y471 PolarHBondContact O-N 3.38Å; L467-M513 HydrophobicContact CB-CE 4.19Å; L467-M513 HydrophobicContact CD1-CB 3.87Å; L467-L514 HydrophobicContact CD1-CB 4.47Å; L467-L514 HydrophobicContact CD2-CD1 4.17Å; L467-Y517 HydrophobicContact CD2-CD1 3.79Å; L467-Y517 HydrophobicContact CD2-CE1 4.42Å; L467-Y517 HydrophobicContact CD2-CG 4.29Å; L467-L575 HydrophobicContact CB-CD1 4.42Å; L467-L575 HydrophobicContact CD2-CD1 4.02Å; L467-L575 HydrophobicContact CD2-CD2 3.77Å; L467-L575 HydrophobicContact CG-CD1 3.83Å; L467-L575 HydrophobicContact CG-CD2 4.48Å
468	M	97	Very high	94.9	Very high	38 Å²	38	64.4 Å²	64.4	19%	0.187	30%	0.297	C	S	.	.	H	α-helix	trans	-59.2	-43	173.1	-69.6	174.7	68.3	0	0	111.9	R464 F465 T470 Y471 I472 A572 L575	R464-M468 HydrophobicContact CG-CG 4.45Å; R464-M468 HydrophobicContact CG-SD 3.99Å; R464-M468 WeakPolarHBondContact O-CG 3.24Å; R464-M468 PolarHBondContact O-N 3.1Å; F465-M468 WeakPolarHBondContact O-CB 3.36Å; F465-M468 PolarHBondContact O-N 2.94Å; F465-M468 VanDerWaalsContact O-N 3.15Å; M468-T470 VanDerWaalsContact C-N 3.33Å; M468-T470 PolarHBondContact O-N 2.85Å; M468-Y471 PolarHBondContact O-N 3.24Å; M468-I472 WeakPolarHBondContact O-CG1 3.39Å; M468-I472 PolarHBondContact O-N 2.96Å; M468-A572 WeakPolarHBondContact CE-O 3.29Å; M468-L575 HydrophobicContact CB-CD1 4.44Å; M468-L575 HydrophobicContact CG-CB 3.66Å; M468-L575 HydrophobicContact CG-CD1 3.6Å; M468-L575 HydrophobicContact CG-CG 4.3Å; M468-L575 HydrophobicContact SD-CB 4.16Å
469	C	96.7	Very high	95.4	Very high	41 Å²	41	56.4 Å²	56.4	28%	0.277	27%	0.274	S	S	.	.	H	α-helix	trans	-58.4	-42.4	176.7	-65.3	0	0	0	0	112.3	F465 P466 L467 Y471 I472 I473	F465-C469 PolarHBondContact O-N 3.46Å; F465-C469 PolarHBondContact O-SG 3.32Å; F465-C469 VanDerWaalsContact O-SG 3.34Å; P466-C469 WeakPolarHBondContact O-CB 3.43Å; P466-C469 PolarHBondContact O-N 2.92Å; L467-C469 VanDerWaalsContact C-N 3.34Å; L467-C469 PolarHBondContact O-N 2.86Å; C469-Y471 VanDerWaalsContact C-N 3.3Å; C469-Y471 PolarHBondContact O-N 3.4Å; C469-I472 PolarHBondContact O-N 3.39Å; C469-I473 VanDerWaalsContact O-CG1 3.28Å; C469-I473 WeakPolarHBondContact O-CG1 3.41Å; C469-I473 PolarHBondContact O-N 2.87Å
470	T	96.6	Very high	95.7	Very high	8 Å²	8	56.1 Å²	56.1	5%	0.049	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-38.4	177.8	60.7	0	0	0	0	112.6	P466 L467 M468 S474 M513	P466-T470 PolarHBondContact O-N 3.32Å; P466-T470 VanDerWaalsContact O-N 3.12Å; L467-T470 PolarHBondContact O-N 3.49Å; L467-T470 PolarHBondContact O-OG1 2.85Å; M468-T470 VanDerWaalsContact C-N 3.33Å; M468-T470 PolarHBondContact O-N 2.85Å; T470-S474 PolarHBondContact O-N 3.44Å; T470-M513 HydrophobicContact CG2-CE 4.12Å; T470-M513 HydrophobicContact CG2-SD 3.96Å
471	Y	98	Very high	96	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-71.9	-40.3	176.3	-67.7	-50.5	0	0	0	112.7	H417 L467 M468 C469 I473 S474 A475 Y507 S510 Q571 L575	H417-Y471 AromaticContact ND1-CE1 3.84Å; H417-Y471 AromaticContact ND1-CZ 3.9Å; H417-Y471 PolarHBondContact ND1-OH 2.77Å; L467-Y471 HydrophobicContact CD1-CD2 4.44Å; L467-Y471 HydrophobicContact CD1-CE2 3.71Å; L467-Y471 HydrophobicContact CD2-CE2 4.45Å; L467-Y471 HydrophobicContact CG-CD2 4.34Å; L467-Y471 HydrophobicContact CG-CE2 3.79Å; L467-Y471 WeakPolarHBondContact O-CD2 3.26Å; L467-Y471 PolarHBondContact O-N 3.38Å; M468-Y471 PolarHBondContact O-N 3.24Å; C469-Y471 VanDerWaalsContact C-N 3.3Å; C469-Y471 PolarHBondContact O-N 3.4Å; Y471-I473 PolarHBondContact O-N 3.06Å; Y471-S474 WeakPolarHBondContact CA-OG 3.34Å; Y471-S474 PolarHBondContact O-N 2.94Å; Y471-S474 PolarHBondContact O-OG 3.34Å; Y471-A475 PolarHBondContact O-N 3.44Å; Y471-Y507 AromaticContact CD1-CE1 4Å; Y471-Y507 HydrophobicContact CD1-CE1 4Å; Y471-Y507 HydrophobicContact CE1-CD1 4.11Å; Y471-Y507 AromaticContact CE1-CE1 3.68Å; Y471-Y507 HydrophobicContact CE1-CE1 3.68Å; Y471-S510 WeakPolarHBondContact CE1-OG 3.3Å; Y471-Q571 HydrophobicContact CD1-CB 4.41Å; Y471-Q571 HydrophobicContact CD2-CB 4.09Å; Y471-Q571 HydrophobicContact CE2-CB 4.33Å; Y471-Q571 HydrophobicContact CG-CB 4.12Å; Y471-Q571 VanDerWaalsContact CZ-OE1 3.23Å; Y471-L575 HydrophobicContact CD2-CD1 3.64Å; Y471-L575 HydrophobicContact CE2-CD1 3.75Å
472	I	98	Very high	96.4	Very high	82 Å²	82	43.5 Å²	43.5	42%	0.421	21%	0.213	S	C	.	.	H	α-helix	trans	-62.6	-44.5	176.1	-66.5	166.5	0	0	0	110.8	M468 C469 S474 A475 I476 A572	M468-I472 WeakPolarHBondContact O-CG1 3.39Å; M468-I472 PolarHBondContact O-N 2.96Å; C469-I472 PolarHBondContact O-N 3.39Å; I472-S474 VanDerWaalsContact C-N 3.32Å; I472-S474 PolarHBondContact O-N 3.29Å; I472-A475 WeakPolarHBondContact O-CB 3.47Å; I472-A475 PolarHBondContact O-N 3.08Å; I472-I476 HydrophobicContact CG2-CD1 4Å; I472-I476 WeakPolarHBondContact O-CG1 3.35Å; I472-I476 PolarHBondContact O-N 2.97Å; I472-A572 HydrophobicContact CG1-CB 4.06Å
473	I	98	Very high	96.7	Very high	83 Å²	83	40 Å²	40	43%	0.426	21%	0.206	S	C	.	.	H	α-helix	trans	-61.2	-43.1	175.8	-66	165.5	0	0	0	110.5	C469 Y471 A475 I476 L477 T506	C469-I473 VanDerWaalsContact O-CG1 3.28Å; C469-I473 WeakPolarHBondContact O-CG1 3.41Å; C469-I473 PolarHBondContact O-N 2.87Å; Y471-I473 PolarHBondContact O-N 3.06Å; I473-A475 VanDerWaalsContact C-N 3.33Å; I473-A475 PolarHBondContact O-N 3.39Å; I473-I476 PolarHBondContact O-N 3.25Å; I473-L477 HydrophobicContact CG2-CD1 3.98Å; I473-L477 HydrophobicContact CG2-CG 4.43Å; I473-L477 WeakPolarHBondContact O-CG 3.28Å; I473-L477 PolarHBondContact O-N 2.8Å; I473-T506 HydrophobicContact CB-CG2 4.42Å; I473-T506 HydrophobicContact CG2-CG2 3.95Å
474	S	98	Very high	96.9	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61	-41.4	175.9	75.1	0	0	0	0	112.3	T470 Y471 I472 I476 L477 L478 T506 Y507 A568	T470-S474 PolarHBondContact O-N 3.44Å; Y471-S474 WeakPolarHBondContact CA-OG 3.34Å; Y471-S474 PolarHBondContact O-N 2.94Å; Y471-S474 PolarHBondContact O-OG 3.34Å; I472-S474 VanDerWaalsContact C-N 3.32Å; I472-S474 PolarHBondContact O-N 3.29Å; S474-I476 PolarHBondContact O-N 3.37Å; S474-L477 PolarHBondContact O-N 3.36Å; S474-L478 WeakPolarHBondContact O-CB 3.29Å; S474-L478 WeakPolarHBondContact O-CD1 3.46Å; S474-L478 WeakPolarHBondContact O-CG 3.29Å; S474-L478 PolarHBondContact O-N 3.49Å; S474-T506 WeakPolarHBondContact CB-OG1 3.43Å; S474-Y507 WeakPolarHBondContact OG-CE2 3.39Å; S474-A568 WeakPolarHBondContact OG-CB 3.32Å
475	A	98.4	Very high	96.9	Very high	6 Å²	6	39 Å²	39	5%	0.05	20%	0.203	C	C	.	.	H	α-helix	trans	-61.8	-45.3	177.7	0	0	0	0	0	111.5	Y471 I472 I473 L478 C479 S565 A568 I569	Y471-A475 PolarHBondContact O-N 3.44Å; I472-A475 WeakPolarHBondContact O-CB 3.47Å; I472-A475 PolarHBondContact O-N 3.08Å; I473-A475 VanDerWaalsContact C-N 3.33Å; I473-A475 PolarHBondContact O-N 3.39Å; A475-L478 PolarHBondContact O-N 2.9Å; A475-C479 WeakPolarHBondContact O-CB 3.33Å; A475-C479 PolarHBondContact O-N 3.36Å; A475-S565 PolarHBondContact O-OG 2.92Å; A475-A568 HydrophobicContact CB-CB 3.85Å; A475-I569 HydrophobicContact CB-CD1 4.45Å; A475-I569 HydrophobicContact CB-CG1 3.7Å
476	I	98.3	Very high	96.8	Very high	93 Å²	93	35.7 Å²	35.7	48%	0.477	19%	0.19	S	C	.	.	H	α-helix	trans	-61.9	-49.1	178.8	-65.7	165.5	0	0	0	110.5	I472 I473 S474 L478 C479 I480	I472-I476 HydrophobicContact CG2-CD1 4Å; I472-I476 WeakPolarHBondContact O-CG1 3.35Å; I472-I476 PolarHBondContact O-N 2.97Å; I473-I476 PolarHBondContact O-N 3.25Å; S474-I476 PolarHBondContact O-N 3.37Å; I476-L478 PolarHBondContact O-N 3.29Å; I476-C479 PolarHBondContact O-N 3.43Å; I476-I480 HydrophobicContact CG2-CD1 3.76Å; I476-I480 HydrophobicContact CG2-CG1 4.49Å; I476-I480 VanDerWaalsContact O-CG1 3.28Å; I476-I480 WeakPolarHBondContact O-CG1 3.4Å; I476-I480 PolarHBondContact O-N 3.38Å
477	L	98.1	Very high	96.8	Very high	50 Å²	50	41.6 Å²	41.6	26%	0.262	22%	0.221	S	C	.	.	H	α-helix	trans	-61.2	-46.1	-179.8	-70.7	173.1	0	0	0	112.2	I473 S474 I480 G481 C499 A503	I473-L477 HydrophobicContact CG2-CD1 3.98Å; I473-L477 HydrophobicContact CG2-CG 4.43Å; I473-L477 WeakPolarHBondContact O-CG 3.28Å; I473-L477 PolarHBondContact O-N 2.8Å; S474-L477 PolarHBondContact O-N 3.36Å; L477-I480 PolarHBondContact O-N 2.83Å; L477-G481 PolarHBondContact O-N 2.95Å; L477-C499 WeakPolarHBondContact O-CB 3.14Å; L477-A503 HydrophobicContact CB-CB 4.34Å
478	L	98.2	Very high	96.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.5	-38	178.7	-65.5	168.2	0	0	0	111.5	I424 S474 A475 I476 G481 G482 A503 Y507 V561	I424-L478 HydrophobicContact CD1-CD1 3.98Å; I424-L478 HydrophobicContact CD1-CD2 3.78Å; I424-L478 HydrophobicContact CG1-CD2 4.26Å; S474-L478 WeakPolarHBondContact O-CB 3.29Å; S474-L478 WeakPolarHBondContact O-CD1 3.46Å; S474-L478 WeakPolarHBondContact O-CG 3.29Å; S474-L478 PolarHBondContact O-N 3.49Å; A475-L478 PolarHBondContact O-N 2.9Å; I476-L478 PolarHBondContact O-N 3.29Å; L478-G481 PolarHBondContact O-N 2.88Å; L478-G482 PolarHBondContact O-N 3.05Å; L478-A503 HydrophobicContact CD1-CB 4.07Å; L478-A503 HydrophobicContact CD2-CB 3.63Å; L478-A503 HydrophobicContact CG-CB 3.59Å; L478-Y507 HydrophobicContact CD1-CE2 4.27Å; L478-V561 HydrophobicContact CB-CG1 3.85Å; L478-V561 HydrophobicContact CD2-CG1 3.66Å; L478-V561 HydrophobicContact CG-CG1 4.35Å; L478-V561 VanDerWaalsContact O-CG1 3.32Å; L478-V561 WeakPolarHBondContact O-CG1 3.35Å
479	C	97.8	Very high	96.3	Very high	54 Å²	54	55.4 Å²	55.4	37%	0.365	28%	0.275	S	S	.	.	H	α-helix	trans	-61.2	-48.8	175.1	-166.4	0	0	0	0	111.2	A475 I476 G481 G482 V483	A475-C479 WeakPolarHBondContact O-CB 3.33Å; A475-C479 PolarHBondContact O-N 3.36Å; I476-C479 PolarHBondContact O-N 3.43Å; C479-G481 PolarHBondContact O-N 3.18Å; C479-G482 PolarHBondContact O-N 3.01Å; C479-V483 WeakPolarHBondContact O-CB 3.27Å; C479-V483 VanDerWaalsContact O-CG2 3.3Å; C479-V483 WeakPolarHBondContact O-CG2 3.5Å; C479-V483 PolarHBondContact O-N 3.28Å
480	I	97.2	Very high	95.9	Very high	93 Å²	93	54.9 Å²	54.9	48%	0.477	27%	0.271	S	S	.	.	H	α-helix	trans	-58.9	-50.1	178.2	-67.7	166.2	0	0	0	110.5	I476 L477 Y484	I476-I480 HydrophobicContact CG2-CD1 3.76Å; I476-I480 HydrophobicContact CG2-CG1 4.49Å; I476-I480 VanDerWaalsContact O-CG1 3.28Å; I476-I480 WeakPolarHBondContact O-CG1 3.4Å; I476-I480 PolarHBondContact O-N 3.38Å; L477-I480 PolarHBondContact O-N 2.83Å; I480-Y484 WeakPolarHBondContact O-CB 3.23Å; I480-Y484 PolarHBondContact O-N 2.66Å
481	G	96	Very high	95.4	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.2	-44.6	-179.7	0	0	0	0	0	113.1	L477 L478 C479 T485	L477-G481 PolarHBondContact O-N 2.95Å; L478-G481 PolarHBondContact O-N 2.88Å; C479-G481 PolarHBondContact O-N 3.18Å; G481-T485 WeakPolarHBondContact O-CB 3.18Å; G481-T485 PolarHBondContact O-N 2.99Å; G481-T485 VanDerWaalsContact O-N 3.14Å; G481-T485 PolarHBondContact O-OG1 3.42Å
482	G	95.9	Very high	94.9	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65.9	-49.1	179.5	0	0	0	0	0	112.7	L478 C479 Y484 T485 L486	L478-G482 PolarHBondContact O-N 3.05Å; C479-G482 PolarHBondContact O-N 3.01Å; G482-Y484 PolarHBondContact O-N 2.78Å; G482-T485 PolarHBondContact O-N 2.92Å; G482-L486 PolarHBondContact O-N 3.16Å
483	V	96.5	Very high	94.6	Very high	61 Å²	61	62.4 Å²	62.4	37%	0.37	31%	0.314	S	S	.	.	H	α-helix	trans	-64.9	-41.1	179.5	172.8	0	0	0	0	111.2	C479 T485 L486 L487 L562	C479-V483 WeakPolarHBondContact O-CB 3.27Å; C479-V483 VanDerWaalsContact O-CG2 3.3Å; C479-V483 WeakPolarHBondContact O-CG2 3.5Å; C479-V483 PolarHBondContact O-N 3.28Å; V483-T485 VanDerWaalsContact C-N 3.33Å; V483-T485 PolarHBondContact O-N 3.39Å; V483-L486 PolarHBondContact O-N 3.07Å; V483-L487 HydrophobicContact CG1-CD1 3.6Å; V483-L487 HydrophobicContact CG1-CG 4.16Å; V483-L487 WeakPolarHBondContact O-CB 3.36Å; V483-L487 WeakPolarHBondContact O-CG 3.32Å; V483-L487 PolarHBondContact O-N 2.92Å; V483-L562 HydrophobicContact CG2-CD2 3.93Å
484	Y	95.7	Very high	94.3	Very high	81 Å²	81	62 Å²	62	32%	0.318	31%	0.312	S	S	.	.	H	α-helix	trans	-57.9	-46.7	176.2	174.4	-98.7	0	0	0	111.8	I480 G482 W488 P490 V495	I480-Y484 WeakPolarHBondContact O-CB 3.23Å; I480-Y484 PolarHBondContact O-N 2.66Å; G482-Y484 PolarHBondContact O-N 2.78Å; Y484-W488 AromaticContact CD2-CD1 3.61Å; Y484-W488 HydrophobicContact CD2-CG 4.18Å; Y484-W488 HydrophobicContact CE2-CB 4.26Å; Y484-W488 AromaticContact CE2-CD1 3.9Å; Y484-W488 HydrophobicContact CE2-CG 4.04Å; Y484-W488 WeakPolarHBondContact O-CB 3.45Å; Y484-W488 PolarHBondContact O-N 3.26Å; Y484-P490 HydrophobicContact CE1-CB 4.35Å; Y484-P490 HydrophobicContact CE1-CG 3.89Å; Y484-V495 HydrophobicContact CD1-CB 3.65Å; Y484-V495 HydrophobicContact CD1-CG1 3.67Å; Y484-V495 HydrophobicContact CD1-CG2 4.17Å; Y484-V495 HydrophobicContact CE1-CB 3.53Å; Y484-V495 HydrophobicContact CE1-CG1 4Å; Y484-V495 HydrophobicContact CE1-CG2 3.6Å; Y484-V495 HydrophobicContact CG-CB 4.46Å; Y484-V495 HydrophobicContact CG-CG1 4.03Å
