IFT56_MACFA Loading...

Intraflagellar transport protein 56

Component of the intraflagellar transport (IFT) complex B required for transport of proteins in the motile cilium. Required for transport of specific ciliary cargo proteins related to motility, while it is neither required for IFT complex B assembly or motion nor for cilium assembly. Required for efficient coupling between the accumulation of GLI2 and GLI3 at the ciliary tips and their dissociation from the negative regulator SUFU. Plays a key role in maintaining the integrity of the IFT complex B and the proper ciliary localization of the IFT complex B components. Not required for IFT complex A ciliary localization or function. Essential for maintaining proper microtubule organization within the ciliary axoneme.

AlphaFold DB , UniProt , Accession Q4R7Z9, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene IFT56, Length 554 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	37.5	Very low	34.9	Very low	105 Å²	105	99.7 Å²	99.7	52%	0.517	57%	0.574	S	S	.	*				0	90	0	-168	179	-160.4	0	0	109.3	L3 L259	M1-L3 HydrophobicContact CE-CD2 4.48Å; M1-L259 HydrophobicContact CE-CB 3.95Å; M1-L259 HydrophobicContact CE-CD1 3.1Å; M1-L259 HydrophobicContact CE-CD2 3.5Å; M1-L259 VanDerWaalsContact CE-CD2 3.5Å; M1-L259 HydrophobicContact CE-CG 3.63Å; M1-L259 HydrophobicContact SD-CD1 3.87Å; M1-L259 HydrophobicContact SD-CD2 3.19Å; M1-L259 WeakPolarHBondContact SD-CD2 3.39Å; M1-L259 HydrophobicContact SD-CG 4.02Å
2	M	34.6	Very low	34.3	Very low	114 Å²	114	111.4 Å²	111.4	56%	0.562	60%	0.602	S	S	*	*			trans	-102	111.7	162.6	-75	-162	-70.9	0	0	105.8	S4 F103	M2-S4 PolarHBondContact O-N 2.87Å; M2-F103 HydrophobicContact SD-CE1 4.1Å
3	L	39.1	Very low	33.8	Very low	46 Å²	46	108.2 Å²	108.2	24%	0.241	61%	0.611	C	S	.	*			trans	-55.7	130.3	171.5	-70.9	163	0	0	0	107.6	M1 R5 F255 V283 I284	M1-L3 HydrophobicContact CE-CD2 4.48Å; L3-R5 PolarHBondContact O-N 3.36Å; L3-R5 VanDerWaalsContact O-N 3.1Å; L3-F255 HydrophobicContact CD1-CB 3.91Å; L3-F255 HydrophobicContact CD1-CD2 4.24Å; L3-V283 HydrophobicContact CD2-CG1 4.23Å; L3-I284 HydrophobicContact CD2-CG1 4.29Å
4	S	42.8	Very low	33.7	Very low	50 Å²	50	110.8 Å²	110.8	35%	0.35	63%	0.63	S	S	.	*	S	Bend	trans	-60.1	-21.7	-179.6	61	0	0	0	0	112.3	M2 D282	M2-S4 PolarHBondContact O-N 2.87Å; S4-D282 PolarHBondContact OG-O 3.34Å
5	R	39	Very low	33.2	Very low	185 Å²	185	114.8 Å²	114.8	70%	0.698	64%	0.641	S	S	*	*			trans	-149.2	112.4	178.5	-64	-177.8	172.4	165.6	-2	109.5	L3 K7	L3-R5 PolarHBondContact O-N 3.36Å; L3-R5 VanDerWaalsContact O-N 3.1Å; R5-K7 PolarHBondContact O-N 3.39Å
6	A	38.5	Very low	33	Very low	60 Å²	60	115.2 Å²	115.2	50%	0.496	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-73.5	121.8	161.7	0	0	0	0	0	108.3
7	K	35	Very low	33	Very low	188 Å²	188	116.2 Å²	116.2	82%	0.817	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-68.1	144.7	161.6	-84.7	-177.9	-179.5	169.9	0	108.1	R5 A9	R5-K7 PolarHBondContact O-N 3.39Å; K7-A9 PolarHBondContact O-N 3.25Å
8	P	30.2	Very low	32.8	Very low	65 Å²	65	118.1 Å²	118.1	42%	0.422	67%	0.668	S	S	.	*	P	Polyproline II helix	trans	-62.5	132	-175	-13.3	26.2	0	0	0	110.7	V10 K74	P8-V10 PolarHBondContact O-N 3.26Å; P8-V10 VanDerWaalsContact O-N 3.08Å; P8-K74 HydrophobicContact CB-CD 4.23Å; P8-K74 HydrophobicContact CG-CD 3.94Å; P8-K74 VanDerWaalsContact CG-CE 3.49Å; P8-K74 VanDerWaalsContact CG-NZ 3.27Å
9	A	30.6	Very low	32.9	Very low	84 Å²	84	122.9 Å²	122.9	69%	0.694	68%	0.681	S	S	*	*			trans	-64.5	107.8	163.8	0	0	0	0	0	107.8	K7 G11	K7-A9 PolarHBondContact O-N 3.25Å; A9-G11 PolarHBondContact O-N 3.41Å; A9-G11 VanDerWaalsContact O-N 3.07Å
10	V	29.4	Very low	33	Very low	128 Å²	128	126 Å²	126	78%	0.776	69%	0.686	S	S	*	*			trans	-74.2	102.1	175	-175.1	0	0	0	0	107	P8 R12	P8-V10 PolarHBondContact O-N 3.26Å; P8-V10 VanDerWaalsContact O-N 3.08Å; V10-R12 PolarHBondContact O-N 3.03Å
11	G	27.2	Very low	33.1	Very low	72 Å²	72	129.9 Å²	129.9	74%	0.742	70%	0.697	S	S	*	*			trans	-58.5	117.7	178.3	0	0	0	0	0	111.4	A9	A9-G11 PolarHBondContact O-N 3.41Å; A9-G11 VanDerWaalsContact O-N 3.07Å
12	R	27.3	Very low	33.2	Very low	240 Å²	240	133 Å²	133	91%	0.906	71%	0.708	S	S	*	*			trans	-146.1	134.3	159.7	-77.4	-164.9	176.4	178.3	-1.1	111.7	V10	V10-R12 PolarHBondContact O-N 3.03Å
13	G	28.3	Very low	33.3	Very low	70 Å²	70	137.6 Å²	137.6	72%	0.722	72%	0.724	S	S	*	*			trans	102.2	76.5	156	0	0	0	0	0	115	Q15	G13-Q15 PolarHBondContact O-N 3.44Å
14	V	31.9	Very low	33.6	Very low	144 Å²	144	139.2 Å²	139.2	87%	0.873	75%	0.752	S	S	*	*			trans	-56.4	106.6	154.8	177.6	0	0	0	0	106.8
15	Q	27.1	Very low	34	Very low	171 Å²	171	147 Å²	147	80%	0.799	77%	0.774	S	S	*	*			trans	-62.9	131.2	166	-81.9	-172	3	0	0	107.9	G13 T17	G13-Q15 PolarHBondContact O-N 3.44Å; Q15-T17 PolarHBondContact O-N 3.4Å
16	P	29.1	Very low	35.3	Very low	121 Å²	121	147.6 Å²	147.6	79%	0.786	78%	0.781	S	S	*	*			trans	-70.8	103.4	-176.8	28.1	-30.9	0	0	0	108.2	D18	P16-D18 PolarHBondContact O-N 2.95Å
17	T	33.8	Very low	37	Very low	132 Å²	132	150.7 Å²	150.7	81%	0.81	79%	0.788	S	S	*	*			trans	-67.5	125.8	166.4	46	0	0	0	0	108.2	Q15 K19	Q15-T17 PolarHBondContact O-N 3.4Å; T17-K19 PolarHBondContact O-N 3.18Å
18	D	29.5	Very low	39.3	Very low	151 Å²	151	144.8 Å²	144.8	81%	0.807	77%	0.769	S	S	*	*			trans	-42	123.3	-177.6	-89.8	-46.6	0	0	0	112.5	P16 K20	P16-D18 PolarHBondContact O-N 2.95Å; D18-K20 PolarHBondContact O-N 3.02Å
19	K	34.6	Very low	42.1	Very low	210 Å²	210	149 Å²	149	91%	0.913	78%	0.781	S	S	*	*			trans	-67.1	64.2	172.1	-70.5	-179.2	177.1	175.3	0	110.9	T17	T17-K19 PolarHBondContact O-N 3.18Å
20	K	33.9	Very low	44.8	Very low	183 Å²	183	145.5 Å²	145.5	80%	0.796	75%	0.75	S	S	*	*			trans	-93.4	97.3	160.8	-83.5	-176	178.4	172.5	0	108.7	D18 K22	D18-K20 PolarHBondContact O-N 3.02Å; K20-K22 PolarHBondContact O-N 2.88Å
21	K	34.9	Very low	47.8	Very low	209 Å²	209	145.4 Å²	145.4	91%	0.909	74%	0.741	S	S	*	*			trans	-32.3	94.5	165.5	-71.6	174.5	173.4	175	0	111.7
22	K	41.4	Very low	50.8	Low	171 Å²	171	146.2 Å²	146.2	74%	0.743	73%	0.726	S	S	*	*			trans	-99.2	97.6	165.3	-82.4	-174	176.6	177	0	108.6	K20	K20-K22 PolarHBondContact O-N 2.88Å
23	K	36.6	Very low	53.9	Low	210 Å²	210	135.5 Å²	135.5	91%	0.913	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.4	130.2	167.8	-72.5	176.2	170.8	-179.6	0	109.7
24	G	44.6	Very low	56.9	Low	79 Å²	79	133.6 Å²	133.6	81%	0.814	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	92	17.4	154.5	0	0	0	0	0	119.3	K26	G24-K26 PolarHBondContact O-N 3.25Å
25	R	50.9	Low	59.6	Low	215 Å²	215	131.3 Å²	131.3	81%	0.811	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-77.6	117.8	167.6	-88.9	-176.9	169.5	178.7	-6.4	109.7	I27	R25-I27 PolarHBondContact O-N 2.84Å
26	K	66.1	Low	62.5	Low	197 Å²	197	129.7 Å²	129.7	86%	0.857	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-51.1	135.8	168.6	-71	-178.7	176.2	-179.1	0	108.8	G24 P28	G24-K26 PolarHBondContact O-N 3.25Å; K26-P28 WeakPolarHBondContact O-CD 3.23Å
27	I	74.4	Confident	65.2	Low	125 Å²	125	133.3 Å²	133.3	64%	0.641	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-57	123.4	173	-60.3	172.4	0	0	0	107	R25 L45	R25-I27 PolarHBondContact O-N 2.84Å; I27-L45 HydrophobicContact CG2-CD1 3.58Å