485	T	94.7	Very high	94.2	Very high	4 Å²	4	64.4 Å²	64.4	3%	0.025	33%	0.327	C	S	.	.	H	α-helix	trans	-65	-43	-179	-52.5	0	0	0	0	111.5	G481 G482 V483 K489 L496 H557	G481-T485 WeakPolarHBondContact O-CB 3.18Å; G481-T485 PolarHBondContact O-N 2.99Å; G481-T485 VanDerWaalsContact O-N 3.14Å; G481-T485 PolarHBondContact O-OG1 3.42Å; G482-T485 PolarHBondContact O-N 2.92Å; V483-T485 VanDerWaalsContact C-N 3.33Å; V483-T485 PolarHBondContact O-N 3.39Å; T485-K489 WeakPolarHBondContact O-CA 3.44Å; T485-K489 PolarHBondContact O-N 2.98Å; T485-K489 VanDerWaalsContact O-N 3.11Å; T485-L496 HydrophobicContact CG2-CD2 4.09Å; T485-H557 WeakPolarHBondContact CG2-CD2 3.32Å; T485-H557 WeakPolarHBondContact CG2-O 3.08Å
486	L	93.4	Very high	94	Very high	49 Å²	49	64.1 Å²	64.1	26%	0.257	33%	0.325	S	S	.	.	H	α-helix	trans	-63.9	-44	179.6	-127.3	75	0	0	0	112.5	G482 V483 E556 H557 L562	G482-L486 PolarHBondContact O-N 3.16Å; V483-L486 PolarHBondContact O-N 3.07Å; L486-E556 HydrophobicContact CD1-CB 4.09Å; L486-H557 WeakPolarHBondContact CD1-O 3.39Å; L486-L562 HydrophobicContact CD2-CD1 4.22Å
487	L	93.7	Very high	93.9	Very high	131 Å²	131	60.1 Å²	60.1	69%	0.686	30%	0.304	S	S	*	.	H	α-helix	trans	-80.3	-41.8	-174	-67.2	178.9	0	0	0	113.2	V483	V483-L487 HydrophobicContact CG1-CD1 3.6Å; V483-L487 HydrophobicContact CG1-CG 4.16Å; V483-L487 WeakPolarHBondContact O-CB 3.36Å; V483-L487 WeakPolarHBondContact O-CG 3.32Å; V483-L487 PolarHBondContact O-N 2.92Å
488	W	92.9	Very high	93.8	Very high	190 Å²	190	63.6 Å²	63.6	72%	0.72	32%	0.322	S	S	*	.	H	α-helix	trans	-99	-14.6	-170.1	-65.5	90.2	0	0	0	114.1	Y484 P490	Y484-W488 AromaticContact CD2-CD1 3.61Å; Y484-W488 HydrophobicContact CD2-CG 4.18Å; Y484-W488 HydrophobicContact CE2-CB 4.26Å; Y484-W488 AromaticContact CE2-CD1 3.9Å; Y484-W488 HydrophobicContact CE2-CG 4.04Å; Y484-W488 WeakPolarHBondContact O-CB 3.45Å; Y484-W488 PolarHBondContact O-N 3.26Å; W488-P490 VanDerWaalsContact C-N 3.33Å
489	K	89.5	Confident	93.8	Very high	138 Å²	138	64.2 Å²	64.2	60%	0.6	33%	0.326	S	S	*	.			trans	39.8	57	-178.9	-60.5	-171.4	177.5	-172.6	0	112.5	T485 E556	T485-K489 WeakPolarHBondContact O-CA 3.44Å; T485-K489 PolarHBondContact O-N 2.98Å; T485-K489 VanDerWaalsContact O-N 3.11Å; K489-E556 IonicContact NZ-OE1 3.85Å; K489-E556 PolarHBondContact NZ-OE1 3.03Å
490	P	89.9	Confident	93.7	Very high	30 Å²	30	61.8 Å²	61.8	20%	0.195	31%	0.309	C	S	.	.			trans	-64	151.1	-176.1	30.9	-37.5	0	0	0	111.2	Y484 W488 T492	Y484-P490 HydrophobicContact CE1-CB 4.35Å; Y484-P490 HydrophobicContact CE1-CG 3.89Å; W488-P490 VanDerWaalsContact C-N 3.33Å; P490-T492 VanDerWaalsContact C-N 3.31Å; P490-T492 PolarHBondContact O-N 3.39Å
491	L	85.3	Confident	93.7	Very high	172 Å²	172	58 Å²	58	90%	0.901	29%	0.29	S	S	*	.	S	Bend	trans	-68.4	-29.6	175.7	-74.2	160.5	0	0	0	113
492	T	87.3	Confident	93.8	Very high	75 Å²	75	59 Å²	59	46%	0.46	30%	0.3	S	S	.	.	S	Bend	trans	-126.4	132.6	179.3	59.3	0	0	0	0	110.5	P490 N494	P490-T492 VanDerWaalsContact C-N 3.31Å; P490-T492 PolarHBondContact O-N 3.39Å; T492-N494 PolarHBondContact O-N 3.44Å
493	D	91.8	Very high	93.9	Very high	1 Å²	1	59 Å²	59	1%	0.005	30%	0.3	C	S	.	.			trans	-85	39.2	-172.4	-67.4	-34.5	0	0	0	114	I431 N432 V495 L496 N497 H557	I431-D493 HydrophobicContact CG2-CB 3.77Å; N432-D493 WeakPolarHBondContact CA-OD2 3.06Å; N432-D493 WeakPolarHBondContact CB-OD2 3.31Å; N432-D493 PolarHBondContact N-OD2 3.4Å; N432-D493 PolarHBondContact ND2-OD2 3.5Å; D493-V495 PolarHBondContact O-N 3.33Å; D493-L496 HydrophobicContact CB-CB 4.15Å; D493-L496 HydrophobicContact CB-CD2 4.31Å; D493-L496 PolarHBondContact O-N 2.69Å; D493-N497 WeakPolarHBondContact O-CB 3.45Å; D493-N497 PolarHBondContact O-N 3.27Å; D493-H557 IonicContact OD1-CD2 3.72Å; D493-H557 IonicContact OD1-NE2 2.83Å; D493-H557 PolarHBondContact OD1-NE2 3.02Å; D493-H557 IonicContact OD2-CD2 3.46Å; D493-H557 IonicContact OD2-CE1 2.75Å; D493-H557 IonicContact OD2-NE2 3.87Å; D493-H557 PolarHBondContact OD2-NE2 3.1Å
494	N	92.7	Very high	93.9	Very high	74 Å²	74	56 Å²	56	40%	0.396	28%	0.283	S	S	.	.	H	α-helix	trans	-61.8	-48.4	-175.8	-68	-14.1	0	0	0	111.9	T492 N497 I498	T492-N494 PolarHBondContact O-N 3.44Å; N494-N497 PolarHBondContact O-N 2.98Å; N494-I498 WeakPolarHBondContact O-CD1 3.48Å; N494-I498 VanDerWaalsContact O-CG1 3.23Å; N494-I498 WeakPolarHBondContact O-CG1 3.45Å; N494-I498 PolarHBondContact O-N 2.95Å
495	V	94.4	Very high	93.9	Very high	50 Å²	50	54.6 Å²	54.6	30%	0.303	28%	0.28	S	S	.	.	H	α-helix	trans	-64.9	-45.1	179.9	178.3	0	0	0	0	110.6	Y484 D493 N497 I498 C499	Y484-V495 HydrophobicContact CD1-CB 3.65Å; Y484-V495 HydrophobicContact CD1-CG1 3.67Å; Y484-V495 HydrophobicContact CD1-CG2 4.17Å; Y484-V495 HydrophobicContact CE1-CB 3.53Å; Y484-V495 HydrophobicContact CE1-CG1 4Å; Y484-V495 HydrophobicContact CE1-CG2 3.6Å; Y484-V495 HydrophobicContact CG-CB 4.46Å; Y484-V495 HydrophobicContact CG-CG1 4.03Å; D493-V495 PolarHBondContact O-N 3.33Å; V495-N497 PolarHBondContact O-N 3.44Å; V495-I498 PolarHBondContact O-N 3.1Å; V495-C499 WeakPolarHBondContact O-CB 3.42Å; V495-C499 PolarHBondContact O-N 3.03Å; V495-C499 PolarHBondContact O-SG 3.21Å; V495-C499 VanDerWaalsContact O-SG 3.4Å
496	L	95.8	Very high	94	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-59.1	-47.2	177	-177	60.8	0	0	0	111.2	F427 T485 D493 I498 C499 C500 V561	F427-L496 HydrophobicContact CE1-CD2 4.02Å; F427-L496 HydrophobicContact CZ-CD2 4.48Å; T485-L496 HydrophobicContact CG2-CD2 4.09Å; D493-L496 HydrophobicContact CB-CB 4.15Å; D493-L496 HydrophobicContact CB-CD2 4.31Å; D493-L496 PolarHBondContact O-N 2.69Å; L496-I498 PolarHBondContact O-N 3.25Å; L496-C499 PolarHBondContact O-N 3.17Å; L496-C500 WeakPolarHBondContact O-CB 3.36Å; L496-C500 PolarHBondContact O-N 3.28Å; L496-C500 PolarHBondContact O-SG 3.03Å; L496-C500 VanDerWaalsContact O-SG 3.33Å; L496-V561 HydrophobicContact CD1-CB 4.47Å; L496-V561 HydrophobicContact CD1-CG1 4.34Å; L496-V561 HydrophobicContact CD1-CG2 4.03Å
497	N	95.6	Very high	94.2	Very high	9 Å²	9	52.9 Å²	52.9	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-61.9	-42.5	178.3	-171.9	39	0	0	0	112	I431 D493 N494 V495 N501	I431-N497 HydrophobicContact CD1-CB 4.4Å; I431-N497 HydrophobicContact CG2-CB 4.14Å; D493-N497 WeakPolarHBondContact O-CB 3.45Å; D493-N497 PolarHBondContact O-N 3.27Å; N494-N497 PolarHBondContact O-N 2.98Å; V495-N497 PolarHBondContact O-N 3.44Å; N497-N501 WeakPolarHBondContact O-CB 3.24Å; N497-N501 PolarHBondContact O-N 3.24Å; N497-N501 PolarHBondContact O-ND2 3.16Å; N497-N501 PolarHBondContact OD1-ND2 3.08Å
498	I	96.1	Very high	94.2	Very high	122 Å²	122	47 Å²	47	63%	0.626	24%	0.241	S	C	*	.	H	α-helix	trans	-62.9	-47.9	175.9	-68.8	164.2	0	0	0	110.7	N494 V495 L496 N501 G502	N494-I498 WeakPolarHBondContact O-CD1 3.48Å; N494-I498 VanDerWaalsContact O-CG1 3.23Å; N494-I498 WeakPolarHBondContact O-CG1 3.45Å; N494-I498 PolarHBondContact O-N 2.95Å; V495-I498 PolarHBondContact O-N 3.1Å; L496-I498 PolarHBondContact O-N 3.25Å; I498-N501 PolarHBondContact O-N 3.14Å; I498-G502 PolarHBondContact O-N 2.97Å
499	C	97	Very high	94.3	Very high	13 Å²	13	38 Å²	38	9%	0.088	21%	0.207	C	C	.	.	H	α-helix	trans	-61.5	-47	178.5	-76.7	0	0	0	0	112.4	L477 V495 L496 G502 A503	L477-C499 WeakPolarHBondContact O-CB 3.14Å; V495-C499 WeakPolarHBondContact O-CB 3.42Å; V495-C499 PolarHBondContact O-N 3.03Å; V495-C499 PolarHBondContact O-SG 3.21Å; V495-C499 VanDerWaalsContact O-SG 3.4Å; L496-C499 PolarHBondContact O-N 3.17Å; C499-G502 PolarHBondContact O-N 3.46Å; C499-A503 WeakPolarHBondContact O-CB 3.27Å; C499-A503 PolarHBondContact O-N 2.92Å
500	C	97.2	Very high	94.6	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.02	18%	0.178	C	C	.	.	H	α-helix	trans	-61.6	-43.8	177.3	-75.1	0	0	0	0	112	I424 L496 A503 L504	I424-C500 HydrophobicContact CG2-CB 4.03Å; L496-C500 WeakPolarHBondContact O-CB 3.36Å; L496-C500 PolarHBondContact O-N 3.28Å; L496-C500 PolarHBondContact O-SG 3.03Å; L496-C500 VanDerWaalsContact O-SG 3.33Å; C500-A503 PolarHBondContact O-N 3.21Å; C500-L504 WeakPolarHBondContact O-CB 3.47Å; C500-L504 PolarHBondContact O-N 3.32Å
501	N	96.7	Very high	94.8	Very high	13 Å²	13	32.5 Å²	32.5	7%	0.07	19%	0.185	C	C	.	.	H	α-helix	trans	-70.6	-37.9	177.7	-79	-76.5	0	0	0	112.4	I441 N442 T445 N497 I498 A503 L504 I505	I441-N501 HydrophobicContact CG2-CB 4.06Å; N442-N501 VanDerWaalsContact CA-OD1 3.26Å; N442-N501 WeakPolarHBondContact CA-OD1 3.38Å; N442-N501 PolarHBondContact N-OD1 2.81Å; T445-N501 HydrophobicContact CG2-CB 4.3Å; N497-N501 WeakPolarHBondContact O-CB 3.24Å; N497-N501 PolarHBondContact O-N 3.24Å; N497-N501 PolarHBondContact O-ND2 3.16Å; N497-N501 PolarHBondContact OD1-ND2 3.08Å; I498-N501 PolarHBondContact O-N 3.14Å; N501-A503 VanDerWaalsContact C-N 3.33Å; N501-A503 PolarHBondContact O-N 2.89Å; N501-L504 WeakPolarHBondContact O-CB 3.39Å; N501-L504 PolarHBondContact O-N 3.29Å; N501-L504 VanDerWaalsContact O-N 3.1Å; N501-I505 WeakPolarHBondContact O-CG1 3.38Å; N501-I505 PolarHBondContact O-N 2.9Å
502	G	97.3	Very high	95.1	Very high	21 Å²	21	26 Å²	26	22%	0.216	15%	0.151	C	C	.	.	H	α-helix	trans	-58.5	-44.7	172.4	0	0	0	0	0	112	I498 C499 L504 I505 T506	I498-G502 PolarHBondContact O-N 2.97Å; C499-G502 PolarHBondContact O-N 3.46Å; G502-L504 VanDerWaalsContact C-N 3.35Å; G502-I505 PolarHBondContact O-N 3.29Å; G502-T506 PolarHBondContact O-N 2.98Å
503	A	98	Very high	95.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66.4	-35.4	172.8	0	0	0	0	0	112.3	L477 L478 C499 C500 N501 I505 T506 Y507	L477-A503 HydrophobicContact CB-CB 4.34Å; L478-A503 HydrophobicContact CD1-CB 4.07Å; L478-A503 HydrophobicContact CD2-CB 3.63Å; L478-A503 HydrophobicContact CG-CB 3.59Å; C499-A503 WeakPolarHBondContact O-CB 3.27Å; C499-A503 PolarHBondContact O-N 2.92Å; C500-A503 PolarHBondContact O-N 3.21Å; N501-A503 VanDerWaalsContact C-N 3.33Å; N501-A503 PolarHBondContact O-N 2.89Å; A503-I505 VanDerWaalsContact C-N 3.31Å; A503-I505 PolarHBondContact O-N 3.42Å; A503-T506 PolarHBondContact O-N 2.92Å; A503-T506 PolarHBondContact O-OG1 2.84Å; A503-Y507 WeakPolarHBondContact O-CD2 3.43Å; A503-Y507 PolarHBondContact O-N 3.42Å
504	L	96.8	Very high	95.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.8	-32.6	177.2	-172.1	65.6	0	0	0	112.5	F421 I424 N442 T445 C500 N501 G502 Y507 S508	F421-L504 HydrophobicContact CD2-CD1 3.56Å; F421-L504 HydrophobicContact CE2-CD1 3.61Å; I424-L504 HydrophobicContact CG2-CB 4.36Å; I424-L504 HydrophobicContact CG2-CD1 4.48Å; N442-L504 HydrophobicContact CB-CD2 4.34Å; N442-L504 VanDerWaalsContact CG-CD2 3.43Å; N442-L504 WeakPolarHBondContact ND2-CD2 3.21Å; T445-L504 HydrophobicContact CG2-CB 4.18Å; T445-L504 HydrophobicContact CG2-CD2 3.94Å; T445-L504 HydrophobicContact CG2-CG 4.19Å; T445-L504 WeakPolarHBondContact OG1-CD2 3.19Å; C500-L504 WeakPolarHBondContact O-CB 3.47Å; C500-L504 PolarHBondContact O-N 3.32Å; N501-L504 WeakPolarHBondContact O-CB 3.39Å; N501-L504 PolarHBondContact O-N 3.29Å; N501-L504 VanDerWaalsContact O-N 3.1Å; G502-L504 VanDerWaalsContact C-N 3.35Å; L504-Y507 PolarHBondContact O-N 3.04Å; L504-S508 VanDerWaalsContact O-CB 3.3Å; L504-S508 WeakPolarHBondContact O-CB 3.27Å; L504-S508 PolarHBondContact O-N 3.03Å
505	I	96.8	Very high	95.3	Very high	50 Å²	50	21.6 Å²	21.6	26%	0.256	13%	0.129	S	C	.	.	H	α-helix	trans	-60.9	-47.3	171.6	-66	170.4	0	0	0	110.2	T445 P448 G449 N501 G502 A503 S508 A509	T445-I505 HydrophobicContact CG2-CG1 3.77Å; P448-I505 HydrophobicContact CB-CG2 4.01Å; P448-I505 HydrophobicContact CG-CD1 3.8Å; P448-I505 HydrophobicContact CG-CG1 3.81Å; P448-I505 HydrophobicContact CG-CG2 3.94Å; G449-I505 WeakPolarHBondContact CA-O 3.42Å; N501-I505 WeakPolarHBondContact O-CG1 3.38Å; N501-I505 PolarHBondContact O-N 2.9Å; G502-I505 PolarHBondContact O-N 3.29Å; A503-I505 VanDerWaalsContact C-N 3.31Å; A503-I505 PolarHBondContact O-N 3.42Å; I505-S508 PolarHBondContact O-N 3.23Å; I505-A509 PolarHBondContact O-N 3.31Å
506	T	97	Very high	95.1	Very high	18 Å²	18	22.5 Å²	22.5	11%	0.11	13%	0.131	C	C	.	.	H	α-helix	trans	-69.3	-35	178.7	60.9	0	0	0	0	112	I473 S474 G502 A503 A509 S510	I473-T506 HydrophobicContact CB-CG2 4.42Å; I473-T506 HydrophobicContact CG2-CG2 3.95Å; S474-T506 WeakPolarHBondContact CB-OG1 3.43Å; G502-T506 PolarHBondContact O-N 2.98Å; A503-T506 PolarHBondContact O-N 2.92Å; A503-T506 PolarHBondContact O-OG1 2.84Å; T506-A509 PolarHBondContact O-N 3.28Å; T506-S510 WeakPolarHBondContact O-CB 3.39Å; T506-S510 PolarHBondContact O-N 2.96Å; T506-S510 PolarHBondContact O-OG 3.33Å
507	Y	96.8	Very high	95	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-67.6	-36	171.7	-90.8	-75.4	0	0	0	113.2	H417 A420 F421 I424 Y471 S474 L478 A503 L504 A509 S510 T511 A568 Q571	H417-Y507 AromaticContact CE1-CD1 3.78Å; H417-Y507 PolarHBondContact CE1-O 3.44Å; H417-Y507 AromaticContact ND1-CD1 3.75Å; A420-Y507 HydrophobicContact CB-CD1 4.45Å; A420-Y507 HydrophobicContact CB-CE1 3.68Å; A420-Y507 HydrophobicContact CB-CE2 3.76Å; A420-Y507 VanDerWaalsContact CB-OH 3.23Å; A420-Y507 WeakPolarHBondContact CB-OH 3.5Å; F421-Y507 HydrophobicContact CB-CD1 4.41Å; I424-Y507 HydrophobicContact CD1-CD2 4.19Å; I424-Y507 HydrophobicContact CD1-CE2 4.28Å; Y471-Y507 AromaticContact CD1-CE1 4Å; Y471-Y507 HydrophobicContact CD1-CE1 4Å; Y471-Y507 HydrophobicContact CE1-CD1 4.11Å; Y471-Y507 AromaticContact CE1-CE1 3.68Å; Y471-Y507 HydrophobicContact CE1-CE1 3.68Å; S474-Y507 WeakPolarHBondContact OG-CE2 3.39Å; L478-Y507 HydrophobicContact CD1-CE2 4.27Å; A503-Y507 WeakPolarHBondContact O-CD2 3.43Å; A503-Y507 PolarHBondContact O-N 3.42Å; L504-Y507 PolarHBondContact O-N 3.04Å; Y507-A509 VanDerWaalsContact C-N 3.34Å; Y507-S510 VanDerWaalsContact CA-OG 3.29Å; Y507-S510 WeakPolarHBondContact CA-OG 3.22Å; Y507-S510 PolarHBondContact O-N 3.24Å; Y507-S510 PolarHBondContact O-OG 3.34Å; Y507-S510 VanDerWaalsContact O-OG 3.06Å; Y507-T511 PolarHBondContact O-N 3.45Å; Y507-T511 PolarHBondContact O-OG1 3.49Å; Y507-A568 WeakPolarHBondContact OH-CB 3.49Å; Y507-Q571 PolarHBondContact OH-NE2 2.83Å
508	S	94.4	Very high	94.8	Very high	7 Å²	7	22.1 Å²	22.1	5%	0.049	13%	0.129	C	C	.	.	H	α-helix	trans	-66.5	-38.4	173.7	-177.8	0	0	0	0	111.1	L504 I505	L504-S508 VanDerWaalsContact O-CB 3.3Å; L504-S508 WeakPolarHBondContact O-CB 3.27Å; L504-S508 PolarHBondContact O-N 3.03Å; I505-S508 PolarHBondContact O-N 3.23Å
509	A	94.6	Very high	94.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64.7	-47.8	171.8	0	0	0	0	0	110.9	G449 T452 A453 I505 T506 Y507 T511 I512 M513	G449-A509 WeakPolarHBondContact O-CA 3.41Å; G449-A509 VanDerWaalsContact O-CB 3.23Å; G449-A509 WeakPolarHBondContact O-CB 3.49Å; T452-A509 HydrophobicContact CG2-CB 4.24Å; A453-A509 HydrophobicContact CB-CB 4.15Å; I505-A509 PolarHBondContact O-N 3.31Å; T506-A509 PolarHBondContact O-N 3.28Å; Y507-A509 VanDerWaalsContact C-N 3.34Å; A509-T511 VanDerWaalsContact C-N 3.25Å; A509-T511 PolarHBondContact O-N 2.86Å; A509-I512 PolarHBondContact O-N 3.21Å; A509-I512 VanDerWaalsContact O-N 3.16Å; A509-M513 HydrophobicContact CB-SD 4.34Å; A509-M513 WeakPolarHBondContact O-CG 3.32Å; A509-M513 PolarHBondContact O-N 2.92Å
510	S	95.5	Very high	94.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-65.7	-26.5	-178.5	74.7	0	0	0	0	112.8	H417 Y471 T506 Y507 I512 M513 L514	H417-S510 PolarHBondContact CE1-OG 2.83Å; H417-S510 PolarHBondContact ND1-OG 3.42Å; Y471-S510 WeakPolarHBondContact CE1-OG 3.3Å; T506-S510 WeakPolarHBondContact O-CB 3.39Å; T506-S510 PolarHBondContact O-N 2.96Å; T506-S510 PolarHBondContact O-OG 3.33Å; Y507-S510 VanDerWaalsContact CA-OG 3.29Å; Y507-S510 WeakPolarHBondContact CA-OG 3.22Å; Y507-S510 PolarHBondContact O-N 3.24Å; Y507-S510 PolarHBondContact O-OG 3.34Å; Y507-S510 VanDerWaalsContact O-OG 3.06Å; S510-I512 PolarHBondContact O-N 3.34Å; S510-M513 PolarHBondContact O-N 3.38Å; S510-L514 WeakPolarHBondContact O-CA 3.38Å; S510-L514 WeakPolarHBondContact O-CB 3.26Å; S510-L514 PolarHBondContact O-N 2.88Å
511	T	93.9	Very high	93.9	Very high	54 Å²	54	18 Å²	18	33%	0.331	11%	0.109	S	C	.	.	H	α-helix	trans	-57.9	-47.9	172.6	-60.1	0	0	0	0	111.1	H417 Y507 A509 S515	H417-T511 PolarHBondContact CE1-N 3.5Å; H417-T511 PolarHBondContact CE1-OG1 3.49Å; H417-T511 PolarHBondContact NE2-OG1 3.02Å; Y507-T511 PolarHBondContact O-N 3.45Å; Y507-T511 PolarHBondContact O-OG1 3.49Å; A509-T511 VanDerWaalsContact C-N 3.25Å; A509-T511 PolarHBondContact O-N 2.86Å; T511-S515 WeakPolarHBondContact O-CB 3.4Å; T511-S515 PolarHBondContact O-N 3.05Å; T511-S515 VanDerWaalsContact O-N 3.14Å
512	I	91.1	Very high	93.5	Very high	36 Å²	36	17.6 Å²	17.6	19%	0.185	11%	0.107	C	C	.	.	H	α-helix	trans	-70.5	-48.9	179.3	-66.3	163	0	0	0	109.1	V275 P450 A453 A509 S510 L514 S515 I516	V275-I512 HydrophobicContact CG1-CD1 4.48Å; P450-I512 HydrophobicContact CB-CD1 3.55Å; P450-I512 HydrophobicContact CG-CD1 3.73Å; A453-I512 HydrophobicContact CB-CB 4.1Å; A453-I512 HydrophobicContact CB-CD1 4.47Å; A453-I512 HydrophobicContact CB-CG2 4.22Å; A509-I512 PolarHBondContact O-N 3.21Å; A509-I512 VanDerWaalsContact O-N 3.16Å; S510-I512 PolarHBondContact O-N 3.34Å; I512-L514 PolarHBondContact O-N 3.28Å; I512-S515 PolarHBondContact O-N 2.9Å; I512-S515 VanDerWaalsContact O-N 3.13Å; I512-S515 PolarHBondContact O-OG 3.16Å; I512-I516 HydrophobicContact CG2-CD1 4.17Å; I512-I516 WeakPolarHBondContact O-CG1 3.19Å; I512-I516 PolarHBondContact O-N 2.82Å
513	M	92.4	Very high	92.8	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-57.6	-48.5	-179	-68.5	166.8	73.7	0	0	112.2	A453 V456 Y457 P466 L467 T470 A509 S510 S515 I516 Y517	A453-M513 HydrophobicContact CB-CG 3.84Å; A453-M513 HydrophobicContact CB-SD 4.29Å; V456-M513 HydrophobicContact CG1-CE 3.86Å; Y457-M513 HydrophobicContact CD1-CE 3.74Å; Y457-M513 HydrophobicContact CD1-CG 4.15Å; Y457-M513 HydrophobicContact CD2-CB 4.47Å; Y457-M513 HydrophobicContact CD2-CG 4.12Å; Y457-M513 HydrophobicContact CE1-CB 4.06Å; Y457-M513 HydrophobicContact CE1-CE 3.25Å; Y457-M513 HydrophobicContact CE1-CG 3.85Å; Y457-M513 HydrophobicContact CE1-SD 4.37Å; Y457-M513 VanDerWaalsContact CE2-CA 3.47Å; Y457-M513 HydrophobicContact CE2-CB 3.68Å; Y457-M513 HydrophobicContact CE2-CG 3.8Å; Y457-M513 HydrophobicContact CG-CG 4.3Å; Y457-M513 VanDerWaalsContact CZ-CB 3.44Å; Y457-M513 WeakPolarHBondContact OH-CB 3.23Å; Y457-M513 PolarHBondContact OH-O 3.06Å; P466-M513 HydrophobicContact CB-CE 3.96Å; L467-M513 HydrophobicContact CB-CE 4.19Å; L467-M513 HydrophobicContact CD1-CB 3.87Å; T470-M513 HydrophobicContact CG2-CE 4.12Å; T470-M513 HydrophobicContact CG2-SD 3.96Å; A509-M513 HydrophobicContact CB-SD 4.34Å; A509-M513 WeakPolarHBondContact O-CG 3.32Å; A509-M513 PolarHBondContact O-N 2.92Å; S510-M513 PolarHBondContact O-N 3.38Å; M513-S515 VanDerWaalsContact C-N 3.32Å; M513-S515 PolarHBondContact O-N 3.42Å; M513-I516 PolarHBondContact O-N 3.42Å; M513-Y517 WeakPolarHBondContact O-CB 3.47Å; M513-Y517 PolarHBondContact O-N 3.16Å
514	L	94.7	Very high	91.9	Very high	4 Å²	4	19 Å²	19	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-62.9	-36.3	176.9	-178.3	64.3	0	0	0	112	I413 F414 H417 L467 S510 I512 I516 S518	I413-L514 HydrophobicContact CG2-CD1 3.66Å; I413-L514 HydrophobicContact CG2-CD2 3.91Å; I413-L514 HydrophobicContact CG2-CG 4.47Å; F414-L514 HydrophobicContact CD1-CD2 3.77Å; F414-L514 HydrophobicContact CD1-CG 4.45Å; F414-L514 HydrophobicContact CD2-CD2 4.32Å; F414-L514 HydrophobicContact CE1-CD2 3.75Å; F414-L514 HydrophobicContact CE1-CG 3.99Å; F414-L514 HydrophobicContact CE2-CD2 4.32Å; F414-L514 HydrophobicContact CE2-CG 4.12Å; F414-L514 HydrophobicContact CG-CD2 4.07Å; F414-L514 HydrophobicContact CZ-CD2 4.04Å; F414-L514 HydrophobicContact CZ-CG 3.82Å; H417-L514 HydrophobicContact CB-CD2 4.14Å; L467-L514 HydrophobicContact CD1-CB 4.47Å; L467-L514 HydrophobicContact CD2-CD1 4.17Å; S510-L514 WeakPolarHBondContact O-CA 3.38Å; S510-L514 WeakPolarHBondContact O-CB 3.26Å; S510-L514 PolarHBondContact O-N 2.88Å; I512-L514 PolarHBondContact O-N 3.28Å; L514-I516 VanDerWaalsContact C-N 3.31Å; L514-I516 PolarHBondContact O-N 3.39Å; L514-S518 WeakPolarHBondContact O-CB 3.27Å; L514-S518 PolarHBondContact O-N 3.45Å; L514-S518 PolarHBondContact O-OG 3.35Å
515	S	90.3	Very high	91	Very high	53 Å²	53	25 Å²	25	37%	0.371	14%	0.137	S	C	.	.	H	α-helix	trans	-64.4	-35.6	177.5	74.8	0	0	0	0	112.6	T511 I512 M513 S518	T511-S515 WeakPolarHBondContact O-CB 3.4Å; T511-S515 PolarHBondContact O-N 3.05Å; T511-S515 VanDerWaalsContact O-N 3.14Å; I512-S515 PolarHBondContact O-N 2.9Å; I512-S515 VanDerWaalsContact O-N 3.13Å; I512-S515 PolarHBondContact O-OG 3.16Å; M513-S515 VanDerWaalsContact C-N 3.32Å; M513-S515 PolarHBondContact O-N 3.42Å; S515-S518 PolarHBondContact O-OG 3.35Å
516	I	89.8	Confident	90.2	Very high	68 Å²	68	23.4 Å²	23.4	35%	0.349	13%	0.129	S	C	.	.	H	α-helix	trans	-82.3	-44.1	178.1	-45.9	167.9	0	0	0	110.3	Y457 I512 M513 L514 S518 A519 E520	Y457-I516 HydrophobicContact CD2-CD1 4.28Å; Y457-I516 HydrophobicContact CE2-CD1 4.5Å; I512-I516 HydrophobicContact CG2-CD1 4.17Å; I512-I516 WeakPolarHBondContact O-CG1 3.19Å; I512-I516 PolarHBondContact O-N 2.82Å; M513-I516 PolarHBondContact O-N 3.42Å; L514-I516 VanDerWaalsContact C-N 3.31Å; L514-I516 PolarHBondContact O-N 3.39Å; I516-S518 PolarHBondContact O-N 3.32Å; I516-A519 WeakPolarHBondContact O-CB 3.45Å; I516-A519 PolarHBondContact O-N 3.02Å; I516-E520 PolarHBondContact O-N 3.5Å
517	Y	92.4	Very high	89.6	Confident	1 Å²	1	24.7 Å²	24.7	0%	0.004	13%	0.131	C	C	.	.	H	α-helix	trans	-59.1	-45.4	177.7	-180	-117.4	0	0	0	111.9	R463 R464 L467 M513 A519 E520 L521 L575 L578 P579 T581	R463-Y517 HydrophobicContact CB-CD2 3.91Å; R464-Y517 HydrophobicContact CB-CE2 4.29Å; L467-Y517 HydrophobicContact CD2-CD1 3.79Å; L467-Y517 HydrophobicContact CD2-CE1 4.42Å; L467-Y517 HydrophobicContact CD2-CG 4.29Å; M513-Y517 WeakPolarHBondContact O-CB 3.47Å; M513-Y517 PolarHBondContact O-N 3.16Å; Y517-A519 VanDerWaalsContact C-N 3.28Å; Y517-A519 PolarHBondContact O-N 2.92Å; Y517-E520 PolarHBondContact O-N 3.19Å; Y517-L521 HydrophobicContact CD1-CD1 4.34Å; Y517-L521 HydrophobicContact CE1-CD1 4.01Å; Y517-L521 HydrophobicContact CE2-CD2 4.41Å; Y517-L521 WeakPolarHBondContact O-CG 3.45Å; Y517-L521 PolarHBondContact O-N 3.42Å; Y517-L575 HydrophobicContact CD1-CD2 4.25Å; Y517-L575 HydrophobicContact CE1-CD2 3.68Å; Y517-L578 HydrophobicContact CE1-CB 4.47Å; Y517-L578 HydrophobicContact CE1-CD1 4.01Å; Y517-L578 VanDerWaalsContact OH-CB 3.29Å; Y517-L578 WeakPolarHBondContact OH-CB 3.41Å; Y517-P579 PolarHBondContact OH-O 2.97Å; Y517-T581 HydrophobicContact CD2-CG2 4.33Å; Y517-T581 WeakPolarHBondContact CD2-OG1 3.29Å; Y517-T581 HydrophobicContact CE2-CG2 4.02Å
518	S	92.2	Very high	88.9	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.007	16%	0.16	C	C	.	.	H	α-helix	trans	-65.1	-30.6	178	60.7	0	0	0	0	113.2	F414 L514 S515 I516 F522	F414-S518 WeakPolarHBondContact CZ-OG 3.32Å; L514-S518 WeakPolarHBondContact O-CB 3.27Å; L514-S518 PolarHBondContact O-N 3.45Å; L514-S518 PolarHBondContact O-OG 3.35Å; S515-S518 PolarHBondContact O-OG 3.35Å; I516-S518 PolarHBondContact O-N 3.32Å; S518-F522 WeakPolarHBondContact O-CD2 3.46Å; S518-F522 WeakPolarHBondContact O-CE2 3.36Å
519	A	90	Very high	88.4	Confident	22 Å²	22	31.2 Å²	31.2	18%	0.182	18%	0.177	C	C	.	.	H	α-helix	trans	-70.1	-29.3	175.9	0	0	0	0	0	113.3	I516 Y517 R527 V531	I516-A519 WeakPolarHBondContact O-CB 3.45Å; I516-A519 PolarHBondContact O-N 3.02Å; Y517-A519 VanDerWaalsContact C-N 3.28Å; Y517-A519 PolarHBondContact O-N 2.92Å; A519-R527 HydrophobicContact CB-CG 4.03Å; A519-R527 WeakPolarHBondContact O-CD 3.31Å; A519-R527 VanDerWaalsContact O-CG 3.32Å; A519-R527 WeakPolarHBondContact O-CG 3.31Å; A519-R527 PolarHBondContact O-NE 3.03Å; A519-V531 HydrophobicContact CB-CG2 3.98Å
520	E	90.4	Very high	88.1	Confident	15 Å²	15	31.6 Å²	31.6	7%	0.07	18%	0.18	C	C	.	.	H	α-helix	trans	-82.2	-18.4	-179.7	-73.9	177.3	-176	0	0	114	R463 I516 Y517 F522 T581 G583 L586	R463-E520 WeakPolarHBondContact CD-OE2 3.37Å; R463-E520 IonicContact CZ-OE1 3.57Å; R463-E520 IonicContact CZ-OE2 2.67Å; R463-E520 IonicContact NE-OE1 3.3Å; R463-E520 IonicContact NE-OE2 3.66Å; R463-E520 PolarHBondContact NE-OE2 2.93Å; R463-E520 IonicContact NH1-OE1 2.7Å; R463-E520 PolarHBondContact NH1-OE1 3.01Å; R463-E520 IonicContact NH1-OE2 2.86Å; R463-E520 PolarHBondContact NH1-OE2 3.38Å; R463-E520 IonicContact NH2-OE1 3.46Å; R463-E520 PolarHBondContact NH2-OE1 2.9Å; R463-E520 IonicContact NH2-OE2 3.94Å; I516-E520 PolarHBondContact O-N 3.5Å; Y517-E520 PolarHBondContact O-N 3.19Å; E520-F522 PolarHBondContact O-N 3.25Å; E520-T581 HydrophobicContact CB-CG2 3.94Å; E520-T581 WeakPolarHBondContact OE2-CB 3.41Å; E520-T581 PolarHBondContact OE2-OG1 3.12Å; E520-G583 WeakPolarHBondContact OE1-CA 3.21Å; E520-L586 VanDerWaalsContact O-CD1 3.31Å; E520-L586 WeakPolarHBondContact O-CD1 3.17Å