28	P	82.9	Confident	67.9	Low	64 Å²	64	130.4 Å²	130.4	42%	0.416	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-57.6	143.7	177.1	-22.4	32.7	0	0	0	110.6	K26 L33 L45	K26-P28 WeakPolarHBondContact O-CD 3.23Å; P28-L33 HydrophobicContact CB-CD1 4.24Å; P28-L33 HydrophobicContact CB-CD2 4.09Å; P28-L33 HydrophobicContact CB-CG 4.08Å; P28-L45 WeakPolarHBondContact O-CD2 3.45Å
29	K	89.1	Confident	70.9	Confident	153 Å²	153	124.3 Å²	124.3	67%	0.665	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-76.3	151.9	173	-68.5	-171.1	174.1	-169.6	0	110.4	E31 E32 L33	K29-E31 VanDerWaalsContact C-N 3.29Å; K29-E31 WeakPolarHBondContact CB-OE2 3.33Å; K29-E31 PolarHBondContact O-N 3.25Å; K29-E32 HydrophobicContact CB-CB 4.49Å; K29-E32 WeakPolarHBondContact O-CB 3.45Å; K29-E32 PolarHBondContact O-N 3Å; K29-E32 VanDerWaalsContact O-N 3.15Å; K29-L33 PolarHBondContact O-N 3.36Å
30	L	88.8	Confident	73.6	Confident	11 Å²	11	118.2 Å²	118.2	6%	0.058	57%	0.565	C	S	.	*	H	α-helix	trans	-57.6	-44.2	179.3	178.6	62.9	0	0	0	111.2	E32 L33 L34 A42 L45 L46 W62	L30-E32 VanDerWaalsContact C-N 3.26Å; L30-E32 PolarHBondContact O-N 3.37Å; L30-L33 WeakPolarHBondContact O-CB 3.49Å; L30-L33 PolarHBondContact O-N 3Å; L30-L33 VanDerWaalsContact O-N 3.08Å; L30-L34 HydrophobicContact CD1-CD1 4.2Å; L30-L34 HydrophobicContact CD1-CG 4.14Å; L30-L34 HydrophobicContact CD2-CD1 4.4Å; L30-L34 HydrophobicContact CG-CD1 3.86Å; L30-L34 HydrophobicContact CG-CG 4.23Å; L30-L34 WeakPolarHBondContact O-CG 3.42Å; L30-L34 PolarHBondContact O-N 2.94Å; L30-A42 HydrophobicContact CD1-CB 3.92Å; L30-L45 HydrophobicContact CB-CD2 4.32Å; L30-L46 HydrophobicContact CD1-CD1 3.96Å; L30-L46 HydrophobicContact CD1-CD2 4.09Å; L30-L46 HydrophobicContact CD1-CG 3.97Å; L30-L46 HydrophobicContact CD2-CD2 3.89Å; L30-W62 HydrophobicContact CD2-CB 4.48Å; L30-W62 HydrophobicContact CD2-CD2 4.43Å; L30-W62 HydrophobicContact CD2-CG 4.07Å
31	E	90.6	Very high	76.4	Confident	125 Å²	125	110.4 Å²	110.4	58%	0.584	54%	0.536	S	S	*	.	H	α-helix	trans	-63.3	-32.8	-179.4	-56.2	79.6	-175.3	0	0	112.1	K29 S35	K29-E31 VanDerWaalsContact C-N 3.29Å; K29-E31 WeakPolarHBondContact CB-OE2 3.33Å; K29-E31 PolarHBondContact O-N 3.25Å; E31-S35 VanDerWaalsContact O-CB 3.26Å; E31-S35 WeakPolarHBondContact O-CB 2.9Å; E31-S35 PolarHBondContact O-N 3.08Å; E31-S35 PolarHBondContact O-OG 3.04Å
32	E	91.7	Very high	79.2	Confident	89 Å²	89	100.5 Å²	100.5	42%	0.416	49%	0.493	S	S	.	.	H	α-helix	trans	-68.6	-39.3	175.4	-166.5	-172.4	160.6	0	0	111.3	K29 L30 S35 K36	K29-E32 HydrophobicContact CB-CB 4.49Å; K29-E32 WeakPolarHBondContact O-CB 3.45Å; K29-E32 PolarHBondContact O-N 3Å; K29-E32 VanDerWaalsContact O-N 3.15Å; L30-E32 VanDerWaalsContact C-N 3.26Å; L30-E32 PolarHBondContact O-N 3.37Å; E32-S35 WeakPolarHBondContact CA-OG 3.42Å; E32-S35 PolarHBondContact O-OG 2.91Å; E32-K36 HydrophobicContact CG-CD 4.36Å; E32-K36 WeakPolarHBondContact O-CB 3.41Å; E32-K36 VanDerWaalsContact O-CG 3.31Å; E32-K36 WeakPolarHBondContact O-CG 3.33Å; E32-K36 PolarHBondContact O-N 3.41Å; E32-K36 IonicContact OE1-NZ 3.42Å; E32-K36 PolarHBondContact OE1-NZ 3.17Å
33	L	91.2	Very high	81.6	Confident	16 Å²	16	92.9 Å²	92.9	8%	0.084	46%	0.46	C	S	.	.	H	α-helix	trans	-69.3	-44.6	176.8	-64.9	168.2	0	0	0	110.9	P28 K29 L30 K36 R37 D38 A42 L45	P28-L33 HydrophobicContact CB-CD1 4.24Å; P28-L33 HydrophobicContact CB-CD2 4.09Å; P28-L33 HydrophobicContact CB-CG 4.08Å; K29-L33 PolarHBondContact O-N 3.36Å; L30-L33 WeakPolarHBondContact O-CB 3.49Å; L30-L33 PolarHBondContact O-N 3Å; L30-L33 VanDerWaalsContact O-N 3.08Å; L33-K36 CarbonylContact O-C 3.53Å; L33-K36 PolarHBondContact O-N 3.19Å; L33-R37 PolarHBondContact O-N 2.88Å; L33-D38 HydrophobicContact CD2-CB 4.22Å; L33-D38 PolarHBondContact O-N 3.19Å; L33-A42 HydrophobicContact CB-CB 4.07Å; L33-L45 HydrophobicContact CD1-CB 4.17Å; L33-L45 HydrophobicContact CD1-CD2 3.76Å
34	L	91	Very high	84.3	Confident	30 Å²	30	87 Å²	87	16%	0.157	44%	0.442	C	S	.	.	H	α-helix	trans	-64.2	-44.3	178.4	-67	175.7	0	0	0	112.2	L30 K36 R37 F39 A42 W62 Y65	L30-L34 HydrophobicContact CD1-CD1 4.2Å; L30-L34 HydrophobicContact CD1-CG 4.14Å; L30-L34 HydrophobicContact CD2-CD1 4.4Å; L30-L34 HydrophobicContact CG-CD1 3.86Å; L30-L34 HydrophobicContact CG-CG 4.23Å; L30-L34 WeakPolarHBondContact O-CG 3.42Å; L30-L34 PolarHBondContact O-N 2.94Å; L34-K36 VanDerWaalsContact C-N 3.28Å; L34-K36 PolarHBondContact O-N 3.4Å; L34-R37 WeakPolarHBondContact O-CA 3.47Å; L34-R37 PolarHBondContact O-N 3.38Å; L34-F39 HydrophobicContact CD2-CD1 4.28Å; L34-F39 HydrophobicContact CD2-CE1 4.34Å; L34-A42 HydrophobicContact CD2-CB 4.24Å; L34-W62 HydrophobicContact CD1-CD2 4.19Å; L34-W62 HydrophobicContact CD1-CE3 3.62Å; L34-W62 HydrophobicContact CD1-CH2 3.92Å; L34-W62 HydrophobicContact CD1-CZ2 4.43Å; L34-W62 HydrophobicContact CD1-CZ3 3.48Å; L34-W62 VanDerWaalsContact CD1-CZ3 3.48Å; L34-W62 HydrophobicContact CD2-CE3 4.27Å; L34-W62 HydrophobicContact CD2-CZ3 4.4Å; L34-Y65 HydrophobicContact CD2-CD1 4.26Å; L34-Y65 HydrophobicContact CD2-CE1 4.17Å
35	S	88.7	Confident	86.6	Confident	95 Å²	95	84.3 Å²	84.3	66%	0.664	41%	0.409	S	S	*	.	H	α-helix	trans	-63.9	-33.1	176.9	55.7	0	0	0	0	112.8	E31 E32 R37	E31-S35 VanDerWaalsContact O-CB 3.26Å; E31-S35 WeakPolarHBondContact O-CB 2.9Å; E31-S35 PolarHBondContact O-N 3.08Å; E31-S35 PolarHBondContact O-OG 3.04Å; E32-S35 WeakPolarHBondContact CA-OG 3.42Å; E32-S35 PolarHBondContact O-OG 2.91Å; S35-R37 VanDerWaalsContact C-N 3.25Å; S35-R37 PolarHBondContact O-N 3.44Å
36	K	88.7	Confident	88.7	Confident	138 Å²	138	74.2 Å²	74.2	60%	0.6	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-3.5	171.6	-71.1	174.1	178.2	172.1	0	113.8	E32 L33 L34 D38	E32-K36 HydrophobicContact CG-CD 4.36Å; E32-K36 WeakPolarHBondContact O-CB 3.41Å; E32-K36 VanDerWaalsContact O-CG 3.31Å; E32-K36 WeakPolarHBondContact O-CG 3.33Å; E32-K36 PolarHBondContact O-N 3.41Å; E32-K36 IonicContact OE1-NZ 3.42Å; E32-K36 PolarHBondContact OE1-NZ 3.17Å; L33-K36 CarbonylContact O-C 3.53Å; L33-K36 PolarHBondContact O-N 3.19Å; L34-K36 VanDerWaalsContact C-N 3.28Å; L34-K36 PolarHBondContact O-N 3.4Å; K36-D38 PolarHBondContact O-N 3.21Å
37	R	86.1	Confident	89.9	Confident	196 Å²	196	67.5 Å²	67.5	74%	0.74	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	27.3	-173.1	-57	-177.6	175.9	-169.6	-1.4	113.5	L33 L34 S35 F39	L33-R37 PolarHBondContact O-N 2.88Å; L34-R37 WeakPolarHBondContact O-CA 3.47Å; L34-R37 PolarHBondContact O-N 3.38Å; S35-R37 VanDerWaalsContact C-N 3.25Å; S35-R37 PolarHBondContact O-N 3.44Å; R37-F39 HydrophobicContact CB-CD2 4.5Å; R37-F39 HydrophobicContact CB-CE2 3.79Å; R37-F39 HydrophobicContact CB-CZ 3.94Å; R37-F39 HydrophobicContact CG-CE2 4.39Å; R37-F39 HydrophobicContact CG-CZ 4.16Å; R37-F39 VanDerWaalsContact O-CD2 3.29Å; R37-F39 WeakPolarHBondContact O-CD2 3.2Å; R37-F39 PolarHBondContact O-N 3.04Å
38	D	90.6	Very high	90.7	Very high	71 Å²	71	67.1 Å²	67.1	38%	0.38	34%	0.336	S	S	.	.			trans	-82.5	72.1	172.7	-175.9	6	0	0	0	109.7	L33 K36 T40 G41 A42	L33-D38 HydrophobicContact CD2-CB 4.22Å; L33-D38 PolarHBondContact O-N 3.19Å; K36-D38 PolarHBondContact O-N 3.21Å; D38-T40 VanDerWaalsContact C-N 3.3Å; D38-T40 PolarHBondContact O-N 3.3Å; D38-G41 PolarHBondContact O-N 3.36Å; D38-G41 PolarHBondContact OD1-N 3.4Å; D38-A42 WeakPolarHBondContact O-CB 3.35Å; D38-A42 PolarHBondContact O-N 3.08Å
39	F	92.2	Very high	91	Very high	24 Å²	24	66.1 Å²	66.1	11%	0.105	33%	0.325	C	S	.	.	H	α-helix	trans	-67.3	-30.3	-176.9	-58.7	-61.8	0	0	0	112.7	L34 R37 A42 I43 Y65 C66 H69 L70	L34-F39 HydrophobicContact CD2-CD1 4.28Å; L34-F39 HydrophobicContact CD2-CE1 4.34Å; R37-F39 HydrophobicContact CB-CD2 4.5Å; R37-F39 HydrophobicContact CB-CE2 3.79Å; R37-F39 HydrophobicContact CB-CZ 3.94Å; R37-F39 HydrophobicContact CG-CE2 4.39Å; R37-F39 HydrophobicContact CG-CZ 4.16Å; R37-F39 VanDerWaalsContact O-CD2 3.29Å; R37-F39 WeakPolarHBondContact O-CD2 3.2Å; R37-F39 PolarHBondContact O-N 3.04Å; F39-A42 PolarHBondContact O-N 3.48Å; F39-I43 WeakPolarHBondContact O-CG1 3.48Å; F39-I43 PolarHBondContact O-N 3.41Å; F39-Y65 HydrophobicContact CE1-CD1 4.49Å; F39-Y65 AromaticContact CE1-CE1 3.87Å; F39-Y65 HydrophobicContact CE1-CE1 3.87Å; F39-C66 HydrophobicContact CB-CB 4.01Å; F39-C66 HydrophobicContact CD1-CB 4.26Å; F39-H69 HydrophobicContact CD1-CB 4.07Å; F39-H69 HydrophobicContact CD2-CB 3.69Å; F39-H69 HydrophobicContact CE1-CB 3.9Å; F39-H69 HydrophobicContact CE2-CB 3.51Å; F39-H69 HydrophobicContact CG-CB 3.98Å; F39-H69 HydrophobicContact CZ-CB 3.61Å; F39-H69 AromaticContact CZ-CG 3.82Å; F39-L70 HydrophobicContact CB-CD1 4.14Å; F39-L70 HydrophobicContact CB-CD2 3.83Å; F39-L70 HydrophobicContact CB-CG 3.67Å
40	T	91.8	Very high	90.9	Very high	82 Å²	82	62.4 Å²	62.4	50%	0.503	31%	0.307	S	S	.	.	H	α-helix	trans	-66.7	-46	174.7	-54.3	0	0	0	0	110.8	D38 A42 I43 T44	D38-T40 VanDerWaalsContact C-N 3.3Å; D38-T40 PolarHBondContact O-N 3.3Å; T40-A42 VanDerWaalsContact C-N 3.33Å; T40-I43 PolarHBondContact O-N 3.02Å; T40-T44 PolarHBondContact O-N 3.09Å; T40-T44 VanDerWaalsContact O-N 3.08Å; T40-T44 PolarHBondContact O-OG1 2.54Å
41	G	92	Very high	90.9	Very high	19 Å²	19	69.3 Å²	69.3	20%	0.196	34%	0.339	C	S	.	.	H	α-helix	trans	-61	-42.6	173.1	0	0	0	0	0	111.9	D38 T44 L45	D38-G41 PolarHBondContact O-N 3.36Å; D38-G41 PolarHBondContact OD1-N 3.4Å; G41-T44 PolarHBondContact O-N 3.46Å; G41-L45 PolarHBondContact O-N 3.05Å
42	A	93.7	Very high	90.9	Very high	0 Å²	0	67 Å²	67	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.4	-47.1	177.8	0	0	0	0	0	112.2	L30 L33 L34 D38 F39 T40 T44 L45 L46 C66	L30-A42 HydrophobicContact CD1-CB 3.92Å; L33-A42 HydrophobicContact CB-CB 4.07Å; L34-A42 HydrophobicContact CD2-CB 4.24Å; D38-A42 WeakPolarHBondContact O-CB 3.35Å; D38-A42 PolarHBondContact O-N 3.08Å; F39-A42 PolarHBondContact O-N 3.48Å; T40-A42 VanDerWaalsContact C-N 3.33Å; A42-T44 VanDerWaalsContact C-N 3.33Å; A42-T44 PolarHBondContact O-N 3.02Å; A42-L45 PolarHBondContact O-N 3.23Å; A42-L46 WeakPolarHBondContact O-CB 3.47Å; A42-L46 WeakPolarHBondContact O-CD1 3.32Å; A42-L46 WeakPolarHBondContact O-CG 3.4Å; A42-L46 PolarHBondContact O-N 3.42Å; A42-C66 VanDerWaalsContact CB-SG 3.59Å
43	I	92.8	Very high	90.5	Very high	12 Å²	12	65.8 Å²	65.8	6%	0.062	34%	0.344	C	S	.	.	H	α-helix	trans	-57.5	-46.5	174.7	-76.2	165.5	0	0	0	111.1	F39 T40 L45 L46 E47 C66 A67 L70	F39-I43 WeakPolarHBondContact O-CG1 3.48Å; F39-I43 PolarHBondContact O-N 3.41Å; T40-I43 PolarHBondContact O-N 3.02Å; I43-L45 VanDerWaalsContact C-N 3.29Å; I43-L45 PolarHBondContact O-N 3.37Å; I43-L46 PolarHBondContact O-N 3.08Å; I43-E47 HydrophobicContact CG2-CG 4.13Å; I43-E47 WeakPolarHBondContact CG2-OE1 3.21Å; I43-E47 WeakPolarHBondContact O-CB 3.48Å; I43-E47 WeakPolarHBondContact O-CG 3.1Å; I43-E47 PolarHBondContact O-N 3.2Å; I43-C66 HydrophobicContact CD1-CB 3.74Å; I43-C66 HydrophobicContact CG1-CB 3.45Å; I43-C66 VanDerWaalsContact CG1-CB 3.45Å; I43-A67 HydrophobicContact CD1-CB 4.5Å; I43-L70 HydrophobicContact CD1-CD1 3.54Å
44	T	93.2	Very high	90.1	Very high	85 Å²	85	71 Å²	71	52%	0.521	37%	0.368	S	S	.	.	H	α-helix	trans	-61.2	-41	-178.8	-53.3	0	0	0	0	111.3	T40 G41 A42 F48	T40-T44 PolarHBondContact O-N 3.09Å; T40-T44 VanDerWaalsContact O-N 3.08Å; T40-T44 PolarHBondContact O-OG1 2.54Å; G41-T44 PolarHBondContact O-N 3.46Å; A42-T44 VanDerWaalsContact C-N 3.33Å; A42-T44 PolarHBondContact O-N 3.02Å; T44-F48 WeakPolarHBondContact O-CB 3.4Å; T44-F48 PolarHBondContact O-N 3.39Å; T44-F48 VanDerWaalsContact O-N 3.08Å
45	L	92.6	Very high	89.6	Confident	24 Å²	24	74.8 Å²	74.8	13%	0.126	39%	0.385	C	S	.	.	H	α-helix	trans	-65.4	-45.5	176.1	178.6	65.1	0	0	0	111.8	I27 P28 L30 L33 G41 A42 I43 F48 K49	I27-L45 HydrophobicContact CG2-CD1 3.58Å; P28-L45 WeakPolarHBondContact O-CD2 3.45Å; L30-L45 HydrophobicContact CB-CD2 4.32Å; L33-L45 HydrophobicContact CD1-CB 4.17Å; L33-L45 HydrophobicContact CD1-CD2 3.76Å; G41-L45 PolarHBondContact O-N 3.05Å; A42-L45 PolarHBondContact O-N 3.23Å; I43-L45 VanDerWaalsContact C-N 3.29Å; I43-L45 PolarHBondContact O-N 3.37Å; L45-F48 PolarHBondContact O-N 3.26Å; L45-K49 PolarHBondContact O-N 3.12Å
46	L	93.7	Very high	89.3	Confident	3 Å²	3	75.4 Å²	75.4	2%	0.016	38%	0.377	C	S	.	.	H	α-helix	trans	-66.3	-43.5	-179.5	-69.5	163.8	0	0	0	111.8	L30 A42 I43 F48 K49 R50 T59 W62 I63	L30-L46 HydrophobicContact CD1-CD1 3.96Å; L30-L46 HydrophobicContact CD1-CD2 4.09Å; L30-L46 HydrophobicContact CD1-CG 3.97Å; L30-L46 HydrophobicContact CD2-CD2 3.89Å; A42-L46 WeakPolarHBondContact O-CB 3.47Å; A42-L46 WeakPolarHBondContact O-CD1 3.32Å; A42-L46 WeakPolarHBondContact O-CG 3.4Å; A42-L46 PolarHBondContact O-N 3.42Å; I43-L46 PolarHBondContact O-N 3.08Å; L46-F48 VanDerWaalsContact C-N 3.33Å; L46-F48 PolarHBondContact O-N 3.01Å; L46-K49 PolarHBondContact O-N 3.06Å; L46-R50 WeakPolarHBondContact O-CB 3.36Å; L46-R50 PolarHBondContact O-N 3.24Å; L46-T59 HydrophobicContact CB-CG2 4.26Å; L46-T59 HydrophobicContact CD2-CG2 4.04Å; L46-W62 HydrophobicContact CD1-CB 3.6Å; L46-W62 HydrophobicContact CD2-CB 4.13Å; L46-I63 HydrophobicContact CB-CD1 4.03Å; L46-I63 HydrophobicContact CB-CG1 3.59Å; L46-I63 HydrophobicContact CD1-CG1 3.89Å; L46-I63 HydrophobicContact CG-CG1 4.33Å
47	E	92.2	Very high	88.9	Confident	55 Å²	55	77.9 Å²	77.9	26%	0.257	39%	0.391	S	S	.	.	H	α-helix	trans	-61.7	-41.1	174.5	-76.2	177.2	173.8	0	0	111.6	I43 R50 H51 R75	I43-E47 HydrophobicContact CG2-CG 4.13Å; I43-E47 WeakPolarHBondContact CG2-OE1 3.21Å; I43-E47 WeakPolarHBondContact O-CB 3.48Å; I43-E47 WeakPolarHBondContact O-CG 3.1Å; I43-E47 PolarHBondContact O-N 3.2Å; E47-R50 PolarHBondContact O-N 3.15Å; E47-H51 WeakPolarHBondContact O-CB 3.32Å; E47-H51 PolarHBondContact O-CD2 3.37Å; E47-H51 PolarHBondContact O-N 3.29Å; E47-R75 IonicContact OE1-CZ 2.96Å; E47-R75 IonicContact OE1-NH1 2.67Å; E47-R75 PolarHBondContact OE1-NH1 3.35Å; E47-R75 IonicContact OE1-NH2 2.99Å; E47-R75 PolarHBondContact OE1-NH2 3.2Å
48	F	90.5	Very high	88.8	Confident	117 Å²	117	72.4 Å²	72.4	51%	0.513	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-47.5	175.9	176.5	-96.9	0	0	0	111.5	T44 L45 L46 R50 H51 V52	T44-F48 WeakPolarHBondContact O-CB 3.4Å; T44-F48 PolarHBondContact O-N 3.39Å; T44-F48 VanDerWaalsContact O-N 3.08Å; L45-F48 PolarHBondContact O-N 3.26Å; L46-F48 VanDerWaalsContact C-N 3.33Å; L46-F48 PolarHBondContact O-N 3.01Å; F48-R50 VanDerWaalsContact C-N 3.33Å; F48-R50 PolarHBondContact O-N 3.29Å; F48-H51 PolarHBondContact O-N 3.47Å; F48-V52 HydrophobicContact CD1-CG2 4.41Å; F48-V52 HydrophobicContact CD2-CG2 4.3Å; F48-V52 HydrophobicContact CE1-CG2 4Å; F48-V52 HydrophobicContact CE2-CG2 3.88Å; F48-V52 HydrophobicContact CZ-CG2 3.72Å; F48-V52 WeakPolarHBondContact O-CG2 3.25Å; F48-V52 PolarHBondContact O-N 3.36Å