521	L	90.6	Very high	87.8	Confident	15 Å²	15	33.1 Å²	33.1	8%	0.079	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-11.7	174.5	-67.7	173.1	0	0	0	113	T406 C410 Y517 L578 P579 T581 L586	T406-L521 HydrophobicContact CG2-CB 3.9Å; T406-L521 HydrophobicContact CG2-CD1 4.17Å; T406-L521 HydrophobicContact CG2-CD2 4.47Å; T406-L521 HydrophobicContact CG2-CG 4.41Å; C410-L521 VanDerWaalsContact SG-CD1 3.51Å; Y517-L521 HydrophobicContact CD1-CD1 4.34Å; Y517-L521 HydrophobicContact CE1-CD1 4.01Å; Y517-L521 HydrophobicContact CE2-CD2 4.41Å; Y517-L521 WeakPolarHBondContact O-CG 3.45Å; Y517-L521 PolarHBondContact O-N 3.42Å; L521-L578 HydrophobicContact CD1-CD1 3.93Å; L521-L578 HydrophobicContact CD1-CD2 4.27Å; L521-P579 HydrophobicContact CD2-CG 3.68Å; L521-T581 HydrophobicContact CD2-CG2 4.1Å; L521-L586 WeakPolarHBondContact O-CD1 3.47Å
522	F	88.9	Confident	87.6	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.018	18%	0.182	C	C	.	.	S	Bend	trans	-124.6	143.2	-177.2	-56.7	-75.4	0	0	0	112.1	T406 L407 S518 E520 M526 R527 A530	T406-F522 HydrophobicContact CG2-CE1 4.2Å; T406-F522 HydrophobicContact CG2-CZ 4.09Å; L407-F522 HydrophobicContact CB-CE1 4.23Å; L407-F522 HydrophobicContact CB-CZ 4.24Å; L407-F522 HydrophobicContact CD1-CE1 4.42Å; L407-F522 HydrophobicContact CD1-CZ 4.04Å; S518-F522 WeakPolarHBondContact O-CD2 3.46Å; S518-F522 WeakPolarHBondContact O-CE2 3.36Å; E520-F522 PolarHBondContact O-N 3.25Å; F522-M526 HydrophobicContact CB-CG 4.34Å; F522-M526 HydrophobicContact CD1-SD 4.15Å; F522-R527 HydrophobicContact CB-CB 4.49Å; F522-R527 PolarHBondContact O-NE 3.35Å; F522-R527 PolarHBondContact O-NH2 3.47Å; F522-A530 HydrophobicContact CB-CB 4.28Å; F522-A530 HydrophobicContact CD1-CB 3.8Å; F522-A530 HydrophobicContact CD2-CB 3.48Å; F522-A530 VanDerWaalsContact CD2-CB 3.48Å; F522-A530 HydrophobicContact CE1-CB 3.97Å; F522-A530 HydrophobicContact CE2-CB 3.69Å; F522-A530 HydrophobicContact CG-CB 3.57Å; F522-A530 HydrophobicContact CZ-CB 3.93Å
523	P	83	Confident	87.6	Confident	7 Å²	7	32.6 Å²	32.6	5%	0.045	19%	0.189	C	C	.	.			trans	-69.1	160	174.2	29.7	-33.8	0	0	0	111.4	M403 Y525 M526 R527 L586	M403-P523 HydrophobicContact CE-CG 3.73Å; P523-Y525 VanDerWaalsContact C-N 3.3Å; P523-Y525 HydrophobicContact CB-CD1 3.95Å; P523-Y525 HydrophobicContact CB-CE1 3.68Å; P523-Y525 HydrophobicContact CG-CD1 3.99Å; P523-Y525 HydrophobicContact CG-CE1 3.37Å; P523-Y525 PolarHBondContact O-N 3.34Å; P523-Y525 VanDerWaalsContact O-N 3.17Å; P523-M526 HydrophobicContact CG-CG 3.78Å; P523-M526 HydrophobicContact CG-SD 4.19Å; P523-M526 PolarHBondContact O-N 3.24Å; P523-M526 VanDerWaalsContact O-N 3.13Å; P523-R527 WeakPolarHBondContact O-CB 3.27Å; P523-R527 PolarHBondContact O-N 3.36Å; P523-L586 HydrophobicContact CB-CB 4.37Å
524	S	79	Confident	87.7	Confident	43 Å²	43	32.6 Å²	32.6	30%	0.301	19%	0.189	S	C	.	.	H	α-helix	trans	-61.4	-35.3	-164	-47.9	0	0	0	0	113.8	M526 R527 D588	S524-M526 VanDerWaalsContact C-N 3.27Å; S524-M526 PolarHBondContact O-N 3.44Å; S524-R527 VanDerWaalsContact CA-NH1 3.33Å; S524-R527 VanDerWaalsContact CB-NH1 3.28Å; S524-R527 PolarHBondContact OG-NH1 2.02Å; S524-R527 PolarHBondContact OG-NH2 2.02Å; S524-D588 WeakPolarHBondContact CB-OD1 3.5Å; S524-D588 PolarHBondContact N-OD1 2.87Å; S524-D588 PolarHBondContact OG-OD1 3.18Å; S524-D588 VanDerWaalsContact OG-OD1 3.09Å
525	Y	76.6	Confident	87.6	Confident	127 Å²	127	33.9 Å²	33.9	50%	0.498	20%	0.195	S	C	.	.	H	α-helix	trans	-66.7	-23.4	-178.2	69.9	-94.4	0	0	0	114.4	P523	P523-Y525 VanDerWaalsContact C-N 3.3Å; P523-Y525 HydrophobicContact CB-CD1 3.95Å; P523-Y525 HydrophobicContact CB-CE1 3.68Å; P523-Y525 HydrophobicContact CG-CD1 3.99Å; P523-Y525 HydrophobicContact CG-CE1 3.37Å; P523-Y525 PolarHBondContact O-N 3.34Å; P523-Y525 VanDerWaalsContact O-N 3.17Å
526	M	80.6	Confident	87.9	Confident	17 Å²	17	31.3 Å²	31.3	8%	0.084	18%	0.178	C	C	.	.	H	α-helix	trans	-119	-7.2	178.4	60.7	159.9	68.8	0	0	113.9	S397 M403 F522 P523 S524 S528 S529 A530	S397-M526 VanDerWaalsContact OG-CE 3.3Å; S397-M526 WeakPolarHBondContact OG-CE 3.34Å; M403-M526 HydrophobicContact CE-CE 3.63Å; M403-M526 HydrophobicContact CE-CG 4.5Å; M403-M526 HydrophobicContact CE-SD 3.26Å; M403-M526 WeakPolarHBondContact CE-SD 3.44Å; M403-M526 HydrophobicContact SD-CE 3.99Å; M403-M526 HydrophobicContact SD-SD 4.32Å; F522-M526 HydrophobicContact CB-CG 4.34Å; F522-M526 HydrophobicContact CD1-SD 4.15Å; P523-M526 HydrophobicContact CG-CG 3.78Å; P523-M526 HydrophobicContact CG-SD 4.19Å; P523-M526 PolarHBondContact O-N 3.24Å; P523-M526 VanDerWaalsContact O-N 3.13Å; S524-M526 VanDerWaalsContact C-N 3.27Å; S524-M526 PolarHBondContact O-N 3.44Å; M526-S528 PolarHBondContact O-N 3.45Å; M526-S529 PolarHBondContact O-N 3.2Å; M526-S529 VanDerWaalsContact O-N 3.16Å; M526-A530 WeakPolarHBondContact O-CB 3.36Å; M526-A530 PolarHBondContact O-N 2.94Å
527	R	83.7	Confident	88.1	Confident	44 Å²	44	31.5 Å²	31.5	17%	0.166	18%	0.179	C	C	.	.	H	α-helix	trans	-48.1	-55.2	-177.8	179.3	178.7	-62	125.3	7.4	113.2	A519 F522 P523 S524 S529 A530 V531 D585	A519-R527 HydrophobicContact CB-CG 4.03Å; A519-R527 WeakPolarHBondContact O-CD 3.31Å; A519-R527 VanDerWaalsContact O-CG 3.32Å; A519-R527 WeakPolarHBondContact O-CG 3.31Å; A519-R527 PolarHBondContact O-NE 3.03Å; F522-R527 HydrophobicContact CB-CB 4.49Å; F522-R527 PolarHBondContact O-NE 3.35Å; F522-R527 PolarHBondContact O-NH2 3.47Å; P523-R527 WeakPolarHBondContact O-CB 3.27Å; P523-R527 PolarHBondContact O-N 3.36Å; S524-R527 VanDerWaalsContact CA-NH1 3.33Å; S524-R527 VanDerWaalsContact CB-NH1 3.28Å; S524-R527 PolarHBondContact OG-NH1 2.02Å; S524-R527 PolarHBondContact OG-NH2 2.02Å; R527-S529 VanDerWaalsContact C-N 3.34Å; R527-S529 PolarHBondContact O-N 2.97Å; R527-A530 PolarHBondContact O-N 3.11Å; R527-V531 WeakPolarHBondContact O-CG2 3.4Å; R527-V531 PolarHBondContact O-N 3.27Å; R527-D585 IonicContact CZ-OD1 3.94Å; R527-D585 IonicContact NH1-OD1 3.45Å; R527-D585 IonicContact NH2-OD1 3.57Å; R527-D585 PolarHBondContact NH2-OD1 3.2Å
528	S	82.2	Confident	88.3	Confident	87 Å²	87	31.5 Å²	31.5	61%	0.608	18%	0.179	S	C	*	.	H	α-helix	trans	-62.1	-41	-177.7	-58.5	0	0	0	0	112.4	M526 G532	M526-S528 PolarHBondContact O-N 3.45Å; S528-G532 PolarHBondContact O-N 3.48Å
529	S	84.7	Confident	88.5	Confident	57 Å²	57	33 Å²	33	40%	0.399	19%	0.185	S	C	.	.	H	α-helix	trans	-67.1	-44.7	178.3	-58.6	0	0	0	0	111.6	M526 R527 G532 I533	M526-S529 PolarHBondContact O-N 3.2Å; M526-S529 VanDerWaalsContact O-N 3.16Å; R527-S529 VanDerWaalsContact C-N 3.34Å; R527-S529 PolarHBondContact O-N 2.97Å; S529-G532 PolarHBondContact O-N 3.41Å; S529-I533 WeakPolarHBondContact O-CB 3.5Å; S529-I533 VanDerWaalsContact O-CG1 3.24Å; S529-I533 WeakPolarHBondContact O-CG1 3.22Å; S529-I533 PolarHBondContact O-N 2.85Å
530	A	87.9	Confident	88.9	Confident	8 Å²	8	35.8 Å²	35.8	7%	0.066	20%	0.196	C	C	.	.	H	α-helix	trans	-63.3	-49.7	179.7	0	0	0	0	0	111.5	L407 F522 M526 R527 G532 I533 S534	L407-A530 HydrophobicContact CD1-CB 4.2Å; F522-A530 HydrophobicContact CB-CB 4.28Å; F522-A530 HydrophobicContact CD1-CB 3.8Å; F522-A530 HydrophobicContact CD2-CB 3.48Å; F522-A530 VanDerWaalsContact CD2-CB 3.48Å; F522-A530 HydrophobicContact CE1-CB 3.97Å; F522-A530 HydrophobicContact CE2-CB 3.69Å; F522-A530 HydrophobicContact CG-CB 3.57Å; F522-A530 HydrophobicContact CZ-CB 3.93Å; M526-A530 WeakPolarHBondContact O-CB 3.36Å; M526-A530 PolarHBondContact O-N 2.94Å; R527-A530 PolarHBondContact O-N 3.11Å; A530-G532 VanDerWaalsContact C-N 3.32Å; A530-G532 PolarHBondContact O-N 2.97Å; A530-I533 PolarHBondContact O-N 3.4Å; A530-S534 WeakPolarHBondContact O-CB 3.4Å; A530-S534 PolarHBondContact O-N 2.74Å; A530-S534 PolarHBondContact O-OG 3.1Å; A530-S534 VanDerWaalsContact O-OG 3.08Å
531	V	89.9	Confident	89.2	Confident	32 Å²	32	35.1 Å²	35.1	19%	0.194	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-41.1	176.6	174.5	0	0	0	0	111.3	A519 R527 N535	A519-V531 HydrophobicContact CB-CG2 3.98Å; R527-V531 WeakPolarHBondContact O-CG2 3.4Å; R527-V531 PolarHBondContact O-N 3.27Å; V531-N535 VanDerWaalsContact O-CB 3.31Å; V531-N535 WeakPolarHBondContact O-CB 3.07Å; V531-N535 PolarHBondContact O-N 3.37Å
532	G	89.1	Confident	89.5	Confident	18 Å²	18	34.4 Å²	34.4	19%	0.186	19%	0.189	C	C	.	.	H	α-helix	trans	-61.3	-46.3	176.3	0	0	0	0	0	112.9	S528 S529 A530 G536	S528-G532 PolarHBondContact O-N 3.48Å; S529-G532 PolarHBondContact O-N 3.41Å; A530-G532 VanDerWaalsContact C-N 3.32Å; A530-G532 PolarHBondContact O-N 2.97Å; G532-G536 PolarHBondContact O-N 3.42Å
533	I	91.5	Very high	89.9	Confident	61 Å²	61	36 Å²	36	31%	0.313	20%	0.197	S	C	.	.	H	α-helix	trans	-66.1	-46.2	177.2	-69.1	165.9	0	0	0	110.9	S529 A530 N535 G536 L537	S529-I533 WeakPolarHBondContact O-CB 3.5Å; S529-I533 VanDerWaalsContact O-CG1 3.24Å; S529-I533 WeakPolarHBondContact O-CG1 3.22Å; S529-I533 PolarHBondContact O-N 2.85Å; A530-I533 PolarHBondContact O-N 3.4Å; I533-N535 PolarHBondContact O-N 3.21Å; I533-G536 PolarHBondContact O-N 2.86Å; I533-L537 HydrophobicContact CG2-CD1 3.79Å; I533-L537 HydrophobicContact CG2-CG 4.28Å; I533-L537 WeakPolarHBondContact O-CB 3.42Å; I533-L537 PolarHBondContact O-N 3.28Å
534	S	93.9	Very high	90.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.7	-45.1	-180	-62.3	0	0	0	0	112.4	F414 A530 G538	F414-S534 WeakPolarHBondContact CB-O 3.4Å; A530-S534 WeakPolarHBondContact O-CB 3.4Å; A530-S534 PolarHBondContact O-N 2.74Å; A530-S534 PolarHBondContact O-OG 3.1Å; A530-S534 VanDerWaalsContact O-OG 3.08Å; S534-G538 WeakPolarHBondContact O-CA 3.24Å; S534-G538 PolarHBondContact O-N 3.46Å
535	N	93.5	Very high	91.4	Very high	31 Å²	31	37.2 Å²	37.2	17%	0.166	20%	0.199	C	C	.	.	H	α-helix	trans	-72.7	-34.5	178.1	-174.3	25.8	0	0	0	112.2	F197 F414 V531 I533 R539	F197-N535 WeakPolarHBondContact CD1-ND2 3.38Å; F197-N535 WeakPolarHBondContact CE1-ND2 3.46Å; F197-N535 VanDerWaalsContact CZ-ND2 3.35Å; F197-N535 WeakPolarHBondContact CZ-ND2 3.29Å; F414-N535 HydrophobicContact CD1-CB 4.3Å; F414-N535 HydrophobicContact CE1-CB 4.24Å; V531-N535 VanDerWaalsContact O-CB 3.31Å; V531-N535 WeakPolarHBondContact O-CB 3.07Å; V531-N535 PolarHBondContact O-N 3.37Å; I533-N535 PolarHBondContact O-N 3.21Å; N535-R539 WeakPolarHBondContact O-CG 3.38Å; N535-R539 PolarHBondContact OD1-NH2 2.98Å
536	G	95.2	Very high	92.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.8	-55.4	175.1	0	0	0	0	0	112.6	S194 G532 I533 G538 R539	S194-G536 WeakPolarHBondContact CB-O 3.06Å; G532-G536 PolarHBondContact O-N 3.42Å; I533-G536 PolarHBondContact O-N 2.86Å; G536-G538 VanDerWaalsContact C-N 3.3Å; G536-G538 PolarHBondContact O-N 2.97Å; G536-R539 WeakPolarHBondContact O-CB 3.12Å; G536-R539 PolarHBondContact O-N 3.37Å
537	L	96	Very high	92.9	Very high	72 Å²	72	34.5 Å²	34.5	38%	0.377	19%	0.19	S	C	.	.	H	α-helix	trans	-67.9	-29.9	177	-66.7	179.8	0	0	0	112.4	V411 I533 R539 I540	V411-L537 HydrophobicContact CG1-CB 3.76Å; V411-L537 HydrophobicContact CG1-CD1 4.33Å; V411-L537 HydrophobicContact CG2-CD1 4.33Å; I533-L537 HydrophobicContact CG2-CD1 3.79Å; I533-L537 HydrophobicContact CG2-CG 4.28Å; I533-L537 WeakPolarHBondContact O-CB 3.42Å; I533-L537 PolarHBondContact O-N 3.28Å; L537-R539 PolarHBondContact O-N 2.99Å; L537-R539 VanDerWaalsContact O-N 3.09Å; L537-I540 WeakPolarHBondContact O-CB 2.93Å; L537-I540 WeakPolarHBondContact O-CD1 2.97Å; L537-I540 VanDerWaalsContact O-CG1 3.25Å; L537-I540 WeakPolarHBondContact O-CG1 3.34Å; L537-I540 PolarHBondContact O-N 3.45Å
538	G	96.6	Very high	93.5	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-57.5	-22.3	172.7	0	0	0	0	0	113.6	M415 S418 S534 G536 I540 G541	M415-G538 VanDerWaalsContact CA-O 3.29Å; M415-G538 WeakPolarHBondContact CA-O 3.19Å; S418-G538 VanDerWaalsContact CB-O 3.23Å; S418-G538 WeakPolarHBondContact CB-O 3.47Å; S534-G538 WeakPolarHBondContact O-CA 3.24Å; S534-G538 PolarHBondContact O-N 3.46Å; G536-G538 VanDerWaalsContact C-N 3.3Å; G536-G538 PolarHBondContact O-N 2.97Å; G538-I540 PolarHBondContact O-N 3.44Å; G538-I540 VanDerWaalsContact O-N 3.14Å; G538-G541 PolarHBondContact O-N 3.27Å