49	K	89.9	Confident	88.7	Confident	43 Å²	43	69.1 Å²	69.1	19%	0.187	36%	0.359	C	S	.	.	H	α-helix	trans	-57.8	-45.6	174.7	-77.1	-173.3	172.3	-171.7	0	111.7	L45 L46 H51 V52 G53 E54 E56	L45-K49 PolarHBondContact O-N 3.12Å; L46-K49 PolarHBondContact O-N 3.06Å; K49-H51 VanDerWaalsContact C-N 3.34Å; K49-H51 PolarHBondContact O-N 3.32Å; K49-V52 PolarHBondContact O-N 2.92Å; K49-G53 PolarHBondContact O-N 3.27Å; K49-G53 VanDerWaalsContact O-N 3.09Å; K49-E54 PolarHBondContact O-N 3.19Å; K49-E56 IonicContact NZ-OE1 3.81Å; K49-E56 PolarHBondContact NZ-OE1 3.25Å
50	R	87.9	Confident	88.6	Confident	76 Å²	76	70 Å²	70	29%	0.287	37%	0.365	S	S	.	.	H	α-helix	trans	-58.6	-41.5	175.7	-171.1	167.7	72.1	178	2.6	112.5	L46 E47 F48 G53 T59 N60 E79	L46-R50 WeakPolarHBondContact O-CB 3.36Å; L46-R50 PolarHBondContact O-N 3.24Å; E47-R50 PolarHBondContact O-N 3.15Å; F48-R50 VanDerWaalsContact C-N 3.33Å; F48-R50 PolarHBondContact O-N 3.29Å; R50-G53 PolarHBondContact O-N 3.35Å; R50-T59 HydrophobicContact CB-CG2 4.43Å; R50-N60 PolarHBondContact NH1-OD1 3.28Å; R50-E79 IonicContact CZ-OE1 3.7Å; R50-E79 IonicContact NH1-OE1 3.53Å; R50-E79 PolarHBondContact NH1-OE1 3.46Å; R50-E79 IonicContact NH1-OE2 2.9Å; R50-E79 IonicContact NH2-OE1 3.58Å
51	H	88.7	Confident	88.5	Confident	155 Å²	155	67.9 Å²	67.9	72%	0.718	35%	0.35	S	S	*	.	H	α-helix	trans	-72.5	-30.8	178.2	-82.4	-60.9	0	0	0	114.4	E47 F48 K49 G53	E47-H51 WeakPolarHBondContact O-CB 3.32Å; E47-H51 PolarHBondContact O-CD2 3.37Å; E47-H51 PolarHBondContact O-N 3.29Å; F48-H51 PolarHBondContact O-N 3.47Å; K49-H51 VanDerWaalsContact C-N 3.34Å; K49-H51 PolarHBondContact O-N 3.32Å; H51-G53 VanDerWaalsContact C-N 3.32Å
52	V	89	Confident	88.6	Confident	78 Å²	78	71.3 Å²	71.3	47%	0.473	36%	0.358	S	S	.	.	H	α-helix	trans	-84.7	-9.9	178.7	-179.8	0	0	0	0	111.8	F48 K49 E54	F48-V52 HydrophobicContact CD1-CG2 4.41Å; F48-V52 HydrophobicContact CD2-CG2 4.3Å; F48-V52 HydrophobicContact CE1-CG2 4Å; F48-V52 HydrophobicContact CE2-CG2 3.88Å; F48-V52 HydrophobicContact CZ-CG2 3.72Å; F48-V52 WeakPolarHBondContact O-CG2 3.25Å; F48-V52 PolarHBondContact O-N 3.36Å; K49-V52 PolarHBondContact O-N 2.92Å; V52-E54 HydrophobicContact CG1-CG 4.23Å
53	G	83.4	Confident	88.6	Confident	62 Å²	62	71.3 Å²	71.3	64%	0.639	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	17.5	-177	0	0	0	0	0	113.5	K49 R50 H51 E55	K49-G53 PolarHBondContact O-N 3.27Å; K49-G53 VanDerWaalsContact O-N 3.09Å; R50-G53 PolarHBondContact O-N 3.35Å; H51-G53 VanDerWaalsContact C-N 3.32Å; G53-E55 VanDerWaalsContact C-N 3.29Å
54	E	84	Confident	88.6	Confident	126 Å²	126	70.8 Å²	70.8	59%	0.589	36%	0.355	S	S	*	.			trans	-97.5	35.2	172	-64.6	-177.9	177.5	0	0	110.5	K49 V52	K49-E54 PolarHBondContact O-N 3.19Å; V52-E54 HydrophobicContact CG1-CG 4.23Å
55	E	80	Confident	88.7	Confident	109 Å²	109	70.7 Å²	70.7	51%	0.509	35%	0.345	S	S	.	.			trans	-71.3	129.8	177	63.2	-175.4	177.4	0	0	111.1	G53 T59	G53-E55 VanDerWaalsContact C-N 3.29Å; E55-T59 HydrophobicContact CB-CG2 4.31Å
56	E	83.3	Confident	88.8	Confident	108 Å²	108	69.6 Å²	69.6	51%	0.505	34%	0.339	S	S	.	.			trans	-82.9	158.4	168.4	-67.3	165.2	-150.1	0	0	109.5	K49 D58 T59	K49-E56 IonicContact NZ-OE1 3.81Å; K49-E56 PolarHBondContact NZ-OE1 3.25Å; E56-D58 PolarHBondContact O-N 2.7Å; E56-D58 VanDerWaalsContact O-N 3.11Å; E56-T59 WeakPolarHBondContact CA-OG1 3.26Å; E56-T59 PolarHBondContact N-OG1 2.68Å; E56-T59 VanDerWaalsContact O-CB 3.25Å; E56-T59 WeakPolarHBondContact O-CB 3.47Å; E56-T59 PolarHBondContact O-N 3.18Å; E56-T59 PolarHBondContact O-OG1 2.85Å
57	E	78.5	Confident	88.8	Confident	190 Å²	190	69.4 Å²	69.4	89%	0.888	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-39	-175.2	-166.6	172.6	180	0	0	113.1
58	D	85.7	Confident	88.9	Confident	81 Å²	81	68.5 Å²	68.5	43%	0.433	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	10.1	-178.7	-65.9	-36.9	0	0	0	114.4	E56 N60 L61 W62	E56-D58 PolarHBondContact O-N 2.7Å; E56-D58 VanDerWaalsContact O-N 3.11Å; D58-N60 VanDerWaalsContact C-N 3.34Å; D58-N60 PolarHBondContact O-N 2.87Å; D58-L61 WeakPolarHBondContact O-CB 3.34Å; D58-L61 PolarHBondContact O-N 2.86Å; D58-L61 VanDerWaalsContact O-N 3.08Å; D58-W62 VanDerWaalsContact O-CD1 3.25Å; D58-W62 PolarHBondContact O-N 3.36Å
59	T	88.2	Confident	88.8	Confident	3 Å²	3	67 Å²	67	2%	0.018	33%	0.328	C	S	.	.	H	α-helix	trans	-55.4	-47.2	-173.4	-62.3	0	0	0	0	111.9	L46 R50 E55 E56 L61 W62 I63	L46-T59 HydrophobicContact CB-CG2 4.26Å; L46-T59 HydrophobicContact CD2-CG2 4.04Å; R50-T59 HydrophobicContact CB-CG2 4.43Å; E55-T59 HydrophobicContact CB-CG2 4.31Å; E56-T59 WeakPolarHBondContact CA-OG1 3.26Å; E56-T59 PolarHBondContact N-OG1 2.68Å; E56-T59 VanDerWaalsContact O-CB 3.25Å; E56-T59 WeakPolarHBondContact O-CB 3.47Å; E56-T59 PolarHBondContact O-N 3.18Å; E56-T59 PolarHBondContact O-OG1 2.85Å; T59-L61 VanDerWaalsContact C-N 3.33Å; T59-L61 PolarHBondContact O-N 3.13Å; T59-W62 PolarHBondContact O-N 2.76Å; T59-I63 HydrophobicContact CG2-CD1 4.16Å; T59-I63 WeakPolarHBondContact O-CG1 3.46Å; T59-I63 PolarHBondContact O-N 3.41Å
60	N	88.8	Confident	88.8	Confident	43 Å²	43	68.9 Å²	68.9	23%	0.23	34%	0.34	C	S	.	.	H	α-helix	trans	-66.6	-35.3	-179.9	-65.7	-35	0	0	0	112	R50 D58 I63 G64	R50-N60 PolarHBondContact NH1-OD1 3.28Å; D58-N60 VanDerWaalsContact C-N 3.34Å; D58-N60 PolarHBondContact O-N 2.87Å; N60-I63 PolarHBondContact O-N 3.5Å; N60-G64 PolarHBondContact O-N 3.49Å
61	L	90.8	Very high	88.7	Confident	37 Å²	37	66.8 Å²	66.8	19%	0.194	34%	0.342	C	S	.	.	H	α-helix	trans	-65.9	-40.9	176.7	-60.3	-176	0	0	0	111.7	D58 T59 G64 Y65 Y80 A83 V93	D58-L61 WeakPolarHBondContact O-CB 3.34Å; D58-L61 PolarHBondContact O-N 2.86Å; D58-L61 VanDerWaalsContact O-N 3.08Å; T59-L61 VanDerWaalsContact C-N 3.33Å; T59-L61 PolarHBondContact O-N 3.13Å; L61-G64 PolarHBondContact O-N 3.08Å; L61-Y65 WeakPolarHBondContact O-CB 3.46Å; L61-Y65 PolarHBondContact O-N 3.39Å; L61-Y80 HydrophobicContact CD2-CD1 4.31Å; L61-Y80 HydrophobicContact CD2-CE1 4.42Å; L61-A83 HydrophobicContact CD2-CB 3.82Å; L61-V93 HydrophobicContact CD1-CG2 4.14Å; L61-V93 HydrophobicContact CD2-CG1 4.37Å; L61-V93 HydrophobicContact CD2-CG2 3.6Å
62	W	93.2	Very high	88.8	Confident	91 Å²	91	62.6 Å²	62.6	35%	0.345	33%	0.325	S	S	.	.	H	α-helix	trans	-68.6	-34.3	175.1	-74.9	115.1	0	0	0	112.8	L30 L34 L46 D58 T59 Y65 C66	L30-W62 HydrophobicContact CD2-CB 4.48Å; L30-W62 HydrophobicContact CD2-CD2 4.43Å; L30-W62 HydrophobicContact CD2-CG 4.07Å; L34-W62 HydrophobicContact CD1-CD2 4.19Å; L34-W62 HydrophobicContact CD1-CE3 3.62Å; L34-W62 HydrophobicContact CD1-CH2 3.92Å; L34-W62 HydrophobicContact CD1-CZ2 4.43Å; L34-W62 HydrophobicContact CD1-CZ3 3.48Å; L34-W62 VanDerWaalsContact CD1-CZ3 3.48Å; L34-W62 HydrophobicContact CD2-CE3 4.27Å; L34-W62 HydrophobicContact CD2-CZ3 4.4Å; L46-W62 HydrophobicContact CD1-CB 3.6Å; L46-W62 HydrophobicContact CD2-CB 4.13Å; D58-W62 VanDerWaalsContact O-CD1 3.25Å; D58-W62 PolarHBondContact O-N 3.36Å; T59-W62 PolarHBondContact O-N 2.76Å; W62-Y65 AromaticContact CE3-CD1 3.83Å; W62-Y65 HydrophobicContact CE3-CD1 3.83Å; W62-Y65 HydrophobicContact CE3-CE1 4.45Å; W62-Y65 HydrophobicContact CE3-CG 4.1Å; W62-Y65 AromaticContact CZ3-CD1 3.83Å; W62-Y65 HydrophobicContact CZ3-CD1 3.83Å; W62-Y65 HydrophobicContact CZ3-CE1 4.02Å; W62-Y65 HydrophobicContact CZ3-CG 4.15Å; W62-Y65 PolarHBondContact O-N 2.69Å; W62-C66 WeakPolarHBondContact O-CB 3.42Å; W62-C66 PolarHBondContact O-N 2.93Å; W62-C66 PolarHBondContact O-SG 3Å