539	R	96.5	Very high	94.2	Very high	33 Å²	33	29.2 Å²	29.2	13%	0.125	16%	0.159	C	C	.	.	H	α-helix	trans	-65.9	-14	174.8	-63.4	-59.8	157.1	-172.3	-1.4	114.2	I190 S194 F197 S418 N535 G536 L537 G541 G542 I543	I190-R539 HydrophobicContact CG2-CB 3.87Å; I190-R539 WeakPolarHBondContact CG2-O 3.42Å; S194-R539 WeakPolarHBondContact OG-CB 3.4Å; F197-R539 HydrophobicContact CD2-CG 4.19Å; F197-R539 HydrophobicContact CE2-CG 4.43Å; S418-R539 PolarHBondContact OG-NH1 2.75Å; N535-R539 WeakPolarHBondContact O-CG 3.38Å; N535-R539 PolarHBondContact OD1-NH2 2.98Å; G536-R539 WeakPolarHBondContact O-CB 3.12Å; G536-R539 PolarHBondContact O-N 3.37Å; L537-R539 PolarHBondContact O-N 2.99Å; L537-R539 VanDerWaalsContact O-N 3.09Å; R539-G541 PolarHBondContact O-N 2.84Å; R539-G542 WeakPolarHBondContact O-CA 3.37Å; R539-G542 PolarHBondContact O-N 2.68Å; R539-I543 PolarHBondContact O-N 2.81Å
540	I	97.2	Very high	94.5	Very high	79 Å²	79	27.5 Å²	27.5	41%	0.405	15%	0.145	S	C	.	.	H	α-helix	trans	-54.4	-38.6	168.3	-66.4	169.1	0	0	0	110.8	M415 L537 G538 G542 I543 I544	M415-I540 HydrophobicContact CG-CB 4.37Å; M415-I540 HydrophobicContact SD-CB 4.42Å; M415-I540 HydrophobicContact SD-CG2 4.14Å; L537-I540 WeakPolarHBondContact O-CB 2.93Å; L537-I540 WeakPolarHBondContact O-CD1 2.97Å; L537-I540 VanDerWaalsContact O-CG1 3.25Å; L537-I540 WeakPolarHBondContact O-CG1 3.34Å; L537-I540 PolarHBondContact O-N 3.45Å; G538-I540 PolarHBondContact O-N 3.44Å; G538-I540 VanDerWaalsContact O-N 3.14Å; I540-G542 VanDerWaalsContact C-N 3.33Å; I540-G542 PolarHBondContact O-N 2.73Å; I540-I543 WeakPolarHBondContact O-CB 3.36Å; I540-I543 PolarHBondContact O-N 3.14Å; I540-I543 VanDerWaalsContact O-N 3.16Å; I540-I544 HydrophobicContact CG2-CD1 4.04Å; I540-I544 WeakPolarHBondContact O-CG1 3.48Å; I540-I544 PolarHBondContact O-N 3.03Å
541	G	97.7	Very high	94.7	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-66.1	-36.7	175.8	0	0	0	0	0	112.6	M415 L419 G538 R539 I543 I544 S545	M415-G541 WeakPolarHBondContact O-CA 3.44Å; L419-G541 VanDerWaalsContact CA-O 3.25Å; L419-G541 WeakPolarHBondContact CA-O 3.38Å; L419-G541 WeakPolarHBondContact CB-O 3.47Å; L419-G541 VanDerWaalsContact CD1-O 3.3Å; L419-G541 WeakPolarHBondContact CD1-O 3.4Å; G538-G541 PolarHBondContact O-N 3.27Å; R539-G541 PolarHBondContact O-N 2.84Å; G541-I543 VanDerWaalsContact C-N 3.31Å; G541-I543 PolarHBondContact O-N 3.49Å; G541-I544 PolarHBondContact O-N 3.45Å; G541-S545 PolarHBondContact O-N 2.97Å
542	G	96.5	Very high	94.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.3	-34.9	171.4	0	0	0	0	0	113.5	I190 S418 R539 I540 S545	I190-G542 WeakPolarHBondContact CD1-O 3.45Å; S418-G542 PolarHBondContact OG-N 3.06Å; R539-G542 WeakPolarHBondContact O-CA 3.37Å; R539-G542 PolarHBondContact O-N 2.68Å; I540-G542 VanDerWaalsContact C-N 3.33Å; I540-G542 PolarHBondContact O-N 2.73Å; G542-S545 PolarHBondContact O-N 3.32Å; G542-S545 PolarHBondContact O-OG 3.32Å
543	I	97.1	Very high	94.6	Very high	38 Å²	38	30.1 Å²	30.1	20%	0.195	15%	0.15	C	C	.	.	H	α-helix	trans	-65.7	-46.3	173.1	-65.3	166.5	0	0	0	109.9	I190 V191 R539 I540 G541 S545 T546 F547	I190-I543 HydrophobicContact CB-CG1 4.06Å; I190-I543 HydrophobicContact CG2-CG1 3.81Å; V191-I543 HydrophobicContact CG2-CD1 3.43Å; V191-I543 VanDerWaalsContact CG2-CD1 3.43Å; V191-I543 HydrophobicContact CG2-CG1 4.2Å; R539-I543 PolarHBondContact O-N 2.81Å; I540-I543 WeakPolarHBondContact O-CB 3.36Å; I540-I543 PolarHBondContact O-N 3.14Å; I540-I543 VanDerWaalsContact O-N 3.16Å; G541-I543 VanDerWaalsContact C-N 3.31Å; G541-I543 PolarHBondContact O-N 3.49Å; I543-S545 PolarHBondContact O-N 3.48Å; I543-T546 PolarHBondContact O-N 3.48Å; I543-T546 PolarHBondContact O-OG1 3.01Å; I543-F547 HydrophobicContact CG2-CE2 4.39Å; I543-F547 WeakPolarHBondContact O-CD2 3.39Å
544	I	97.1	Very high	94.4	Very high	75 Å²	75	31.2 Å²	31.2	39%	0.385	16%	0.159	S	C	.	.	H	α-helix	trans	-61.8	-32.4	176.7	-65.3	165.8	0	0	0	110.7	L419 I540 G541 T546 F547 V548	L419-I544 HydrophobicContact CD1-CB 4.1Å; L419-I544 HydrophobicContact CD1-CG2 3.84Å; I540-I544 HydrophobicContact CG2-CD1 4.04Å; I540-I544 WeakPolarHBondContact O-CG1 3.48Å; I540-I544 PolarHBondContact O-N 3.03Å; G541-I544 PolarHBondContact O-N 3.45Å; I544-T546 VanDerWaalsContact C-N 3.29Å; I544-T546 PolarHBondContact O-N 3Å; I544-F547 PolarHBondContact O-N 3.44Å; I544-V548 HydrophobicContact CG2-CG2 3.82Å; I544-V548 WeakPolarHBondContact O-CG2 3.12Å; I544-V548 PolarHBondContact O-N 2.72Å
545	S	96.7	Very high	94	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.3	-31	-177.2	87.6	0	0	0	0	114.1	L419 G423 G541 G542 I543 F547 V548 N549 Y564	L419-S545 WeakPolarHBondContact O-CB 3.46Å; G423-S545 PolarHBondContact N-OG 3.36Å; G541-S545 PolarHBondContact O-N 2.97Å; G542-S545 PolarHBondContact O-N 3.32Å; G542-S545 PolarHBondContact O-OG 3.32Å; I543-S545 PolarHBondContact O-N 3.48Å; S545-F547 VanDerWaalsContact C-N 3.34Å; S545-V548 PolarHBondContact O-N 3.14Å; S545-N549 PolarHBondContact O-N 3.45Å; S545-Y564 PolarHBondContact O-OH 2.97Å
546	T	94.2	Very high	93.8	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-65.8	-40.3	177.9	65.3	0	0	0	0	111.1	T186 S187 I190 L426 I543 I544 H550	T186-T546 HydrophobicContact CG2-CG2 3.67Å; S187-T546 PolarHBondContact OG-OG1 3.48Å; I190-T546 HydrophobicContact CD1-CG2 4.07Å; L426-T546 HydrophobicContact CD1-CG2 4.24Å; I543-T546 PolarHBondContact O-N 3.48Å; I543-T546 PolarHBondContact O-OG1 3.01Å; I544-T546 VanDerWaalsContact C-N 3.29Å; I544-T546 PolarHBondContact O-N 3Å; T546-H550 PolarHBondContact O-N 2.82Å
547	F	94.7	Very high	93.6	Very high	83 Å²	83	42.6 Å²	42.6	36%	0.364	21%	0.21	S	C	.	.	H	α-helix	trans	-75.9	-37.7	175.9	-61.7	-80.3	0	0	0	111.9	L183 S187 I543 I544 S545 N549 H550 T551	L183-F547 HydrophobicContact CB-CE1 4.26Å; L183-F547 HydrophobicContact CD1-CD1 4.37Å; S187-F547 WeakPolarHBondContact OG-CE2 3.29Å; I543-F547 HydrophobicContact CG2-CE2 4.39Å; I543-F547 WeakPolarHBondContact O-CD2 3.39Å; I544-F547 PolarHBondContact O-N 3.44Å; S545-F547 VanDerWaalsContact C-N 3.34Å; F547-N549 VanDerWaalsContact C-N 3.26Å; F547-N549 PolarHBondContact O-N 2.8Å; F547-H550 WeakPolarHBondContact O-CB 3.34Å; F547-H550 PolarHBondContact O-N 2.87Å; F547-T551 PolarHBondContact O-N 2.91Å
548	V	96.5	Very high	93.4	Very high	17 Å²	17	39.2 Å²	39.2	10%	0.103	19%	0.192	C	C	.	.	H	α-helix	trans	-59.2	-40.4	172.8	168.1	0	0	0	0	110.5	L419 I544 S545 H550 T551 P560 I563 Y564	L419-V548 HydrophobicContact CD1-CG2 4.17Å; I544-V548 HydrophobicContact CG2-CG2 3.82Å; I544-V548 WeakPolarHBondContact O-CG2 3.12Å; I544-V548 PolarHBondContact O-N 2.72Å; S545-V548 PolarHBondContact O-N 3.14Å; V548-H550 VanDerWaalsContact C-N 3.27Å; V548-H550 PolarHBondContact O-N 3.43Å; V548-T551 WeakPolarHBondContact O-CB 3.28Å; V548-T551 WeakPolarHBondContact O-CG2 3.44Å; V548-T551 PolarHBondContact O-N 2.85Å; V548-T551 PolarHBondContact O-OG1 2.92Å; V548-P560 HydrophobicContact CG1-CB 4.02Å; V548-P560 WeakPolarHBondContact O-CB 3.3Å; V548-P560 VanDerWaalsContact O-CG 3.31Å; V548-P560 WeakPolarHBondContact O-CG 3.17Å; V548-I563 HydrophobicContact CG1-CB 4.04Å; V548-I563 HydrophobicContact CG1-CD1 3.92Å; V548-I563 HydrophobicContact CG1-CG2 3.95Å; V548-I563 HydrophobicContact CG2-CG2 4.34Å; V548-Y564 HydrophobicContact CB-CE1 4.32Å; V548-Y564 HydrophobicContact CG1-CD1 4.46Å; V548-Y564 HydrophobicContact CG1-CE1 3.63Å
549	N	95.6	Very high	93.4	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-66.6	-27	175.7	-78.9	-26.7	0	0	0	113.7	G423 F427 Y430 S545 F547 T551 D552 Y564	G423-N549 PolarHBondContact O-ND2 3.21Å; G423-N549 PolarHBondContact O-OD1 3.02Å; F427-N549 WeakPolarHBondContact CB-OD1 3.46Å; F427-N549 HydrophobicContact CD2-CB 4.47Å; F427-N549 WeakPolarHBondContact CD2-OD1 3.28Å; F427-N549 PolarHBondContact N-ND2 2.8Å; Y430-N549 HydrophobicContact CD2-CB 4.25Å; Y430-N549 HydrophobicContact CE2-CB 3.77Å; S545-N549 PolarHBondContact O-N 3.45Å; F547-N549 VanDerWaalsContact C-N 3.26Å; F547-N549 PolarHBondContact O-N 2.8Å; N549-T551 PolarHBondContact O-N 3.15Å; N549-D552 VanDerWaalsContact O-CB 3.31Å; N549-D552 WeakPolarHBondContact O-CB 3.43Å; N549-D552 PolarHBondContact O-N 3.36Å; N549-Y564 VanDerWaalsContact CG-OH 3.28Å; N549-Y564 PolarHBondContact OD1-OH 3.29Å
550	H	92	Very high	93.4	Very high	20 Å²	20	38.8 Å²	38.8	9%	0.093	19%	0.193	C	C	.	.	H	α-helix	trans	-69.5	-22.2	176.5	-175.8	59.3	0	0	0	112.7	M180 L183 T546 F547 V548 D552 F553	M180-H550 WeakPolarHBondContact CE-NE2 3.49Å; L183-H550 HydrophobicContact CD1-CB 3.61Å; L183-H550 HydrophobicContact CD2-CB 4.39Å; T546-H550 PolarHBondContact O-N 2.82Å; F547-H550 WeakPolarHBondContact O-CB 3.34Å; F547-H550 PolarHBondContact O-N 2.87Å; V548-H550 VanDerWaalsContact C-N 3.27Å; V548-H550 PolarHBondContact O-N 3.43Å; H550-D552 PolarHBondContact O-N 2.75Å; H550-F553 PolarHBondContact O-N 3.48Å
551	T	91.9	Very high	93.3	Very high	24 Å²	24	35.1 Å²	35.1	15%	0.147	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-14.7	178.4	73.8	0	0	0	0	113.3	F547 V548 N549 F553 T554 F555	F547-T551 PolarHBondContact O-N 2.91Å; V548-T551 WeakPolarHBondContact O-CB 3.28Å; V548-T551 WeakPolarHBondContact O-CG2 3.44Å; V548-T551 PolarHBondContact O-N 2.85Å; V548-T551 PolarHBondContact O-OG1 2.92Å; N549-T551 PolarHBondContact O-N 3.15Å; T551-F553 PolarHBondContact O-N 3.28Å; T551-T554 PolarHBondContact O-N 3.34Å; T551-F555 HydrophobicContact CG2-CE2 4.34Å; T551-F555 PolarHBondContact O-N 2.7Å
552	D	91.1	Very high	93.3	Very high	13 Å²	13	37.6 Å²	37.6	7%	0.07	19%	0.187	C	C	.	.	H	α-helix	trans	-56.6	-35.4	169.8	-158.9	73	0	0	0	112.9	F427 N549 H550 E556 H557 G558 P560	F427-D552 HydrophobicContact CE2-CB 4.14Å; F427-D552 WeakPolarHBondContact CE2-OD1 3.18Å; F427-D552 WeakPolarHBondContact CZ-OD1 3.26Å; N549-D552 VanDerWaalsContact O-CB 3.31Å; N549-D552 WeakPolarHBondContact O-CB 3.43Å; N549-D552 PolarHBondContact O-N 3.36Å; H550-D552 PolarHBondContact O-N 2.75Å; D552-E556 CarbonylContact O-C 3.52Å; D552-H557 VanDerWaalsContact CG-ND1 3.34Å; D552-H557 VanDerWaalsContact OD1-CA 3.32Å; D552-H557 WeakPolarHBondContact OD1-CA 2.92Å; D552-H557 IonicContact OD1-CE1 2.67Å; D552-H557 IonicContact OD1-CG 3.28Å; D552-H557 IonicContact OD1-ND1 3.7Å; D552-H557 PolarHBondContact OD1-ND1 3.07Å; D552-H557 VanDerWaalsContact OD1-ND1 3.15Å; D552-H557 IonicContact OD2-CE1 3.7Å; D552-H557 IonicContact OD2-CG 3.83Å; D552-H557 IonicContact OD2-ND1 3.27Å; D552-H557 PolarHBondContact OD2-ND1 3.16Å; D552-G558 PolarHBondContact OD1-N 3.13Å; D552-P560 HydrophobicContact CB-CG 3.86Å
553	F	85.9	Confident	93.4	Very high	77 Å²	77	40.9 Å²	40.9	34%	0.338	20%	0.204	S	C	.	.	H	α-helix	trans	-87.7	-30.9	177.2	-70.4	-96.7	0	0	0	112.6	V110 Y430 H550 T551	V110-F553 HydrophobicContact CG1-CD1 4.28Å; Y430-F553 HydrophobicContact CD1-CD2 4.33Å; Y430-F553 AromaticContact CD1-CE2 3.19Å; Y430-F553 HydrophobicContact CD1-CE2 3.19Å; Y430-F553 AromaticContact CD1-CZ 3.66Å; Y430-F553 HydrophobicContact CD1-CZ 3.66Å; Y430-F553 AromaticContact CE1-CD2 3.92Å; Y430-F553 HydrophobicContact CE1-CD2 3.92Å; Y430-F553 AromaticContact CE1-CE2 3.01Å; Y430-F553 HydrophobicContact CE1-CE2 3.01Å; Y430-F553 AromaticContact CE1-CZ 3.64Å; Y430-F553 HydrophobicContact CE1-CZ 3.64Å; Y430-F553 HydrophobicContact CG-CE2 4.18Å; Y430-F553 AromaticContact CZ-CE2 3.93Å; H550-F553 PolarHBondContact O-N 3.48Å; T551-F553 PolarHBondContact O-N 3.28Å
554	T	86	Confident	93.4	Very high	84 Å²	84	39.1 Å²	39.1	52%	0.515	19%	0.194	S	C	.	.	H	α-helix	trans	-79.3	-40.2	-174.4	-48.2	0	0	0	0	112.5	T551	T551-T554 PolarHBondContact O-N 3.34Å
555	F	87	Confident	93.5	Very high	145 Å²	145	36 Å²	36	64%	0.636	18%	0.179	S	C	*	.	S	Bend	trans	-104.3	-86.2	-179.7	-61	-70.1	0	0	0	110.5	T551 T559	T551-F555 HydrophobicContact CG2-CE2 4.34Å; T551-F555 PolarHBondContact O-N 2.7Å; F555-T559 HydrophobicContact CB-CG2 4.41Å; F555-T559 HydrophobicContact CD2-CG2 4.39Å
556	E	88.1	Confident	93.5	Very high	79 Å²	79	37.8 Å²	37.8	37%	0.369	20%	0.198	S	C	.	.			trans	-152.8	154	178.2	-67.7	-165.5	134.5	0	0	110.4	L486 K489 D552 G558 T559	L486-E556 HydrophobicContact CD1-CB 4.09Å; K489-E556 IonicContact NZ-OE1 3.85Å; K489-E556 PolarHBondContact NZ-OE1 3.03Å; D552-E556 CarbonylContact O-C 3.52Å; E556-G558 PolarHBondContact O-N 3.29Å; E556-T559 VanDerWaalsContact O-CB 3.3Å; E556-T559 WeakPolarHBondContact O-CB 3.25Å; E556-T559 PolarHBondContact O-N 3.16Å; E556-T559 VanDerWaalsContact O-N 3.16Å; E556-T559 PolarHBondContact O-OG1 3.37Å
557	H	91.6	Very high	93.7	Very high	46 Å²	46	38 Å²	38	21%	0.213	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	127	178.6	-174.2	60.4	0	0	0	111.5	Y430 T485 L486 D493 D552	Y430-H557 PolarHBondContact O-CE1 3.45Å; Y430-H557 VanDerWaalsContact O-CE1 3.28Å; T485-H557 WeakPolarHBondContact CG2-CD2 3.32Å; T485-H557 WeakPolarHBondContact CG2-O 3.08Å; L486-H557 WeakPolarHBondContact CD1-O 3.39Å; D493-H557 IonicContact OD1-CD2 3.72Å; D493-H557 IonicContact OD1-NE2 2.83Å; D493-H557 PolarHBondContact OD1-NE2 3.02Å; D493-H557 IonicContact OD2-CD2 3.46Å; D493-H557 IonicContact OD2-CE1 2.75Å; D493-H557 IonicContact OD2-NE2 3.87Å; D493-H557 PolarHBondContact OD2-NE2 3.1Å; D552-H557 VanDerWaalsContact CG-ND1 3.34Å; D552-H557 VanDerWaalsContact OD1-CA 3.32Å; D552-H557 WeakPolarHBondContact OD1-CA 2.92Å; D552-H557 IonicContact OD1-CE1 2.67Å; D552-H557 IonicContact OD1-CG 3.28Å; D552-H557 IonicContact OD1-ND1 3.7Å; D552-H557 PolarHBondContact OD1-ND1 3.07Å; D552-H557 VanDerWaalsContact OD1-ND1 3.15Å; D552-H557 IonicContact OD2-CE1 3.7Å; D552-H557 IonicContact OD2-CG 3.83Å; D552-H557 IonicContact OD2-ND1 3.27Å; D552-H557 PolarHBondContact OD2-ND1 3.16Å
558	G	92.5	Very high	93.8	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.9	-8.2	-177.1	0	0	0	0	0	115.2	D552 E556 P560 V561	D552-G558 PolarHBondContact OD1-N 3.13Å; E556-G558 PolarHBondContact O-N 3.29Å; G558-P560 VanDerWaalsContact C-CD 3.44Å; G558-V561 PolarHBondContact O-N 3.46Å
559	T	95	Very high	93.9	Very high	26 Å²	26	38.1 Å²	38.1	16%	0.16	20%	0.203	C	C	.	.	H	α-helix	trans	-55.5	-43.3	176.8	-58.5	0	0	0	0	114.1	F555 E556 V561 L562 I563	F555-T559 HydrophobicContact CB-CG2 4.41Å; F555-T559 HydrophobicContact CD2-CG2 4.39Å; E556-T559 VanDerWaalsContact O-CB 3.3Å; E556-T559 WeakPolarHBondContact O-CB 3.25Å; E556-T559 PolarHBondContact O-N 3.16Å; E556-T559 VanDerWaalsContact O-N 3.16Å; E556-T559 PolarHBondContact O-OG1 3.37Å; T559-V561 PolarHBondContact O-N 2.83Å; T559-L562 PolarHBondContact O-N 3.28Å; T559-L562 VanDerWaalsContact O-N 3.16Å; T559-I563 PolarHBondContact O-N 3.36Å
560	P	96.6	Very high	94	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.8	-33.4	-179.3	-25	34.8	0	0	0	113.4	F427 V548 D552 G558 L562 I563 Y564	F427-P560 HydrophobicContact CD2-CB 4.3Å; F427-P560 HydrophobicContact CD2-CG 4.28Å; F427-P560 HydrophobicContact CE2-CB 4.23Å; F427-P560 HydrophobicContact CE2-CG 3.85Å; V548-P560 HydrophobicContact CG1-CB 4.02Å; V548-P560 WeakPolarHBondContact O-CB 3.3Å; V548-P560 VanDerWaalsContact O-CG 3.31Å; V548-P560 WeakPolarHBondContact O-CG 3.17Å; D552-P560 HydrophobicContact CB-CG 3.86Å; G558-P560 VanDerWaalsContact C-CD 3.44Å; P560-L562 VanDerWaalsContact C-N 3.32Å; P560-L562 PolarHBondContact O-N 3.1Å; P560-I563 WeakPolarHBondContact O-CB 3.35Å; P560-I563 PolarHBondContact O-N 3.2Å; P560-I563 VanDerWaalsContact O-N 3.16Å; P560-Y564 HydrophobicContact CB-CE2 4.12Å; P560-Y564 VanDerWaalsContact O-CD2 3.22Å; P560-Y564 WeakPolarHBondContact O-CD2 3.43Å; P560-Y564 PolarHBondContact O-N 2.89Å
561	V	96.6	Very high	94.3	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-67.7	-33.8	-177.9	179.4	0	0	0	0	111.5	F427 L478 L496 G558 T559 Y564 S565	F427-V561 HydrophobicContact CD1-CG2 4.22Å; F427-V561 HydrophobicContact CE1-CG2 3.95Å; F427-V561 HydrophobicContact CZ-CG2 4.33Å; L478-V561 HydrophobicContact CB-CG1 3.85Å; L478-V561 HydrophobicContact CD2-CG1 3.66Å; L478-V561 HydrophobicContact CG-CG1 4.35Å; L478-V561 VanDerWaalsContact O-CG1 3.32Å; L478-V561 WeakPolarHBondContact O-CG1 3.35Å; L496-V561 HydrophobicContact CD1-CB 4.47Å; L496-V561 HydrophobicContact CD1-CG1 4.34Å; L496-V561 HydrophobicContact CD1-CG2 4.03Å; G558-V561 PolarHBondContact O-N 3.46Å; T559-V561 PolarHBondContact O-N 2.83Å; V561-Y564 PolarHBondContact O-N 3.02Å; V561-S565 PolarHBondContact O-N 2.94Å
562	L	96.9	Very high	94.5	Very high	53 Å²	53	40.8 Å²	40.8	28%	0.277	21%	0.213	S	C	.	.	H	α-helix	trans	-67.9	-37	173	-63	178.5	0	0	0	112	V483 L486 T559 P560 Y564 S565 G566	V483-L562 HydrophobicContact CG2-CD2 3.93Å; L486-L562 HydrophobicContact CD2-CD1 4.22Å; T559-L562 PolarHBondContact O-N 3.28Å; T559-L562 VanDerWaalsContact O-N 3.16Å; P560-L562 VanDerWaalsContact C-N 3.32Å; P560-L562 PolarHBondContact O-N 3.1Å; L562-Y564 VanDerWaalsContact C-N 3.32Å; L562-Y564 PolarHBondContact O-N 3.12Å; L562-S565 WeakPolarHBondContact O-CB 3.46Å; L562-S565 PolarHBondContact O-N 2.58Å; L562-G566 PolarHBondContact O-N 2.79Å
563	I	97.5	Very high	94.8	Very high	70 Å²	70	45.6 Å²	45.6	36%	0.359	23%	0.234	S	C	.	.	H	α-helix	trans	-63.3	-42	173.9	-61.8	170.5	0	0	0	110	V548 T559 P560 G566 S567	V548-I563 HydrophobicContact CG1-CB 4.04Å; V548-I563 HydrophobicContact CG1-CD1 3.92Å; V548-I563 HydrophobicContact CG1-CG2 3.95Å; V548-I563 HydrophobicContact CG2-CG2 4.34Å; T559-I563 PolarHBondContact O-N 3.36Å; P560-I563 WeakPolarHBondContact O-CB 3.35Å; P560-I563 PolarHBondContact O-N 3.2Å; P560-I563 VanDerWaalsContact O-N 3.16Å; I563-G566 PolarHBondContact O-N 2.86Å; I563-S567 PolarHBondContact O-N 2.87Å
564	Y	98.2	Very high	95.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.1	-38.7	175.2	-58.6	-37.6	0	0	0	112.6	L419 A420 G423 I424 S545 V548 N549 P560 V561 L562 S567 A568	L419-Y564 HydrophobicContact CD1-CE1 3.97Å; L419-Y564 HydrophobicContact CG-CD1 4.19Å; L419-Y564 HydrophobicContact CG-CE1 4.05Å; L419-Y564 WeakPolarHBondContact O-CE1 3.3Å; A420-Y564 HydrophobicContact CB-CD1 4.29Å; A420-Y564 HydrophobicContact CB-CG 4.42Å; G423-Y564 VanDerWaalsContact CA-CZ 3.48Å; G423-Y564 WeakPolarHBondContact CA-OH 3.4Å; I424-Y564 HydrophobicContact CG1-CD2 3.8Å; I424-Y564 HydrophobicContact CG1-CE2 4.33Å; I424-Y564 HydrophobicContact CG1-CG 4.39Å; S545-Y564 PolarHBondContact O-OH 2.97Å; V548-Y564 HydrophobicContact CB-CE1 4.32Å; V548-Y564 HydrophobicContact CG1-CD1 4.46Å; V548-Y564 HydrophobicContact CG1-CE1 3.63Å; N549-Y564 VanDerWaalsContact CG-OH 3.28Å; N549-Y564 PolarHBondContact OD1-OH 3.29Å; P560-Y564 HydrophobicContact CB-CE2 4.12Å; P560-Y564 VanDerWaalsContact O-CD2 3.22Å; P560-Y564 WeakPolarHBondContact O-CD2 3.43Å; P560-Y564 PolarHBondContact O-N 2.89Å; V561-Y564 PolarHBondContact O-N 3.02Å; L562-Y564 VanDerWaalsContact C-N 3.32Å; L562-Y564 PolarHBondContact O-N 3.12Å; Y564-S567 PolarHBondContact O-N 2.82Å; Y564-S567 PolarHBondContact O-OG 3.02Å; Y564-A568 PolarHBondContact O-N 3.45Å
565	S	98.2	Very high	95.8	Very high	9 Å²	9	38.6 Å²	38.6	6%	0.063	20%	0.197	C	C	.	.	H	α-helix	trans	-58.1	-49.9	172.1	179.3	0	0	0	0	112.1	A475 V561 L562 S567 A568 I569	A475-S565 PolarHBondContact O-OG 2.92Å; V561-S565 PolarHBondContact O-N 2.94Å; L562-S565 WeakPolarHBondContact O-CB 3.46Å; L562-S565 PolarHBondContact O-N 2.58Å; S565-S567 VanDerWaalsContact C-N 3.28Å; S565-S567 PolarHBondContact O-N 3.48Å; S565-A568 WeakPolarHBondContact O-CB 3.38Å; S565-A568 PolarHBondContact O-N 3.22Å; S565-A568 VanDerWaalsContact O-N 3.07Å; S565-I569 PolarHBondContact O-N 2.65Å; S565-I569 VanDerWaalsContact O-N 3.11Å
566	G	97.9	Very high	96.1	Very high	39 Å²	39	39.2 Å²	39.2	40%	0.402	20%	0.196	S	C	.	.	H	α-helix	trans	-59.2	-39.6	175.3	0	0	0	0	0	112.6	L562 I563 A568 I569 F570	L562-G566 PolarHBondContact O-N 2.79Å; I563-G566 PolarHBondContact O-N 2.86Å; G566-A568 VanDerWaalsContact C-N 3.3Å; G566-A568 PolarHBondContact O-N 2.99Å; G566-I569 PolarHBondContact O-N 2.88Å; G566-F570 PolarHBondContact O-N 3.26Å
567	S	97.6	Very high	96.4	Very high	9 Å²	9	40 Å²	40	6%	0.063	20%	0.198	C	C	.	.	H	α-helix	trans	-64.1	-33	175.9	85.8	0	0	0	0	113	I563 Y564 S565 Q571	I563-S567 PolarHBondContact O-N 2.87Å; Y564-S567 PolarHBondContact O-N 2.82Å; Y564-S567 PolarHBondContact O-OG 3.02Å; S565-S567 VanDerWaalsContact C-N 3.28Å; S565-S567 PolarHBondContact O-N 3.48Å; S567-Q571 VanDerWaalsContact O-CG 3.27Å; S567-Q571 WeakPolarHBondContact O-CG 3.4Å; S567-Q571 PolarHBondContact O-N 3Å; S567-Q571 PolarHBondContact O-NE2 2.9Å; S567-Q571 VanDerWaalsContact O-NE2 3.16Å
568	A	98	Very high	96.5	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-71.9	-40.3	177.5	0	0	0	0	0	111.8	S474 A475 Y507 Y564 S565 G566 F570 Q571 A572	S474-A568 WeakPolarHBondContact OG-CB 3.32Å; A475-A568 HydrophobicContact CB-CB 3.85Å; Y507-A568 WeakPolarHBondContact OH-CB 3.49Å; Y564-A568 PolarHBondContact O-N 3.45Å; S565-A568 WeakPolarHBondContact O-CB 3.38Å; S565-A568 PolarHBondContact O-N 3.22Å; S565-A568 VanDerWaalsContact O-N 3.07Å; G566-A568 VanDerWaalsContact C-N 3.3Å; G566-A568 PolarHBondContact O-N 2.99Å; A568-F570 VanDerWaalsContact C-N 3.32Å; A568-F570 PolarHBondContact O-N 3.42Å; A568-Q571 WeakPolarHBondContact O-CB 3.4Å; A568-Q571 PolarHBondContact O-N 2.99Å; A568-A572 PolarHBondContact O-N 3.36Å; A568-A572 VanDerWaalsContact O-N 3.1Å
569	I	97.9	Very high	96.4	Very high	103 Å²	103	41.1 Å²	41.1	53%	0.528	21%	0.209	S	C	.	.	H	α-helix	trans	-60.8	-45.5	173.1	-62.4	171.4	0	0	0	109.8	A475 S565 G566 Q571 A572 F573	A475-I569 HydrophobicContact CB-CD1 4.45Å; A475-I569 HydrophobicContact CB-CG1 3.7Å; S565-I569 PolarHBondContact O-N 2.65Å; S565-I569 VanDerWaalsContact O-N 3.11Å; G566-I569 PolarHBondContact O-N 2.88Å; I569-Q571 VanDerWaalsContact C-N 3.31Å; I569-Q571 PolarHBondContact O-N 3.49Å; I569-A572 PolarHBondContact O-N 2.93Å; I569-F573 PolarHBondContact O-N 3.25Å
570	F	98	Very high	96.1	Very high	95 Å²	95	42.4 Å²	42.4	42%	0.417	22%	0.215	S	C	.	.	H	α-helix	trans	-65.5	-33.2	178.8	-169.1	-128.7	0	0	0	112.6	L416 G566 A568 F573 L574	L416-F570 HydrophobicContact CD1-CB 4.44Å; L416-F570 HydrophobicContact CD1-CD1 3.37Å; L416-F570 HydrophobicContact CD1-CE1 3.95Å; L416-F570 HydrophobicContact CD1-CG 4.24Å; L416-F570 HydrophobicContact CD2-CD1 4.01Å; L416-F570 HydrophobicContact CG-CD1 4.31Å; G566-F570 PolarHBondContact O-N 3.26Å; A568-F570 VanDerWaalsContact C-N 3.32Å; A568-F570 PolarHBondContact O-N 3.42Å; F570-F573 AromaticContact CD2-CD1 3.89Å; F570-F573 HydrophobicContact CD2-CD1 3.89Å; F570-F573 AromaticContact CE2-CD1 3.79Å; F570-F573 HydrophobicContact CE2-CD1 3.79Å; F570-F573 HydrophobicContact CE2-CE1 4.22Å; F570-F573 WeakPolarHBondContact O-CB 3.38Å; F570-F573 PolarHBondContact O-N 3.29Å; F570-L574 HydrophobicContact CD1-CD1 4.2Å; F570-L574 HydrophobicContact CE1-CD1 3.89Å; F570-L574 HydrophobicContact CE1-CG 4.29Å; F570-L574 HydrophobicContact CE2-CD2 4.35Å; F570-L574 HydrophobicContact CE2-CG 4.34Å; F570-L574 HydrophobicContact CZ-CD1 4.21Å; F570-L574 HydrophobicContact CZ-CD2 4.07Å; F570-L574 HydrophobicContact CZ-CG 4.16Å; F570-L574 WeakPolarHBondContact O-CG 3.34Å; F570-L574 PolarHBondContact O-N 2.67Å
571	Q	97.6	Very high	95.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-46.3	171.2	-76.4	166.9	64.3	0	0	112.3	L416 Y471 Y507 S567 A568 I569 F573 L574 L575	L416-Q571 HydrophobicContact CB-CG 3.37Å; L416-Q571 VanDerWaalsContact CB-NE2 3.27Å; L416-Q571 HydrophobicContact CD1-CG 3.75Å; L416-Q571 HydrophobicContact CG-CG 4.22Å; L416-Q571 PolarHBondContact O-NE2 2.92Å; Y471-Q571 HydrophobicContact CD1-CB 4.41Å; Y471-Q571 HydrophobicContact CD2-CB 4.09Å; Y471-Q571 HydrophobicContact CE2-CB 4.33Å; Y471-Q571 HydrophobicContact CG-CB 4.12Å; Y471-Q571 VanDerWaalsContact CZ-OE1 3.23Å; Y507-Q571 PolarHBondContact OH-NE2 2.83Å; S567-Q571 VanDerWaalsContact O-CG 3.27Å; S567-Q571 WeakPolarHBondContact O-CG 3.4Å; S567-Q571 PolarHBondContact O-N 3Å; S567-Q571 PolarHBondContact O-NE2 2.9Å; S567-Q571 VanDerWaalsContact O-NE2 3.16Å; A568-Q571 WeakPolarHBondContact O-CB 3.4Å; A568-Q571 PolarHBondContact O-N 2.99Å; I569-Q571 VanDerWaalsContact C-N 3.31Å; I569-Q571 PolarHBondContact O-N 3.49Å; Q571-F573 VanDerWaalsContact C-N 3.29Å; Q571-F573 PolarHBondContact O-N 2.88Å; Q571-L574 PolarHBondContact O-N 3.39Å; Q571-L575 WeakPolarHBondContact O-CG 3.15Å; Q571-L575 PolarHBondContact O-N 2.89Å
572	A	97	Very high	95.1	Very high	8 Å²	8	45.2 Å²	45.2	7%	0.066	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-40.1	176.2	0	0	0	0	0	111.4	M468 I472 A568 I569 L575 Y576	M468-A572 WeakPolarHBondContact CE-O 3.29Å; I472-A572 HydrophobicContact CG1-CB 4.06Å; A568-A572 PolarHBondContact O-N 3.36Å; A568-A572 VanDerWaalsContact O-N 3.1Å; I569-A572 PolarHBondContact O-N 2.93Å; A572-L575 PolarHBondContact O-N 3.45Å; A572-Y576 PolarHBondContact O-N 3.49Å