63	I	93.7	Very high	89.1	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.1	-48.3	171.8	-67.8	170.9	0	0	0	109.8	L46 T59 N60 Y65 C66 A67 E79	L46-I63 HydrophobicContact CB-CD1 4.03Å; L46-I63 HydrophobicContact CB-CG1 3.59Å; L46-I63 HydrophobicContact CD1-CG1 3.89Å; L46-I63 HydrophobicContact CG-CG1 4.33Å; T59-I63 HydrophobicContact CG2-CD1 4.16Å; T59-I63 WeakPolarHBondContact O-CG1 3.46Å; T59-I63 PolarHBondContact O-N 3.41Å; N60-I63 PolarHBondContact O-N 3.5Å; I63-Y65 VanDerWaalsContact C-N 3.33Å; I63-Y65 PolarHBondContact O-N 3.24Å; I63-C66 PolarHBondContact O-N 2.94Å; I63-A67 VanDerWaalsContact O-CB 3.32Å; I63-A67 WeakPolarHBondContact O-CB 3.5Å; I63-A67 PolarHBondContact O-N 3.37Å; I63-E79 HydrophobicContact CG2-CG 3.97Å; I63-E79 WeakPolarHBondContact CG2-OE1 3.33Å
64	G	93.8	Very high	89.5	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-58	-43.9	175.6	0	0	0	0	0	112.4	N60 L61 A67 F68 Y80	N60-G64 PolarHBondContact O-N 3.49Å; L61-G64 PolarHBondContact O-N 3.08Å; G64-A67 PolarHBondContact O-N 2.89Å; G64-F68 WeakPolarHBondContact O-CB 3.37Å; G64-F68 PolarHBondContact O-N 3.38Å; G64-Y80 VanDerWaalsContact C-OH 3.29Å
65	Y	94.3	Very high	90	Very high	84 Å²	84	60.3 Å²	60.3	33%	0.329	29%	0.287	S	S	.	.	H	α-helix	trans	-60.6	-49.7	177.3	177.3	-93.4	0	0	0	111.8	L34 F39 L61 W62 I63 A67 F68 H69 Y80	L34-Y65 HydrophobicContact CD2-CD1 4.26Å; L34-Y65 HydrophobicContact CD2-CE1 4.17Å; F39-Y65 HydrophobicContact CE1-CD1 4.49Å; F39-Y65 AromaticContact CE1-CE1 3.87Å; F39-Y65 HydrophobicContact CE1-CE1 3.87Å; L61-Y65 WeakPolarHBondContact O-CB 3.46Å; L61-Y65 PolarHBondContact O-N 3.39Å; W62-Y65 AromaticContact CE3-CD1 3.83Å; W62-Y65 HydrophobicContact CE3-CD1 3.83Å; W62-Y65 HydrophobicContact CE3-CE1 4.45Å; W62-Y65 HydrophobicContact CE3-CG 4.1Å; W62-Y65 AromaticContact CZ3-CD1 3.83Å; W62-Y65 HydrophobicContact CZ3-CD1 3.83Å; W62-Y65 HydrophobicContact CZ3-CE1 4.02Å; W62-Y65 HydrophobicContact CZ3-CG 4.15Å; W62-Y65 PolarHBondContact O-N 2.69Å; I63-Y65 VanDerWaalsContact C-N 3.33Å; I63-Y65 PolarHBondContact O-N 3.24Å; Y65-A67 PolarHBondContact O-N 3.17Å; Y65-F68 PolarHBondContact O-N 3.35Å; Y65-H69 AromaticContact CD1-CD2 3.82Å; Y65-H69 AromaticContact CD2-CD2 3.81Å; Y65-H69 AromaticContact CD2-NE2 3.83Å; Y65-H69 AromaticContact CE1-CD2 3.5Å; Y65-H69 VanDerWaalsContact CE1-CD2 3.5Å; Y65-H69 WeakPolarHBondContact CE1-CD2 3.29Å; Y65-H69 AromaticContact CE1-NE2 3.89Å; Y65-H69 AromaticContact CE2-CD2 3.48Å; Y65-H69 VanDerWaalsContact CE2-CD2 3.48Å; Y65-H69 WeakPolarHBondContact CE2-CD2 3.47Å; Y65-H69 AromaticContact CE2-NE2 3.14Å; Y65-H69 WeakPolarHBondContact CE2-NE2 3.37Å; Y65-H69 AromaticContact CG-CD2 3.96Å; Y65-H69 AromaticContact CZ-CD2 3.3Å; Y65-H69 AromaticContact CZ-NE2 3.16Å; Y65-H69 PolarHBondContact O-CD2 3.29Å; Y65-H69 PolarHBondContact O-N 3.36Å; Y65-H69 PolarHBondContact OH-NE2 3.03Å; Y65-Y80 VanDerWaalsContact CA-OH 3.24Å; Y65-Y80 WeakPolarHBondContact CA-OH 2.9Å; Y65-Y80 PolarHBondContact N-OH 2.92Å
66	C	94.6	Very high	90.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.3	-41.4	178.4	-65.9	0	0	0	0	111.5	F39 A42 I43 W62 I63 F68 H69 L70	F39-C66 HydrophobicContact CB-CB 4.01Å; F39-C66 HydrophobicContact CD1-CB 4.26Å; A42-C66 VanDerWaalsContact CB-SG 3.59Å; I43-C66 HydrophobicContact CD1-CB 3.74Å; I43-C66 HydrophobicContact CG1-CB 3.45Å; I43-C66 VanDerWaalsContact CG1-CB 3.45Å; W62-C66 WeakPolarHBondContact O-CB 3.42Å; W62-C66 PolarHBondContact O-N 2.93Å; W62-C66 PolarHBondContact O-SG 3Å; I63-C66 PolarHBondContact O-N 2.94Å; C66-F68 PolarHBondContact O-N 2.94Å; C66-H69 PolarHBondContact O-N 3.38Å; C66-L70 WeakPolarHBondContact O-CG 3.4Å; C66-L70 PolarHBondContact O-N 2.94Å
67	A	93.7	Very high	91.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.9	-43.1	176.8	0	0	0	0	0	111.6	I43 I63 G64 Y65 H69 L70 G71 D72 R75 A76	I43-A67 HydrophobicContact CD1-CB 4.5Å; I63-A67 VanDerWaalsContact O-CB 3.32Å; I63-A67 WeakPolarHBondContact O-CB 3.5Å; I63-A67 PolarHBondContact O-N 3.37Å; G64-A67 PolarHBondContact O-N 2.89Å; Y65-A67 PolarHBondContact O-N 3.17Å; A67-H69 PolarHBondContact O-N 3.14Å; A67-L70 PolarHBondContact O-N 3.29Å; A67-G71 PolarHBondContact O-N 3.37Å; A67-D72 PolarHBondContact O-N 2.8Å; A67-R75 HydrophobicContact CB-CB 4.12Å; A67-R75 HydrophobicContact CB-CG 3.98Å; A67-A76 HydrophobicContact CB-CB 4.16Å
68	F	93.8	Very high	92.1	Very high	35 Å²	35	48 Å²	48	15%	0.154	23%	0.23	C	C	.	.	H	α-helix	trans	-59.3	-46.5	175.4	-179.6	-87	0	0	0	111.7	G64 Y65 C66 L70 G71 Y73 A76 C99 F103	G64-F68 WeakPolarHBondContact O-CB 3.37Å; G64-F68 PolarHBondContact O-N 3.38Å; Y65-F68 PolarHBondContact O-N 3.35Å; C66-F68 PolarHBondContact O-N 2.94Å; F68-L70 VanDerWaalsContact C-N 3.3Å; F68-L70 PolarHBondContact O-N 3.23Å; F68-G71 WeakPolarHBondContact O-CA 3.36Å; F68-G71 PolarHBondContact O-N 2.87Å; F68-Y73 AromaticContact CD2-CD1 3.68Å; F68-Y73 HydrophobicContact CD2-CD1 3.68Å; F68-Y73 AromaticContact CD2-CE1 3.84Å; F68-Y73 HydrophobicContact CD2-CE1 3.84Å; F68-Y73 AromaticContact CE2-CD1 3.88Å; F68-Y73 HydrophobicContact CE2-CD1 3.88Å; F68-Y73 AromaticContact CE2-CE1 3.78Å; F68-Y73 HydrophobicContact CE2-CE1 3.78Å; F68-Y73 HydrophobicContact CG-CD1 4.35Å; F68-Y73 HydrophobicContact CG-CE1 4.28Å; F68-Y73 HydrophobicContact CZ-CE1 4.17Å; F68-A76 HydrophobicContact CB-CB 3.93Å; F68-C99 HydrophobicContact CE2-CB 4.13Å; F68-C99 HydrophobicContact CZ-CB 4.26Å; F68-F103 AromaticContact CE2-CD2 3.68Å; F68-F103 HydrophobicContact CE2-CD2 3.68Å; F68-F103 HydrophobicContact CE2-CE2 4.24Å; F68-F103 HydrophobicContact CE2-CG 4.46Å; F68-F103 AromaticContact CZ-CD2 3.49Å; F68-F103 HydrophobicContact CZ-CD2 3.49Å; F68-F103 VanDerWaalsContact CZ-CD2 3.49Å; F68-F103 AromaticContact CZ-CE2 3.56Å; F68-F103 HydrophobicContact CZ-CE2 3.56Å; F68-F103 HydrophobicContact CZ-CG 4.46Å
69	H	90.1	Very high	92.6	Very high	86 Å²	86	45.2 Å²	45.2	40%	0.398	21%	0.214	S	C	.	.	H	α-helix	trans	-72	-21.1	179.7	-79.9	-69.4	0	0	0	114.2	F39 Y65 C66 A67 G71	F39-H69 HydrophobicContact CD1-CB 4.07Å; F39-H69 HydrophobicContact CD2-CB 3.69Å; F39-H69 HydrophobicContact CE1-CB 3.9Å; F39-H69 HydrophobicContact CE2-CB 3.51Å; F39-H69 HydrophobicContact CG-CB 3.98Å; F39-H69 HydrophobicContact CZ-CB 3.61Å; F39-H69 AromaticContact CZ-CG 3.82Å; Y65-H69 AromaticContact CD1-CD2 3.82Å; Y65-H69 AromaticContact CD2-CD2 3.81Å; Y65-H69 AromaticContact CD2-NE2 3.83Å; Y65-H69 AromaticContact CE1-CD2 3.5Å; Y65-H69 VanDerWaalsContact CE1-CD2 3.5Å; Y65-H69 WeakPolarHBondContact CE1-CD2 3.29Å; Y65-H69 AromaticContact CE1-NE2 3.89Å; Y65-H69 AromaticContact CE2-CD2 3.48Å; Y65-H69 VanDerWaalsContact CE2-CD2 3.48Å; Y65-H69 WeakPolarHBondContact CE2-CD2 3.47Å; Y65-H69 AromaticContact CE2-NE2 3.14Å; Y65-H69 WeakPolarHBondContact CE2-NE2 3.37Å; Y65-H69 AromaticContact CG-CD2 3.96Å; Y65-H69 AromaticContact CZ-CD2 3.3Å; Y65-H69 AromaticContact CZ-NE2 3.16Å; Y65-H69 PolarHBondContact O-CD2 3.29Å; Y65-H69 PolarHBondContact O-N 3.36Å; Y65-H69 PolarHBondContact OH-NE2 3.03Å; C66-H69 PolarHBondContact O-N 3.38Å; A67-H69 PolarHBondContact O-N 3.14Å; H69-G71 VanDerWaalsContact C-N 3.25Å
70	L	88.4	Confident	92.9	Very high	82 Å²	82	45.2 Å²	45.2	43%	0.429	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-7.1	166.8	-71.1	176.5	0	0	0	113.3	F39 I43 C66 A67 F68 D72	F39-L70 HydrophobicContact CB-CD1 4.14Å; F39-L70 HydrophobicContact CB-CD2 3.83Å; F39-L70 HydrophobicContact CB-CG 3.67Å; I43-L70 HydrophobicContact CD1-CD1 3.54Å; C66-L70 WeakPolarHBondContact O-CG 3.4Å; C66-L70 PolarHBondContact O-N 2.94Å; A67-L70 PolarHBondContact O-N 3.29Å; F68-L70 VanDerWaalsContact C-N 3.3Å; F68-L70 PolarHBondContact O-N 3.23Å; L70-D72 VanDerWaalsContact C-N 3.3Å
71	G	87.6	Confident	93.1	Very high	33 Å²	33	46.1 Å²	46.1	34%	0.34	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	7.4	-175.4	0	0	0	0	0	114.2	A67 F68 H69 Y73	A67-G71 PolarHBondContact O-N 3.37Å; F68-G71 WeakPolarHBondContact O-CA 3.36Å; F68-G71 PolarHBondContact O-N 2.87Å; H69-G71 VanDerWaalsContact C-N 3.25Å; G71-Y73 WeakPolarHBondContact O-CD2 3.35Å; G71-Y73 PolarHBondContact O-N 2.93Å
72	D	90.7	Very high	93.2	Very high	67 Å²	67	48.1 Å²	48.1	36%	0.358	23%	0.228	S	C	.	.			trans	-83.1	69.8	171.9	-168.9	-6.6	0	0	0	110.2	A67 L70 K74 R75 A76	A67-D72 PolarHBondContact O-N 2.8Å; L70-D72 VanDerWaalsContact C-N 3.3Å; D72-K74 PolarHBondContact O-N 3.11Å; D72-R75 HydrophobicContact CB-CB 4.25Å; D72-R75 PolarHBondContact O-N 3.44Å; D72-R75 WeakPolarHBondContact OD1-CB 3.24Å; D72-R75 PolarHBondContact OD1-N 2.77Å; D72-R75 VanDerWaalsContact OD1-N 3.11Å; D72-R75 VanDerWaalsContact OD2-CB 3.29Å; D72-R75 WeakPolarHBondContact OD2-CB 3.11Å; D72-A76 PolarHBondContact O-N 2.85Å
73	Y	93.5	Very high	93.1	Very high	46 Å²	46	44 Å²	44	18%	0.18	21%	0.214	C	C	.	.	H	α-helix	trans	-64.8	-21.7	-177.8	-54.4	-59	0	0	0	113	F68 G71 L77 T100 F103	F68-Y73 AromaticContact CD2-CD1 3.68Å; F68-Y73 HydrophobicContact CD2-CD1 3.68Å; F68-Y73 AromaticContact CD2-CE1 3.84Å; F68-Y73 HydrophobicContact CD2-CE1 3.84Å; F68-Y73 AromaticContact CE2-CD1 3.88Å; F68-Y73 HydrophobicContact CE2-CD1 3.88Å; F68-Y73 AromaticContact CE2-CE1 3.78Å; F68-Y73 HydrophobicContact CE2-CE1 3.78Å; F68-Y73 HydrophobicContact CG-CD1 4.35Å; F68-Y73 HydrophobicContact CG-CE1 4.28Å; F68-Y73 HydrophobicContact CZ-CE1 4.17Å; G71-Y73 WeakPolarHBondContact O-CD2 3.35Å; G71-Y73 PolarHBondContact O-N 2.93Å; Y73-L77 VanDerWaalsContact O-CB 3.23Å; Y73-L77 WeakPolarHBondContact O-CB 3.03Å; Y73-L77 PolarHBondContact O-N 3.22Å; Y73-T100 WeakPolarHBondContact O-CG2 3.28Å; Y73-F103 HydrophobicContact CD1-CB 3.8Å; Y73-F103 HydrophobicContact CD1-CG 4.41Å; Y73-F103 HydrophobicContact CD2-CB 3.91Å; Y73-F103 HydrophobicContact CE1-CB 3.67Å; Y73-F103 HydrophobicContact CE1-CD1 4.28Å; Y73-F103 HydrophobicContact CE1-CD2 4.28Å; Y73-F103 AromaticContact CE1-CG 3.82Å; Y73-F103 HydrophobicContact CE1-CG 3.82Å; Y73-F103 HydrophobicContact CE2-CB 3.78Å; Y73-F103 HydrophobicContact CE2-CD1 4.26Å; Y73-F103 HydrophobicContact CE2-CG 4.29Å; Y73-F103 HydrophobicContact CG-CB 3.92Å; Y73-F103 AromaticContact CZ-CD1 3.76Å; Y73-F103 AromaticContact CZ-CG 3.75Å; Y73-F103 WeakPolarHBondContact OH-CD1 3.2Å
74	K	93.3	Very high	93	Very high	115 Å²	115	45.5 Å²	45.5	50%	0.5	22%	0.222	S	C	.	.	H	α-helix	trans	-71.2	-47.7	175.8	-75.6	-172.6	169.5	-172.9	0	111	P8 D72 A76 L77 E78 L104	P8-K74 HydrophobicContact CB-CD 4.23Å; P8-K74 HydrophobicContact CG-CD 3.94Å; P8-K74 VanDerWaalsContact CG-CE 3.49Å; P8-K74 VanDerWaalsContact CG-NZ 3.27Å; D72-K74 PolarHBondContact O-N 3.11Å; K74-A76 VanDerWaalsContact C-N 3.35Å; K74-L77 WeakPolarHBondContact O-CB 3.39Å; K74-L77 PolarHBondContact O-N 2.92Å; K74-E78 PolarHBondContact O-N 3.44Å; K74-E78 VanDerWaalsContact O-N 3.1Å; K74-L104 HydrophobicContact CG-CD2 4.31Å
75	R	93.8	Very high	92.8	Very high	56 Å²	56	52.7 Å²	52.7	21%	0.211	25%	0.254	C	S	.	.	H	α-helix	trans	-63.9	-43.1	175.3	-178.1	179.2	170.8	159.2	6.3	111.4	E47 A67 D72 L77 E78 E79	E47-R75 IonicContact OE1-CZ 2.96Å; E47-R75 IonicContact OE1-NH1 2.67Å; E47-R75 PolarHBondContact OE1-NH1 3.35Å; E47-R75 IonicContact OE1-NH2 2.99Å; E47-R75 PolarHBondContact OE1-NH2 3.2Å; A67-R75 HydrophobicContact CB-CB 4.12Å; A67-R75 HydrophobicContact CB-CG 3.98Å; D72-R75 HydrophobicContact CB-CB 4.25Å; D72-R75 PolarHBondContact O-N 3.44Å; D72-R75 WeakPolarHBondContact OD1-CB 3.24Å; D72-R75 PolarHBondContact OD1-N 2.77Å; D72-R75 VanDerWaalsContact OD1-N 3.11Å; D72-R75 VanDerWaalsContact OD2-CB 3.29Å; D72-R75 WeakPolarHBondContact OD2-CB 3.11Å; R75-L77 PolarHBondContact O-N 2.84Å; R75-E78 PolarHBondContact O-N 3.35Å; R75-E79 WeakPolarHBondContact O-CG 3.32Å; R75-E79 PolarHBondContact O-N 3.25Å; R75-E79 VanDerWaalsContact O-N 3.16Å
76	A	95.3	Very high	92.4	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.1	-39	174.3	0	0	0	0	0	111.8	A67 F68 D72 K74 Y80 T100	A67-A76 HydrophobicContact CB-CB 4.16Å; F68-A76 HydrophobicContact CB-CB 3.93Å; D72-A76 PolarHBondContact O-N 2.85Å; K74-A76 VanDerWaalsContact C-N 3.35Å; A76-Y80 HydrophobicContact CB-CD2 4.37Å; A76-Y80 HydrophobicContact CB-CE2 4.16Å; A76-Y80 WeakPolarHBondContact O-CB 3.21Å; A76-Y80 WeakPolarHBondContact O-CD2 3.39Å; A76-Y80 PolarHBondContact O-N 3.39Å; A76-T100 HydrophobicContact CB-CG2 4.01Å
77	L	96.2	Very high	91.6	Very high	24 Å²	24	63.6 Å²	63.6	13%	0.126	31%	0.308	C	S	.	.	H	α-helix	trans	-61.8	-49.1	178.1	178.8	69.7	0	0	0	111.2	Y73 K74 R75 E79 Y80 E81 L97 T100 Y101 L104	Y73-L77 VanDerWaalsContact O-CB 3.23Å; Y73-L77 WeakPolarHBondContact O-CB 3.03Å; Y73-L77 PolarHBondContact O-N 3.22Å; K74-L77 WeakPolarHBondContact O-CB 3.39Å; K74-L77 PolarHBondContact O-N 2.92Å; R75-L77 PolarHBondContact O-N 2.84Å; L77-E79 PolarHBondContact O-N 3.48Å; L77-Y80 PolarHBondContact O-N 3.03Å; L77-E81 HydrophobicContact CD1-CG 3.94Å; L77-E81 HydrophobicContact CG-CG 4.2Å; L77-E81 WeakPolarHBondContact O-CB 3.38Å; L77-E81 WeakPolarHBondContact O-CG 3.37Å; L77-E81 PolarHBondContact O-N 3.46Å; L77-L97 HydrophobicContact CD1-CD1 3.49Å; L77-L97 VanDerWaalsContact CD1-CD1 3.49Å; L77-T100 HydrophobicContact CB-CG2 3.83Å; L77-T100 HydrophobicContact CD1-CG2 4.42Å; L77-Y101 HydrophobicContact CD1-CD1 3.75Å; L77-Y101 HydrophobicContact CD1-CE1 3.3Å; L77-Y101 HydrophobicContact CD1-CE2 4.48Å; L77-Y101 HydrophobicContact CD1-CG 4.47Å; L77-Y101 HydrophobicContact CD2-CE1 4.29Å; L77-Y101 HydrophobicContact CG-CE1 4.42Å; L77-L104 HydrophobicContact CB-CD1 4.09Å; L77-L104 HydrophobicContact CD1-CD1 4.45Å; L77-L104 HydrophobicContact CD2-CD1 3.79Å; L77-L104 HydrophobicContact CG-CD1 4.34Å
78	E	95.4	Very high	90.8	Very high	124 Å²	124	70.9 Å²	70.9	58%	0.579	35%	0.347	S	S	*	.	H	α-helix	trans	-59.8	-45.4	-179.5	-70.2	174	-170.6	0	0	111.9	K74 R75 N82	K74-E78 PolarHBondContact O-N 3.44Å; K74-E78 VanDerWaalsContact O-N 3.1Å; R75-E78 PolarHBondContact O-N 3.35Å; E78-N82 WeakPolarHBondContact O-CB 3.46Å; E78-N82 VanDerWaalsContact O-CG 3.23Å; E78-N82 PolarHBondContact O-N 2.94Å; E78-N82 VanDerWaalsContact O-N 3.07Å; E78-N82 PolarHBondContact O-ND2 2.83Å; E78-N82 VanDerWaalsContact O-ND2 3.13Å