573	F	97	Very high	94.1	Very high	114 Å²	114	44.3 Å²	44.3	50%	0.5	24%	0.237	S	C	.	.	H	α-helix	trans	-62.6	-44.5	174.3	176.3	-105.6	0	0	0	112.7	I569 F570 Q571 L575 Y576 F577	I569-F573 PolarHBondContact O-N 3.25Å; F570-F573 AromaticContact CD2-CD1 3.89Å; F570-F573 HydrophobicContact CD2-CD1 3.89Å; F570-F573 AromaticContact CE2-CD1 3.79Å; F570-F573 HydrophobicContact CE2-CD1 3.79Å; F570-F573 HydrophobicContact CE2-CE1 4.22Å; F570-F573 WeakPolarHBondContact O-CB 3.38Å; F570-F573 PolarHBondContact O-N 3.29Å; Q571-F573 VanDerWaalsContact C-N 3.29Å; Q571-F573 PolarHBondContact O-N 2.88Å; F573-L575 VanDerWaalsContact C-N 3.35Å; F573-L575 PolarHBondContact O-N 3.05Å; F573-Y576 VanDerWaalsContact O-CB 3.27Å; F573-Y576 WeakPolarHBondContact O-CB 3.12Å; F573-Y576 PolarHBondContact O-N 3.04Å; F573-F577 HydrophobicContact CD1-CE2 4.08Å; F573-F577 HydrophobicContact CD2-CE2 4.42Å; F573-F577 AromaticContact CE1-CE2 3.56Å; F573-F577 HydrophobicContact CE1-CE2 3.56Å; F573-F577 HydrophobicContact CE1-CZ 4.22Å; F573-F577 AromaticContact CE2-CE2 3.93Å; F573-F577 HydrophobicContact CE2-CE2 3.93Å; F573-F577 HydrophobicContact CE2-CZ 4.16Å; F573-F577 HydrophobicContact CG-CE2 4.5Å; F573-F577 AromaticContact CZ-CE2 3.48Å; F573-F577 HydrophobicContact CZ-CE2 3.48Å; F573-F577 VanDerWaalsContact CZ-CE2 3.48Å; F573-F577 AromaticContact CZ-CZ 3.73Å; F573-F577 HydrophobicContact CZ-CZ 3.73Å; F573-F577 WeakPolarHBondContact O-CD2 3.34Å
574	L	97	Very high	93	Very high	14 Å²	14	47.9 Å²	47.9	7%	0.073	25%	0.253	C	S	.	.	H	α-helix	trans	-64.7	-37.2	178	-73.3	177	0	0	0	112.8	I409 L412 I413 L416 F570 Q571 Y576 F577	I409-L574 HydrophobicContact CG2-CB 4.24Å; L412-L574 HydrophobicContact CB-CD1 3.81Å; I413-L574 HydrophobicContact CD1-CB 4.14Å; I413-L574 HydrophobicContact CG1-CB 3.83Å; I413-L574 HydrophobicContact CG1-CD1 4.15Å; L416-L574 HydrophobicContact CD1-CD1 3.62Å; F570-L574 HydrophobicContact CD1-CD1 4.2Å; F570-L574 HydrophobicContact CE1-CD1 3.89Å; F570-L574 HydrophobicContact CE1-CG 4.29Å; F570-L574 HydrophobicContact CE2-CD2 4.35Å; F570-L574 HydrophobicContact CE2-CG 4.34Å; F570-L574 HydrophobicContact CZ-CD1 4.21Å; F570-L574 HydrophobicContact CZ-CD2 4.07Å; F570-L574 HydrophobicContact CZ-CG 4.16Å; F570-L574 WeakPolarHBondContact O-CG 3.34Å; F570-L574 PolarHBondContact O-N 2.67Å; Q571-L574 PolarHBondContact O-N 3.39Å; L574-Y576 PolarHBondContact O-N 3.47Å; L574-F577 PolarHBondContact O-N 3.39Å; L574-F577 VanDerWaalsContact O-N 3.14Å
575	L	96.1	Very high	91.6	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.2	-29.3	176.4	-78.6	170.2	0	0	0	113	I413 R464 L467 M468 Y471 Y517 Q571 A572 F573 F577 L578	I413-L575 HydrophobicContact CD1-CD2 3.79Å; I413-L575 HydrophobicContact CD1-CG 4.03Å; R464-L575 VanDerWaalsContact CD-O 3.26Å; R464-L575 WeakPolarHBondContact CD-O 3.41Å; R464-L575 HydrophobicContact CG-CB 4.5Å; L467-L575 HydrophobicContact CB-CD1 4.42Å; L467-L575 HydrophobicContact CD2-CD1 4.02Å; L467-L575 HydrophobicContact CD2-CD2 3.77Å; L467-L575 HydrophobicContact CG-CD1 3.83Å; L467-L575 HydrophobicContact CG-CD2 4.48Å; M468-L575 HydrophobicContact CB-CD1 4.44Å; M468-L575 HydrophobicContact CG-CB 3.66Å; M468-L575 HydrophobicContact CG-CD1 3.6Å; M468-L575 HydrophobicContact CG-CG 4.3Å; M468-L575 HydrophobicContact SD-CB 4.16Å; Y471-L575 HydrophobicContact CD2-CD1 3.64Å; Y471-L575 HydrophobicContact CE2-CD1 3.75Å; Y517-L575 HydrophobicContact CD1-CD2 4.25Å; Y517-L575 HydrophobicContact CE1-CD2 3.68Å; Q571-L575 WeakPolarHBondContact O-CG 3.15Å; Q571-L575 PolarHBondContact O-N 2.89Å; A572-L575 PolarHBondContact O-N 3.45Å; F573-L575 VanDerWaalsContact C-N 3.35Å; F573-L575 PolarHBondContact O-N 3.05Å; L575-F577 PolarHBondContact O-N 3.44Å; L575-L578 HydrophobicContact CD2-CD1 4.34Å; L575-L578 PolarHBondContact O-N 3.32Å; L575-L578 VanDerWaalsContact O-N 3.11Å
576	Y	94	Very high	90.5	Very high	158 Å²	158	55.9 Å²	55.9	62%	0.62	29%	0.294	S	S	*	.	H	α-helix	trans	-58.8	-33.7	176.6	-178.7	-99.7	0	0	0	112.6	R464 A572 F573 L574 L578	R464-Y576 PolarHBondContact NH1-O 3.42Å; A572-Y576 PolarHBondContact O-N 3.49Å; F573-Y576 VanDerWaalsContact O-CB 3.27Å; F573-Y576 WeakPolarHBondContact O-CB 3.12Å; F573-Y576 PolarHBondContact O-N 3.04Å; L574-Y576 PolarHBondContact O-N 3.47Å; Y576-L578 VanDerWaalsContact C-N 3.31Å; Y576-L578 PolarHBondContact O-N 2.84Å
577	F	93.3	Very high	89.1	Confident	96 Å²	96	59 Å²	59	42%	0.421	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-8.6	179.6	-63.9	-75.3	0	0	0	114.3	I409 F573 L574 L575	I409-F577 HydrophobicContact CD1-CB 3.97Å; F573-F577 HydrophobicContact CD1-CE2 4.08Å; F573-F577 HydrophobicContact CD2-CE2 4.42Å; F573-F577 AromaticContact CE1-CE2 3.56Å; F573-F577 HydrophobicContact CE1-CE2 3.56Å; F573-F577 HydrophobicContact CE1-CZ 4.22Å; F573-F577 AromaticContact CE2-CE2 3.93Å; F573-F577 HydrophobicContact CE2-CE2 3.93Å; F573-F577 HydrophobicContact CE2-CZ 4.16Å; F573-F577 HydrophobicContact CG-CE2 4.5Å; F573-F577 AromaticContact CZ-CE2 3.48Å; F573-F577 HydrophobicContact CZ-CE2 3.48Å; F573-F577 VanDerWaalsContact CZ-CE2 3.48Å; F573-F577 AromaticContact CZ-CZ 3.73Å; F573-F577 HydrophobicContact CZ-CZ 3.73Å; F573-F577 WeakPolarHBondContact O-CD2 3.34Å; L574-F577 PolarHBondContact O-N 3.39Å; L574-F577 VanDerWaalsContact O-N 3.14Å; L575-F577 PolarHBondContact O-N 3.44Å
578	L	92.8	Very high	87.4	Confident	4 Å²	4	63 Å²	63	2%	0.021	33%	0.328	C	S	.	.	S	Bend	trans	-91.1	146.1	175.7	-70.2	176.9	0	0	0	111	T406 I409 I413 R464 Y517 L521 L575 Y576	T406-L578 HydrophobicContact CG2-CD2 3.94Å; I409-L578 HydrophobicContact CB-CD2 4.07Å; I409-L578 HydrophobicContact CB-CG 4.42Å; I409-L578 HydrophobicContact CD1-CD2 4.41Å; I409-L578 HydrophobicContact CG2-CD1 3.89Å; I409-L578 HydrophobicContact CG2-CD2 3.93Å; I409-L578 HydrophobicContact CG2-CG 3.72Å; I413-L578 HydrophobicContact CD1-CD1 3.54Å; R464-L578 WeakPolarHBondContact CD-O 3.29Å; R464-L578 PolarHBondContact NH1-O 3.21Å; Y517-L578 HydrophobicContact CE1-CB 4.47Å; Y517-L578 HydrophobicContact CE1-CD1 4.01Å; Y517-L578 VanDerWaalsContact OH-CB 3.29Å; Y517-L578 WeakPolarHBondContact OH-CB 3.41Å; L521-L578 HydrophobicContact CD1-CD1 3.93Å; L521-L578 HydrophobicContact CD1-CD2 4.27Å; L575-L578 HydrophobicContact CD2-CD1 4.34Å; L575-L578 PolarHBondContact O-N 3.32Å; L575-L578 VanDerWaalsContact O-N 3.11Å; Y576-L578 VanDerWaalsContact C-N 3.31Å; Y576-L578 PolarHBondContact O-N 2.84Å
579	P	90.5	Very high	85.4	Confident	65 Å²	65	67.7 Å²	67.7	42%	0.422	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-67	149.9	174.9	29.7	-34.2	0	0	0	110.5	Y517 L521	Y517-P579 PolarHBondContact OH-O 2.97Å; L521-P579 HydrophobicContact CD2-CG 3.68Å
580	D	89.9	Confident	82.8	Confident	52 Å²	52	69 Å²	69	28%	0.278	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-76.7	150.2	173.1	-142.5	-27.9	0	0	0	110.7	Y462 R463 R464	Y462-D580 HydrophobicContact CD1-CB 4.42Å; R463-D580 PolarHBondContact N-OD1 3.37Å; R463-D580 VanDerWaalsContact N-OD1 3.13Å; R464-D580 HydrophobicContact CB-CB 4.32Å; R464-D580 VanDerWaalsContact CB-OD1 3.24Å; R464-D580 WeakPolarHBondContact CB-OD1 3.32Å; R464-D580 PolarHBondContact N-OD1 3.33Å; R464-D580 IonicContact NE-OD2 3.15Å; R464-D580 IonicContact NH2-OD2 2.8Å
581	T	88.9	Confident	79.7	Confident	17 Å²	17	73.3 Å²	73.3	10%	0.104	38%	0.383	C	S	.	.			trans	-123.2	143.1	175.3	69.5	0	0	0	0	110.1	R463 Y517 E520 L521	R463-T581 VanDerWaalsContact CD-OG1 3.27Å; R463-T581 WeakPolarHBondContact CD-OG1 3.34Å; R463-T581 PolarHBondContact N-O 3.45Å; Y517-T581 HydrophobicContact CD2-CG2 4.33Å; Y517-T581 WeakPolarHBondContact CD2-OG1 3.29Å; Y517-T581 HydrophobicContact CE2-CG2 4.02Å; E520-T581 HydrophobicContact CB-CG2 3.94Å; E520-T581 WeakPolarHBondContact OE2-CB 3.41Å; E520-T581 PolarHBondContact OE2-OG1 3.12Å; L521-T581 HydrophobicContact CD2-CG2 4.1Å
582	S	83.9	Confident	76.6	Confident	44 Å²	44	75.2 Å²	75.2	31%	0.308	40%	0.403	S	S	.	.			trans	-103.1	4.4	-179	52.1	0	0	0	0	113.4
583	G	75.4	Confident	73.6	Confident	33 Å²	33	81.4 Å²	81.4	34%	0.34	43%	0.434	S	S	.	.	S	Bend	trans	90.6	4.4	-173.1	0	0	0	0	0	115.6	R463 E520	R463-G583 VanDerWaalsContact NH2-CA 3.33Å; E520-G583 WeakPolarHBondContact OE1-CA 3.21Å
584	E	73.9	Confident	70.5	Confident	145 Å²	145	81.5 Å²	81.5	68%	0.678	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-87.3	133.4	172.6	-68.1	170.8	-157.7	0	0	109.9
585	D	69.7	Low	67.4	Low	104 Å²	104	84.5 Å²	84.5	56%	0.556	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-69.1	137.5	175.3	-78.6	-44.5	0	0	0	110.4	R527	R527-D585 IonicContact CZ-OD1 3.94Å; R527-D585 IonicContact NH1-OD1 3.45Å; R527-D585 IonicContact NH2-OD1 3.57Å; R527-D585 PolarHBondContact NH2-OD1 3.2Å
586	L	73.7	Confident	64.3	Low	73 Å²	73	89.8 Å²	89.8	38%	0.382	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-58.7	138.6	170	-73.3	162.9	0	0	0	110	E520 L521 P523 D588	E520-L586 VanDerWaalsContact O-CD1 3.31Å; E520-L586 WeakPolarHBondContact O-CD1 3.17Å; L521-L586 WeakPolarHBondContact O-CD1 3.47Å; P523-L586 HydrophobicContact CB-CB 4.37Å; L586-D588 PolarHBondContact O-N 3.41Å
587	P	69.5	Low	61.4	Low	106 Å²	106	86 Å²	86	69%	0.688	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-60.5	134.1	178.7	24.7	-32.9	0	0	0	110.3	V589	P587-V589 PolarHBondContact O-N 3.29Å
588	D	61.1	Low	58.5	Low	92 Å²	92	85.4 Å²	85.4	49%	0.492	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-64.7	125.1	169.6	-69.1	-35.8	0	0	0	108	S524 L586 D590	S524-D588 WeakPolarHBondContact CB-OD1 3.5Å; S524-D588 PolarHBondContact N-OD1 2.87Å; S524-D588 PolarHBondContact OG-OD1 3.18Å; S524-D588 VanDerWaalsContact OG-OD1 3.09Å; L586-D588 PolarHBondContact O-N 3.41Å; D588-D590 PolarHBondContact O-N 3.18Å
589	V	56	Low	55.4	Low	99 Å²	99	92.2 Å²	92.2	60%	0.6	52%	0.522	S	S	*	.	S	Bend	trans	-70.3	95.3	-179	178.7	0	0	0	0	108.6	P587	P587-V589 PolarHBondContact O-N 3.29Å
590	D	42.6	Very low	52.6	Low	130 Å²	130	96.8 Å²	96.8	70%	0.695	54%	0.538	S	S	*	.			trans	-135	20.1	152.5	-86.2	-27.6	0	0	0	111.8	D588	D588-D590 PolarHBondContact O-N 3.18Å
591	K	34.8	Very low	49.8	Very low	185 Å²	185	99.1 Å²	99.1	80%	0.804	55%	0.553	S	S	*	*	S	Bend	trans	-94.3	8	167.4	-73.6	-165.7	174.2	-171.5	0	114.6
592	G	32	Very low	46.9	Very low	40 Å²	40	107.1 Å²	107.1	41%	0.412	59%	0.589	S	S	.	*	S	Bend	trans	-103.1	-10.2	176.4	0	0	0	0	0	114.9
593	L	34.3	Very low	44.3	Very low	138 Å²	138	112.9 Å²	112.9	72%	0.723	61%	0.611	S	S	*	*	S	Bend	trans	-91.6	-24	173.1	-123.7	92	0	0	0	112.6	T597	L593-T597 PolarHBondContact O-OG1 2.83Å
594	E	31.4	Very low	41.9	Very low	116 Å²	116	118.1 Å²	118.1	54%	0.542	63%	0.631	S	S	.	*	S	Bend	trans	-78.1	-31	175.4	-77.8	175.5	164.9	0	0	112.5	T596 T597 D598	E594-T596 PolarHBondContact O-N 2.86Å; E594-T596 VanDerWaalsContact O-N 3.11Å; E594-T597 PolarHBondContact O-N 3.08Å; E594-T597 PolarHBondContact O-OG1 3.47Å; E594-D598 WeakPolarHBondContact O-CB 3.35Å; E594-D598 PolarHBondContact O-N 3.02Å
595	S	32.1	Very low	39.8	Very low	78 Å²	78	121 Å²	121	55%	0.545	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.5	-6.7	-177.6	79.2	0	0	0	0	115.4
596	T	30.5	Very low	38	Very low	111 Å²	111	119.2 Å²	119.2	68%	0.681	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-8.8	168.2	13.7	0	0	0	0	113.3	E594	E594-T596 PolarHBondContact O-N 2.86Å; E594-T596 VanDerWaalsContact O-N 3.11Å
597	T	33.1	Very low	36	Very low	78 Å²	78	123.6 Å²	123.6	48%	0.479	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.2	-26.3	171.9	30.9	0	0	0	0	112.8	L593 E594 N599 H600 V601	L593-T597 PolarHBondContact O-OG1 2.83Å; E594-T597 PolarHBondContact O-N 3.08Å; E594-T597 PolarHBondContact O-OG1 3.47Å; T597-N599 VanDerWaalsContact C-N 3.27Å; T597-N599 PolarHBondContact O-N 2.94Å; T597-H600 PolarHBondContact O-N 2.93Å; T597-V601 WeakPolarHBondContact O-CG2 3.46Å; T597-V601 PolarHBondContact O-N 3.11Å; T597-V601 VanDerWaalsContact O-N 3.17Å
598	D	31.6	Very low	34.6	Very low	84 Å²	84	123.4 Å²	123.4	45%	0.449	66%	0.661	S	S	.	*	H	α-helix	trans	-69.3	-19.4	179.4	-74.7	-18.1	0	0	0	114.3	E594 H600	E594-D598 WeakPolarHBondContact O-CB 3.35Å; E594-D598 PolarHBondContact O-N 3.02Å; D598-H600 PolarHBondContact O-N 2.83Å
599	N	29.1	Very low	33.6	Very low	147 Å²	147	122.5 Å²	122.5	79%	0.786	66%	0.662	S	S	*	*	H	α-helix	trans	-75.3	-10.2	169.2	-78.4	-8	0	0	0	113.4	T597	T597-N599 VanDerWaalsContact C-N 3.27Å; T597-N599 PolarHBondContact O-N 2.94Å
600	H	30.3	Very low	32.8	Very low	161 Å²	161	124.2 Å²	124.2	75%	0.745	67%	0.667	S	S	*	*	H	α-helix	trans	-112.3	-4.5	173.1	-84.1	-66.6	0	0	0	114.1	T597 D598	T597-H600 PolarHBondContact O-N 2.93Å; D598-H600 PolarHBondContact O-N 2.83Å
601	V	31.3	Very low	32.5	Very low	100 Å²	100	123.3 Å²	123.3	61%	0.606	66%	0.662	S	S	*	*	H	α-helix	trans	-94.7	-8.1	-178.2	175.9	0	0	0	0	113.5	T597 Q603	T597-V601 WeakPolarHBondContact O-CG2 3.46Å; T597-V601 PolarHBondContact O-N 3.11Å; T597-V601 VanDerWaalsContact O-N 3.17Å; V601-Q603 PolarHBondContact O-N 2.63Å
602	H	28	Very low	32.9	Very low	186 Å²	186	116.8 Å²	116.8	86%	0.861	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	4.2	167.4	-85.3	-56.9	0	0	0	115.1
603	Q	29.6	Very low	33.5	Very low	164 Å²	164	119 Å²	119	77%	0.766	65%	0.647	S	S	*	*	S	Bend	trans	-136.8	84.2	166.7	-73.8	-175.2	-12.8	0	0	109.1	V601	V601-Q603 PolarHBondContact O-N 2.63Å