79	E	94.4	Very high	90.1	Very high	23 Å²	23	70.8 Å²	70.8	11%	0.107	35%	0.35	C	S	.	.	H	α-helix	trans	-64.5	-44.6	179.2	-63.3	-71.5	-176.7	0	0	111.2	R50 I63 R75 L77 N82 A83	R50-E79 IonicContact CZ-OE1 3.7Å; R50-E79 IonicContact NH1-OE1 3.53Å; R50-E79 PolarHBondContact NH1-OE1 3.46Å; R50-E79 IonicContact NH1-OE2 2.9Å; R50-E79 IonicContact NH2-OE1 3.58Å; I63-E79 HydrophobicContact CG2-CG 3.97Å; I63-E79 WeakPolarHBondContact CG2-OE1 3.33Å; R75-E79 WeakPolarHBondContact O-CG 3.32Å; R75-E79 PolarHBondContact O-N 3.25Å; R75-E79 VanDerWaalsContact O-N 3.16Å; L77-E79 PolarHBondContact O-N 3.48Å; E79-N82 PolarHBondContact O-N 3.15Å; E79-A83 PolarHBondContact O-N 3.46Å; E79-A83 VanDerWaalsContact O-N 3.09Å
80	Y	95.3	Very high	89.8	Confident	3 Å²	3	70.3 Å²	70.3	1%	0.012	35%	0.351	C	S	.	.	H	α-helix	trans	-71.7	-38.6	178.5	-66	-44.2	0	0	0	113.4	L61 G64 Y65 A76 L77 N82 A83 T84 V93 N96 T100	L61-Y80 HydrophobicContact CD2-CD1 4.31Å; L61-Y80 HydrophobicContact CD2-CE1 4.42Å; G64-Y80 VanDerWaalsContact C-OH 3.29Å; Y65-Y80 VanDerWaalsContact CA-OH 3.24Å; Y65-Y80 WeakPolarHBondContact CA-OH 2.9Å; Y65-Y80 PolarHBondContact N-OH 2.92Å; A76-Y80 HydrophobicContact CB-CD2 4.37Å; A76-Y80 HydrophobicContact CB-CE2 4.16Å; A76-Y80 WeakPolarHBondContact O-CB 3.21Å; A76-Y80 WeakPolarHBondContact O-CD2 3.39Å; A76-Y80 PolarHBondContact O-N 3.39Å; L77-Y80 PolarHBondContact O-N 3.03Å; Y80-N82 VanDerWaalsContact C-N 3.29Å; Y80-N82 PolarHBondContact O-N 3.1Å; Y80-A83 PolarHBondContact O-N 2.83Å; Y80-T84 WeakPolarHBondContact O-CG2 3.45Å; Y80-T84 PolarHBondContact O-N 2.84Å; Y80-V93 HydrophobicContact CD1-CG1 4.38Å; Y80-N96 HydrophobicContact CD1-CB 4.19Å; Y80-N96 HydrophobicContact CD2-CB 4.23Å; Y80-N96 HydrophobicContact CE1-CB 3.8Å; Y80-N96 HydrophobicContact CE2-CB 3.83Å; Y80-N96 HydrophobicContact CG-CB 4.41Å; Y80-T100 WeakPolarHBondContact CD2-OG1 3.24Å
81	E	94	Very high	89.6	Confident	62 Å²	62	68.4 Å²	68.4	29%	0.29	34%	0.344	S	S	.	.	H	α-helix	trans	-62.8	-37	175.2	-78	-173.6	169.4	0	0	111.6	L77 T84 L97 Y101	L77-E81 HydrophobicContact CD1-CG 3.94Å; L77-E81 HydrophobicContact CG-CG 4.2Å; L77-E81 WeakPolarHBondContact O-CB 3.38Å; L77-E81 WeakPolarHBondContact O-CG 3.37Å; L77-E81 PolarHBondContact O-N 3.46Å; E81-T84 PolarHBondContact O-N 3.36Å; E81-T84 PolarHBondContact O-OG1 3.49Å; E81-L97 HydrophobicContact CG-CD1 3.8Å; E81-L97 HydrophobicContact CG-CD2 4.49Å; E81-Y101 PolarHBondContact OE1-OH 3.27Å
82	N	92.2	Very high	89.6	Confident	79 Å²	79	72.4 Å²	72.4	42%	0.422	35%	0.354	S	S	.	.	H	α-helix	trans	-68.2	-43.3	175.3	-71.4	-25.9	0	0	0	112	E78 E79 Y80 T84 K85	E78-N82 WeakPolarHBondContact O-CB 3.46Å; E78-N82 VanDerWaalsContact O-CG 3.23Å; E78-N82 PolarHBondContact O-N 2.94Å; E78-N82 VanDerWaalsContact O-N 3.07Å; E78-N82 PolarHBondContact O-ND2 2.83Å; E78-N82 VanDerWaalsContact O-ND2 3.13Å; E79-N82 PolarHBondContact O-N 3.15Å; Y80-N82 VanDerWaalsContact C-N 3.29Å; Y80-N82 PolarHBondContact O-N 3.1Å; N82-T84 PolarHBondContact O-N 3.42Å; N82-K85 WeakPolarHBondContact O-CB 3.33Å; N82-K85 PolarHBondContact O-N 2.86Å; N82-K85 PolarHBondContact OD1-NZ 3.28Å
83	A	91	Very high	89.7	Confident	6 Å²	6	69.3 Å²	69.3	5%	0.05	34%	0.337	C	S	.	.	H	α-helix	trans	-59.6	-31.4	174.9	0	0	0	0	0	112.7	L61 E79 Y80 K85 E86 V93	L61-A83 HydrophobicContact CD2-CB 3.82Å; E79-A83 PolarHBondContact O-N 3.46Å; E79-A83 VanDerWaalsContact O-N 3.09Å; Y80-A83 PolarHBondContact O-N 2.83Å; A83-K85 PolarHBondContact O-N 3.1Å; A83-E86 PolarHBondContact O-N 3.21Å; A83-V93 HydrophobicContact CB-CG1 3.7Å; A83-V93 HydrophobicContact CB-CG2 4.4Å
84	T	91	Very high	89.8	Confident	30 Å²	30	69.7 Å²	69.7	18%	0.184	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-12.3	174.8	63.6	0	0	0	0	115.4	Y80 E81 N82 V93 W94 L97	Y80-T84 WeakPolarHBondContact O-CG2 3.45Å; Y80-T84 PolarHBondContact O-N 2.84Å; E81-T84 PolarHBondContact O-N 3.36Å; E81-T84 PolarHBondContact O-OG1 3.49Å; N82-T84 PolarHBondContact O-N 3.42Å; T84-V93 HydrophobicContact CG2-CG1 3.86Å; T84-W94 HydrophobicContact CG2-CD2 4.01Å; T84-W94 HydrophobicContact CG2-CE3 4Å; T84-W94 HydrophobicContact CG2-CH2 3.82Å; T84-W94 HydrophobicContact CG2-CZ2 3.85Å; T84-W94 HydrophobicContact CG2-CZ3 3.9Å; T84-L97 HydrophobicContact CG2-CD2 3.75Å
85	K	89.8	Confident	89.9	Confident	152 Å²	152	64.5 Å²	64.5	66%	0.661	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-10.1	179	-61.8	167.7	-167.7	159.8	0	112.7	N82 A83	N82-K85 WeakPolarHBondContact O-CB 3.33Å; N82-K85 PolarHBondContact O-N 2.86Å; N82-K85 PolarHBondContact OD1-NZ 3.28Å; A83-K85 PolarHBondContact O-N 3.1Å
86	E	86.1	Confident	90	Very high	110 Å²	110	64 Å²	64	51%	0.514	32%	0.318	S	S	.	.	S	Bend	trans	-76.9	141.8	-180	-62.5	178.3	-176.9	0	0	111	A83 N88 C89	A83-E86 PolarHBondContact O-N 3.21Å; E86-N88 PolarHBondContact O-N 3.19Å; E86-C89 WeakPolarHBondContact O-CB 3.4Å; E86-C89 PolarHBondContact O-N 3.45Å
87	E	77.1	Confident	90.1	Very high	202 Å²	202	64.1 Å²	64.1	94%	0.944	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-31.2	-175.6	-67.9	-174.9	168.7	0	0	112.9
88	N	78.8	Confident	90.1	Very high	154 Å²	154	63 Å²	63	82%	0.824	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	32.9	179.6	-68.9	-25.3	0	0	0	112.9	E86 N90	E86-N88 PolarHBondContact O-N 3.19Å; N88-N90 PolarHBondContact O-N 3.44Å
89	C	78.9	Confident	90.2	Very high	33 Å²	33	57.8 Å²	57.8	22%	0.223	29%	0.29	C	S	.	.			trans	-53.5	117.1	-179.9	176.1	0	0	0	0	111.9	E86 S91	E86-C89 WeakPolarHBondContact O-CB 3.4Å; E86-C89 PolarHBondContact O-N 3.45Å; C89-S91 PolarHBondContact O-N 2.98Å
90	N	83	Confident	90.3	Very high	76 Å²	76	56.7 Å²	56.7	41%	0.406	29%	0.285	S	S	.	.			trans	-58.9	135.9	172.6	-178.9	-12	0	0	0	110	N88 E92 V93	N88-N90 PolarHBondContact O-N 3.44Å; N90-E92 PolarHBondContact O-N 3.26Å; N90-E92 VanDerWaalsContact O-N 3.16Å; N90-E92 PolarHBondContact OD1-N 3.18Å; N90-V93 HydrophobicContact CB-CG2 4.17Å; N90-V93 VanDerWaalsContact O-CB 3.31Å; N90-V93 WeakPolarHBondContact O-CB 3.43Å; N90-V93 WeakPolarHBondContact O-CG2 3.37Å; N90-V93 PolarHBondContact O-N 3.37Å
91	S	84.7	Confident	90.5	Very high	41 Å²	41	58.1 Å²	58.1	29%	0.287	29%	0.29	S	S	.	.	H	α-helix	trans	-60	-25.5	180	-162.3	0	0	0	0	113.2	C89 V93 W94 S118	C89-S91 PolarHBondContact O-N 2.98Å; S91-V93 VanDerWaalsContact C-N 3.27Å; S91-V93 PolarHBondContact O-N 3.15Å; S91-W94 PolarHBondContact O-N 3.01Å; S91-S118 VanDerWaalsContact OG-CB 3.24Å; S91-S118 WeakPolarHBondContact OG-CB 3.48Å; S91-S118 PolarHBondContact OG-N 3.48Å; S91-S118 PolarHBondContact OG-OG 3.39Å
92	E	87.1	Confident	90.6	Very high	117 Å²	117	56.1 Å²	56.1	55%	0.547	28%	0.281	S	S	.	.	H	α-helix	trans	-67.2	-24.9	175.8	-66	-174.1	164.9	0	0	113.5	N90 W94 V95 N96	N90-E92 PolarHBondContact O-N 3.26Å; N90-E92 VanDerWaalsContact O-N 3.16Å; N90-E92 PolarHBondContact OD1-N 3.18Å; E92-W94 PolarHBondContact O-N 3.33Å; E92-V95 WeakPolarHBondContact O-CG1 3.3Å; E92-V95 PolarHBondContact O-N 2.58Å; E92-N96 PolarHBondContact O-N 3.35Å