604	N	26.4	Very low	34.1	Very low	143 Å²	143	121.2 Å²	121.2	77%	0.765	65%	0.646	S	S	*	*			trans	168.6	74.6	138.5	-82	-19.5	0	0	0	109.8	S606	N604-S606 PolarHBondContact O-N 2.89Å
605	E	28.8	Very low	34.6	Very low	205 Å²	205	122 Å²	122	96%	0.958	65%	0.65	S	S	*	*			trans	-65.7	89.4	147.9	-73.7	-179.8	156.1	0	0	107.9
606	S	31.4	Very low	35.5	Very low	67 Å²	67	124.1 Å²	124.1	47%	0.469	65%	0.651	S	S	.	*			trans	-162.2	106.7	154.7	45.4	0	0	0	0	109.2	N604 T608	N604-S606 PolarHBondContact O-N 2.89Å; S606-T608 PolarHBondContact O-N 3.49Å
607	N	31.8	Very low	36.2	Very low	165 Å²	165	122.4 Å²	122.4	88%	0.882	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	43.5	176.6	-92.7	-19	0	0	0	113.1
608	T	41.2	Very low	37.4	Very low	102 Å²	102	122 Å²	122	63%	0.626	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	1.8	175.5	32.3	0	0	0	0	113.2	S606 A612	S606-T608 PolarHBondContact O-N 3.49Å; T608-A612 VanDerWaalsContact O-CB 3.31Å; T608-A612 WeakPolarHBondContact O-CB 3.32Å
609	S	39.5	Very low	38.2	Very low	73 Å²	73	122.5 Å²	122.5	51%	0.51	64%	0.643	S	S	.	*	H	α-helix	trans	-86.6	-29.7	-175	60.2	0	0	0	0	115.1	V613	S609-V613 WeakPolarHBondContact O-CB 3.23Å; S609-V613 WeakPolarHBondContact O-CG2 3.43Å; S609-V613 PolarHBondContact O-N 3.16Å
610	I	38.8	Very low	39.3	Very low	135 Å²	135	119.7 Å²	119.7	69%	0.692	63%	0.628	S	S	*	*	H	α-helix	trans	-74.5	-39.2	-177.3	-61.4	178.9	0	0	0	111.4	V613 R614	I610-V613 PolarHBondContact O-N 3.42Å; I610-R614 WeakPolarHBondContact O-CB 3.49Å; I610-R614 PolarHBondContact O-N 3.07Å
611	D	37	Very low	40.4	Very low	112 Å²	112	117.7 Å²	117.7	60%	0.599	62%	0.622	S	S	*	*	H	α-helix	trans	-71.7	-35.2	175.2	-69.4	-33.2	0	0	0	111.5	R614 E615	D611-R614 PolarHBondContact O-N 3.05Å; D611-E615 PolarHBondContact O-N 3.45Å
612	A	42.6	Very low	41.3	Very low	48 Å²	48	116.6 Å²	116.6	40%	0.397	61%	0.613	S	S	.	*	H	α-helix	trans	-64	-42	173	0	0	0	0	0	112.4	T608 R614 E615 E616	T608-A612 VanDerWaalsContact O-CB 3.31Å; T608-A612 WeakPolarHBondContact O-CB 3.32Å; A612-R614 VanDerWaalsContact C-N 3.3Å; A612-R614 PolarHBondContact O-N 3.43Å; A612-E615 PolarHBondContact O-N 2.85Å; A612-E616 VanDerWaalsContact O-CB 3.23Å; A612-E616 WeakPolarHBondContact O-CB 3.42Å; A612-E616 PolarHBondContact O-N 2.75Å
613	V	45.7	Very low	42.5	Very low	85 Å²	85	110.9 Å²	110.9	52%	0.515	59%	0.591	S	S	.	*	H	α-helix	trans	-67	-34.6	175.9	171.5	0	0	0	0	111.1	S609 I610 C617	S609-V613 WeakPolarHBondContact O-CB 3.23Å; S609-V613 WeakPolarHBondContact O-CG2 3.43Å; S609-V613 PolarHBondContact O-N 3.16Å; I610-V613 PolarHBondContact O-N 3.42Å; V613-C617 WeakPolarHBondContact O-CB 3.31Å; V613-C617 PolarHBondContact O-N 3.43Å
614	R	45.2	Very low	43.6	Very low	185 Å²	185	108.2 Å²	108.2	70%	0.698	58%	0.582	S	S	*	*	H	α-helix	trans	-70.2	-42.8	176.1	-162.6	177.6	-174.2	174.3	1	111.8	I610 D611 A612 C617 V618	I610-R614 WeakPolarHBondContact O-CB 3.49Å; I610-R614 PolarHBondContact O-N 3.07Å; D611-R614 PolarHBondContact O-N 3.05Å; A612-R614 VanDerWaalsContact C-N 3.3Å; A612-R614 PolarHBondContact O-N 3.43Å; R614-C617 PolarHBondContact O-N 3.22Å; R614-V618 VanDerWaalsContact O-CG2 3.29Å; R614-V618 WeakPolarHBondContact O-CG2 3.27Å; R614-V618 PolarHBondContact O-N 3.43Å
615	E	43.4	Very low	45.1	Very low	134 Å²	134	106 Å²	106	63%	0.626	57%	0.566	S	S	*	*	H	α-helix	trans	-64.3	-40	172.5	-88.1	-171	153.5	0	0	111.9	D611 A612 V618 N619	D611-E615 PolarHBondContact O-N 3.45Å; A612-E615 PolarHBondContact O-N 2.85Å; E615-V618 PolarHBondContact O-N 2.96Å; E615-N619 VanDerWaalsContact O-CB 3.26Å; E615-N619 WeakPolarHBondContact O-CB 3.45Å; E615-N619 VanDerWaalsContact O-CG 3.25Å; E615-N619 PolarHBondContact O-N 3.36Å; E615-N619 PolarHBondContact O-ND2 2.68Å
616	E	50.2	Low	46.4	Very low	122 Å²	122	100.9 Å²	100.9	57%	0.57	55%	0.546	S	S	*	.	H	α-helix	trans	-67.5	-39	178.3	-165.7	172.7	-161.2	0	0	111.4	A612 N620	A612-E616 VanDerWaalsContact O-CB 3.23Å; A612-E616 WeakPolarHBondContact O-CB 3.42Å; A612-E616 PolarHBondContact O-N 2.75Å; E616-N620 WeakPolarHBondContact O-CB 3.31Å; E616-N620 PolarHBondContact O-N 2.94Å; E616-N620 PolarHBondContact O-ND2 3.48Å; E616-N620 VanDerWaalsContact O-ND2 3.13Å
617	C	44.3	Very low	47.2	Very low	74 Å²	74	106.8 Å²	106.8	50%	0.5	56%	0.558	S	S	.	*	H	α-helix	trans	-65.2	-41.1	172.2	-93.2	0	0	0	0	112.8	V613 R614 L621	V613-C617 WeakPolarHBondContact O-CB 3.31Å; V613-C617 PolarHBondContact O-N 3.43Å; R614-C617 PolarHBondContact O-N 3.22Å; C617-L621 WeakPolarHBondContact O-CB 3.5Å; C617-L621 PolarHBondContact O-N 3.48Å
618	V	59.7	Low	48.1	Very low	71 Å²	71	104.6 Å²	104.6	43%	0.43	55%	0.545	S	S	.	.	H	α-helix	trans	-69	-41.4	177.8	171.8	0	0	0	0	111.1	R614 E615 L621 N622	R614-V618 VanDerWaalsContact O-CG2 3.29Å; R614-V618 WeakPolarHBondContact O-CG2 3.27Å; R614-V618 PolarHBondContact O-N 3.43Å; E615-V618 PolarHBondContact O-N 2.96Å; V618-L621 PolarHBondContact O-N 3.14Å; V618-N622 VanDerWaalsContact O-CG 3.3Å; V618-N622 PolarHBondContact O-N 3.04Å; V618-N622 PolarHBondContact O-ND2 3.42Å
619	N	48.4	Very low	48.8	Very low	93 Å²	93	106 Å²	106	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-66.5	-37.7	175.7	-74.4	-22.3	0	0	0	111.8	E615 N622 T623	E615-N619 VanDerWaalsContact O-CB 3.26Å; E615-N619 WeakPolarHBondContact O-CB 3.45Å; E615-N619 VanDerWaalsContact O-CG 3.25Å; E615-N619 PolarHBondContact O-N 3.36Å; E615-N619 PolarHBondContact O-ND2 2.68Å; N619-N622 PolarHBondContact O-N 2.96Å; N619-T623 WeakPolarHBondContact O-CB 3.43Å; N619-T623 VanDerWaalsContact O-CG2 3.28Å; N619-T623 WeakPolarHBondContact O-CG2 3.19Å; N619-T623 PolarHBondContact O-N 3.34Å; N619-T623 PolarHBondContact O-OG1 2.77Å
620	N	52.6	Low	49.4	Very low	88 Å²	88	107 Å²	107	47%	0.471	55%	0.549	S	S	.	.	H	α-helix	trans	-66.9	-35.6	173.8	-77.7	-30.2	0	0	0	112.3	E616 T623 L624	E616-N620 WeakPolarHBondContact O-CB 3.31Å; E616-N620 PolarHBondContact O-N 2.94Å; E616-N620 PolarHBondContact O-ND2 3.48Å; E616-N620 VanDerWaalsContact O-ND2 3.13Å; N620-T623 WeakPolarHBondContact CA-OG1 3.47Å; N620-T623 PolarHBondContact O-OG1 2.67Å; N620-T623 VanDerWaalsContact O-OG1 3.12Å; N620-L624 WeakPolarHBondContact O-CB 3.41Å; N620-L624 PolarHBondContact O-N 3.01Å
621	L	52.6	Low	49.3	Very low	119 Å²	119	103.6 Å²	103.6	62%	0.623	54%	0.537	S	S	*	.	H	α-helix	trans	-67.8	-46.6	173.7	-104.5	143.4	0	0	0	112	C617 V618 L624 E625	C617-L621 WeakPolarHBondContact O-CB 3.5Å; C617-L621 PolarHBondContact O-N 3.48Å; V618-L621 PolarHBondContact O-N 3.14Å; L621-L624 WeakPolarHBondContact O-CB 3.42Å; L621-L624 PolarHBondContact O-N 2.91Å; L621-E625 PolarHBondContact O-N 2.89Å
622	N	49.6	Very low	49.7	Very low	78 Å²	78	103.5 Å²	103.5	42%	0.417	54%	0.543	S	S	.	.	H	α-helix	trans	-65.4	-40.6	178.4	-68.6	-17.5	0	0	0	111.7	V618 N619 L624 E625 D626	V618-N622 VanDerWaalsContact O-CG 3.3Å; V618-N622 PolarHBondContact O-N 3.04Å; V618-N622 PolarHBondContact O-ND2 3.42Å; N619-N622 PolarHBondContact O-N 2.96Å; N622-L624 PolarHBondContact O-N 3.06Å; N622-E625 PolarHBondContact O-N 2.95Å; N622-D626 WeakPolarHBondContact O-CB 3.5Å; N622-D626 PolarHBondContact O-N 3.27Å
623	T	54.3	Low	49.8	Very low	66 Å²	66	107.3 Å²	107.3	41%	0.405	56%	0.561	S	S	.	*	H	α-helix	trans	-69	-31.1	175.2	51.3	0	0	0	0	112.8	N619 N620 R627	N619-T623 WeakPolarHBondContact O-CB 3.43Å; N619-T623 VanDerWaalsContact O-CG2 3.28Å; N619-T623 WeakPolarHBondContact O-CG2 3.19Å; N619-T623 PolarHBondContact O-N 3.34Å; N619-T623 PolarHBondContact O-OG1 2.77Å; N620-T623 WeakPolarHBondContact CA-OG1 3.47Å; N620-T623 PolarHBondContact O-OG1 2.67Å; N620-T623 VanDerWaalsContact O-OG1 3.12Å; T623-R627 VanDerWaalsContact O-CB 3.31Å; T623-R627 WeakPolarHBondContact O-CB 3.49Å; T623-R627 WeakPolarHBondContact O-CG 3.41Å; T623-R627 PolarHBondContact O-N 3.46Å
624	L	52.6	Low	49.3	Very low	108 Å²	108	108.9 Å²	108.9	57%	0.565	57%	0.571	S	S	*	*	H	α-helix	trans	-66.1	-43.9	169.3	-115.2	127.4	0	0	0	111.2	N620 L621 N622 R627 I628	N620-L624 WeakPolarHBondContact O-CB 3.41Å; N620-L624 PolarHBondContact O-N 3.01Å; L621-L624 WeakPolarHBondContact O-CB 3.42Å; L621-L624 PolarHBondContact O-N 2.91Å; N622-L624 PolarHBondContact O-N 3.06Å; L624-R627 PolarHBondContact O-N 3.17Å; L624-I628 HydrophobicContact CD2-CD1 4.31Å; L624-I628 WeakPolarHBondContact O-CB 3.41Å; L624-I628 WeakPolarHBondContact O-CD1 3.49Å; L624-I628 WeakPolarHBondContact O-CG1 3.42Å; L624-I628 PolarHBondContact O-N 3.17Å
625	E	56.5	Low	48.9	Very low	95 Å²	95	106.2 Å²	106.2	44%	0.444	58%	0.575	S	S	.	*	H	α-helix	trans	-64.9	-40.2	178.6	-135.9	-168.8	136.5	0	0	111.9	L621 N622 I628 K629	L621-E625 PolarHBondContact O-N 2.89Å; N622-E625 PolarHBondContact O-N 2.95Å; E625-I628 PolarHBondContact O-N 3.11Å; E625-K629 WeakPolarHBondContact O-CB 3.24Å; E625-K629 WeakPolarHBondContact O-CG 3.29Å; E625-K629 PolarHBondContact O-N 2.72Å; E625-K629 WeakPolarHBondContact OE1-CE 3.46Å; E625-K629 IonicContact OE1-NZ 3.65Å; E625-K629 PolarHBondContact OE1-NZ 3.34Å
626	D	56.9	Low	48.6	Very low	98 Å²	98	105.3 Å²	105.3	52%	0.524	58%	0.579	S	S	.	*	H	α-helix	trans	-70.4	-35.5	175.9	-74.7	-21.7	0	0	0	112.4	N622 K629 S630	N622-D626 WeakPolarHBondContact O-CB 3.5Å; N622-D626 PolarHBondContact O-N 3.27Å; D626-K629 PolarHBondContact O-N 3.37Å; D626-S630 VanDerWaalsContact O-CB 3.28Å; D626-S630 WeakPolarHBondContact O-CB 3.46Å; D626-S630 PolarHBondContact O-N 3.06Å; D626-S630 PolarHBondContact O-OG 2.88Å
627	R	48.6	Very low	47.7	Very low	191 Å²	191	108.4 Å²	108.4	72%	0.721	59%	0.593	S	S	*	*	H	α-helix	trans	-65.8	-38.8	171.7	-78.9	177.2	-178.4	-164.2	3	111.8	T623 L624 S631	T623-R627 VanDerWaalsContact O-CB 3.31Å; T623-R627 WeakPolarHBondContact O-CB 3.49Å; T623-R627 WeakPolarHBondContact O-CG 3.41Å; T623-R627 PolarHBondContact O-N 3.46Å; L624-R627 PolarHBondContact O-N 3.17Å; R627-S631 PolarHBondContact O-N 3.3Å; R627-S631 PolarHBondContact O-OG 2.67Å
628	I	50.5	Low	47.3	Very low	119 Å²	119	116.4 Å²	116.4	61%	0.61	63%	0.63	S	S	*	*	H	α-helix	trans	-66.2	-38.7	174.7	-69	164.3	0	0	0	110.8	L624 E625	L624-I628 HydrophobicContact CD2-CD1 4.31Å; L624-I628 WeakPolarHBondContact O-CB 3.41Å; L624-I628 WeakPolarHBondContact O-CD1 3.49Å; L624-I628 WeakPolarHBondContact O-CG1 3.42Å; L624-I628 PolarHBondContact O-N 3.17Å; E625-I628 PolarHBondContact O-N 3.11Å
629	K	55.3	Low	46.7	Very low	133 Å²	133	118.7 Å²	118.7	58%	0.578	64%	0.64	S	S	*	*	H	α-helix	trans	-75.1	-31	178.7	-73.4	170.6	-171.7	161	0	113.8	E625 D626	E625-K629 WeakPolarHBondContact O-CB 3.24Å; E625-K629 WeakPolarHBondContact O-CG 3.29Å; E625-K629 PolarHBondContact O-N 2.72Å; E625-K629 WeakPolarHBondContact OE1-CE 3.46Å; E625-K629 IonicContact OE1-NZ 3.65Å; E625-K629 PolarHBondContact OE1-NZ 3.34Å; D626-K629 PolarHBondContact O-N 3.37Å
630	S	52.9	Low	46.6	Very low	93 Å²	93	120.1 Å²	120.1	65%	0.65	65%	0.647	S	S	*	*	H	α-helix	trans	-91.1	-6	-175.1	57.9	0	0	0	0	115.2	D626	D626-S630 VanDerWaalsContact O-CB 3.28Å; D626-S630 WeakPolarHBondContact O-CB 3.46Å; D626-S630 PolarHBondContact O-N 3.06Å; D626-S630 PolarHBondContact O-OG 2.88Å
631	S	36.9	Very low	46.3	Very low	63 Å²	63	121.8 Å²	121.8	44%	0.441	66%	0.657	S	S	.	*			trans	-122.6	83.6	171.6	70.7	0	0	0	0	112.8	R627 T633	R627-S631 PolarHBondContact O-N 3.3Å; R627-S631 PolarHBondContact O-OG 2.67Å; S631-T633 PolarHBondContact O-N 3.5Å; S631-T633 VanDerWaalsContact O-N 3.16Å
632	P	45.8	Very low	45.9	Very low	111 Å²	111	122 Å²	122	72%	0.721	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	5.1	179.6	-13.1	29	0	0	0	115.3
633	T	44.8	Very low	45.7	Very low	127 Å²	127	124.8 Å²	124.8	78%	0.779	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.7	19.6	-166.9	36.5	0	0	0	0	116.7	S631	S631-T633 PolarHBondContact O-N 3.5Å; S631-T633 VanDerWaalsContact O-N 3.16Å
634	T	34.5	Very low	45.1	Very low	119 Å²	119	128.7 Å²	128.7	73%	0.73	69%	0.692	S	S	*	*			trans	-136	44.9	171.4	-23.5	0	0	0	0	112.9
635	V	37.1	Very low	44.6	Very low	128 Å²	128	130.1 Å²	130.1	78%	0.776	70%	0.701	S	S	*	*			trans	-99.3	78.2	161.8	-176.3	0	0	0	0	107.7
636	T	36.3	Very low	43.7	Very low	116 Å²	116	132.8 Å²	132.8	71%	0.712	72%	0.721	S	S	*	*	S	Bend	trans	-143.5	-1.6	163.2	23.8	0	0	0	0	115.5
637	H	32.3	Very low	42.6	Very low	187 Å²	187	135.8 Å²	135.8	87%	0.866	74%	0.738	S	S	*	*			trans	-150.3	80	168.4	-81.9	-64.5	0	0	0	112.8
638	L	35.7	Very low	42	Very low	242 Å²	242	130.7 Å²	130.7	100%	1.267	74%	0.739	S	S	*	*			trans	-165.8	0	151.5	-102.6	154.8	0	0	0	106.2

Retrieved 638 of 638 residues in 1319.5 ms (Link to these results)

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