93	V	92.4	Very high	90.6	Very high	3 Å²	3	56 Å²	56	2%	0.018	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-38.6	175.6	-178.6	0	0	0	0	110.5	L61 Y80 A83 T84 N90 S91 V95 N96 L97	L61-V93 HydrophobicContact CD1-CG2 4.14Å; L61-V93 HydrophobicContact CD2-CG1 4.37Å; L61-V93 HydrophobicContact CD2-CG2 3.6Å; Y80-V93 HydrophobicContact CD1-CG1 4.38Å; A83-V93 HydrophobicContact CB-CG1 3.7Å; A83-V93 HydrophobicContact CB-CG2 4.4Å; T84-V93 HydrophobicContact CG2-CG1 3.86Å; N90-V93 HydrophobicContact CB-CG2 4.17Å; N90-V93 VanDerWaalsContact O-CB 3.31Å; N90-V93 WeakPolarHBondContact O-CB 3.43Å; N90-V93 WeakPolarHBondContact O-CG2 3.37Å; N90-V93 PolarHBondContact O-N 3.37Å; S91-V93 VanDerWaalsContact C-N 3.27Å; S91-V93 PolarHBondContact O-N 3.15Å; V93-V95 PolarHBondContact O-N 2.94Å; V93-N96 PolarHBondContact O-N 2.96Å; V93-L97 VanDerWaalsContact O-CB 3.31Å; V93-L97 WeakPolarHBondContact O-CB 3.5Å; V93-L97 PolarHBondContact O-N 3.05Å
94	W	95.3	Very high	90.7	Very high	54 Å²	54	57.6 Å²	57.6	21%	0.205	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-37.7	179.3	-72.8	104.7	0	0	0	112.8	T84 S91 E92 L97 A98 A113 K116 A117	T84-W94 HydrophobicContact CG2-CD2 4.01Å; T84-W94 HydrophobicContact CG2-CE3 4Å; T84-W94 HydrophobicContact CG2-CH2 3.82Å; T84-W94 HydrophobicContact CG2-CZ2 3.85Å; T84-W94 HydrophobicContact CG2-CZ3 3.9Å; S91-W94 PolarHBondContact O-N 3.01Å; E92-W94 PolarHBondContact O-N 3.33Å; W94-L97 HydrophobicContact CE3-CD2 4.06Å; W94-L97 HydrophobicContact CZ3-CD2 3.97Å; W94-A98 WeakPolarHBondContact O-CB 3.43Å; W94-A98 PolarHBondContact O-N 3.11Å; W94-A113 HydrophobicContact CE3-CB 4.22Å; W94-K116 HydrophobicContact CB-CB 4.44Å; W94-K116 HydrophobicContact CD2-CB 3.82Å; W94-K116 HydrophobicContact CD2-CD 4.11Å; W94-K116 HydrophobicContact CE3-CB 4Å; W94-K116 HydrophobicContact CE3-CD 3.72Å; W94-K116 HydrophobicContact CG-CB 4.03Å; W94-K116 HydrophobicContact CH2-CD 3.76Å; W94-K116 HydrophobicContact CZ2-CD 4.11Å; W94-K116 HydrophobicContact CZ3-CD 3.54Å; W94-A117 HydrophobicContact CB-CB 3.71Å
95	V	95.8	Very high	90.8	Very high	6 Å²	6	57.2 Å²	57.2	4%	0.036	29%	0.286	C	S	.	.	H	α-helix	trans	-73	-37	177.8	68.2	0	0	0	0	111.4	E92 V93 A98 C99 A117 L122 Q123 L126	E92-V95 WeakPolarHBondContact O-CG1 3.3Å; E92-V95 PolarHBondContact O-N 2.58Å; V93-V95 PolarHBondContact O-N 2.94Å; V95-A98 PolarHBondContact O-N 2.81Å; V95-C99 PolarHBondContact O-N 3.48Å; V95-C99 PolarHBondContact O-SG 3.22Å; V95-C99 VanDerWaalsContact O-SG 3.35Å; V95-A117 HydrophobicContact CB-CB 3.88Å; V95-L122 HydrophobicContact CG1-CD2 4.08Å; V95-L122 HydrophobicContact CG2-CB 4.36Å; V95-L122 HydrophobicContact CG2-CD2 4.03Å; V95-L122 HydrophobicContact CG2-CG 3.82Å; V95-Q123 HydrophobicContact CG2-CB 4.11Å; V95-L126 HydrophobicContact CG2-CD2 4.42Å
96	N	95.8	Very high	91.1	Very high	45 Å²	45	53.5 Å²	53.5	24%	0.241	27%	0.272	C	S	.	.	H	α-helix	trans	-66.9	-41.3	175.5	-68.8	-25	0	0	0	112	Y80 E92 V93 A98 C99 T100	Y80-N96 HydrophobicContact CD1-CB 4.19Å; Y80-N96 HydrophobicContact CD2-CB 4.23Å; Y80-N96 HydrophobicContact CE1-CB 3.8Å; Y80-N96 HydrophobicContact CE2-CB 3.83Å; Y80-N96 HydrophobicContact CG-CB 4.41Å; E92-N96 PolarHBondContact O-N 3.35Å; V93-N96 PolarHBondContact O-N 2.96Å; N96-A98 VanDerWaalsContact C-N 3.33Å; N96-A98 PolarHBondContact O-N 3.06Å; N96-C99 PolarHBondContact O-N 2.77Å; N96-T100 PolarHBondContact O-N 2.85Å; N96-T100 PolarHBondContact O-OG1 3.41Å
97	L	96.7	Very high	91.6	Very high	2 Å²	2	51 Å²	51	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-59.1	-45.6	171.1	178.9	57.9	0	0	0	111.1	L77 E81 T84 V93 W94 T100 Y101	L77-L97 HydrophobicContact CD1-CD1 3.49Å; L77-L97 VanDerWaalsContact CD1-CD1 3.49Å; E81-L97 HydrophobicContact CG-CD1 3.8Å; E81-L97 HydrophobicContact CG-CD2 4.49Å; T84-L97 HydrophobicContact CG2-CD2 3.75Å; V93-L97 VanDerWaalsContact O-CB 3.31Å; V93-L97 WeakPolarHBondContact O-CB 3.5Å; V93-L97 PolarHBondContact O-N 3.05Å; W94-L97 HydrophobicContact CE3-CD2 4.06Å; W94-L97 HydrophobicContact CZ3-CD2 3.97Å; L97-T100 WeakPolarHBondContact O-CB 3.38Å; L97-T100 PolarHBondContact O-N 3.29Å; L97-T100 VanDerWaalsContact O-N 3.11Å; L97-Y101 HydrophobicContact CD1-CD2 4.2Å; L97-Y101 HydrophobicContact CD1-CE2 3.73Å; L97-Y101 HydrophobicContact CD2-CE2 4.01Å; L97-Y101 HydrophobicContact CG-CD2 4.01Å; L97-Y101 HydrophobicContact CG-CE2 3.61Å; L97-Y101 WeakPolarHBondContact O-CD2 3.37Å; L97-Y101 PolarHBondContact O-N 3.06Å
98	A	97.5	Very high	92.6	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.2	-41.3	179.4	0	0	0	0	0	112.6	W94 V95 N96 T100 Y101 F102 A110 A113 L126	W94-A98 WeakPolarHBondContact O-CB 3.43Å; W94-A98 PolarHBondContact O-N 3.11Å; V95-A98 PolarHBondContact O-N 2.81Å; N96-A98 VanDerWaalsContact C-N 3.33Å; N96-A98 PolarHBondContact O-N 3.06Å; A98-T100 VanDerWaalsContact C-N 3.29Å; A98-T100 PolarHBondContact O-N 3.06Å; A98-Y101 PolarHBondContact O-N 3.15Å; A98-F102 PolarHBondContact O-N 3.2Å; A98-A110 WeakPolarHBondContact CB-O 3.47Å; A98-A110 WeakPolarHBondContact O-CB 3.48Å; A98-A113 HydrophobicContact CB-CB 3.72Å; A98-L126 HydrophobicContact CB-CD2 3.3Å
99	C	97.1	Very high	93.5	Very high	16 Å²	16	46 Å²	46	11%	0.108	23%	0.227	C	C	.	.	H	α-helix	trans	-58.7	-42.3	170.1	-73.6	0	0	0	0	111.4	F68 V95 N96 F102 F103	F68-C99 HydrophobicContact CE2-CB 4.13Å; F68-C99 HydrophobicContact CZ-CB 4.26Å; V95-C99 PolarHBondContact O-N 3.48Å; V95-C99 PolarHBondContact O-SG 3.22Å; V95-C99 VanDerWaalsContact O-SG 3.35Å; N96-C99 PolarHBondContact O-N 2.77Å; C99-F102 WeakPolarHBondContact O-CB 3.34Å; C99-F102 PolarHBondContact O-N 2.83Å; C99-F103 WeakPolarHBondContact O-CD2 3.47Å; C99-F103 PolarHBondContact O-N 2.92Å; C99-F103 VanDerWaalsContact O-N 3.09Å
100	T	97.2	Very high	94.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.6	-45.9	178.5	-55.5	0	0	0	0	111.7	Y73 A76 L77 Y80 N96 L97 A98 F102 F103 L104	Y73-T100 WeakPolarHBondContact O-CG2 3.28Å; A76-T100 HydrophobicContact CB-CG2 4.01Å; L77-T100 HydrophobicContact CB-CG2 3.83Å; L77-T100 HydrophobicContact CD1-CG2 4.42Å; Y80-T100 WeakPolarHBondContact CD2-OG1 3.24Å; N96-T100 PolarHBondContact O-N 2.85Å; N96-T100 PolarHBondContact O-OG1 3.41Å; L97-T100 WeakPolarHBondContact O-CB 3.38Å; L97-T100 PolarHBondContact O-N 3.29Å; L97-T100 VanDerWaalsContact O-N 3.11Å; A98-T100 VanDerWaalsContact C-N 3.29Å; A98-T100 PolarHBondContact O-N 3.06Å; T100-F102 VanDerWaalsContact C-N 3.28Å; T100-F102 PolarHBondContact O-N 2.57Å; T100-F103 PolarHBondContact O-N 2.67Å; T100-L104 HydrophobicContact CG2-CD1 4.15Å; T100-L104 WeakPolarHBondContact O-CG 3.47Å; T100-L104 PolarHBondContact O-N 3.35Å
101	Y	98	Very high	95.1	Very high	32 Å²	32	42.6 Å²	42.6	13%	0.125	21%	0.206	C	C	.	.	H	α-helix	trans	-58.8	-38.8	172.6	-76.8	-48.1	0	0	0	112.7	L77 E81 L97 A98 L104 G105 M106 Q109 A113	L77-Y101 HydrophobicContact CD1-CD1 3.75Å; L77-Y101 HydrophobicContact CD1-CE1 3.3Å; L77-Y101 HydrophobicContact CD1-CE2 4.48Å; L77-Y101 HydrophobicContact CD1-CG 4.47Å; L77-Y101 HydrophobicContact CD2-CE1 4.29Å; L77-Y101 HydrophobicContact CG-CE1 4.42Å; E81-Y101 PolarHBondContact OE1-OH 3.27Å; L97-Y101 HydrophobicContact CD1-CD2 4.2Å; L97-Y101 HydrophobicContact CD1-CE2 3.73Å; L97-Y101 HydrophobicContact CD2-CE2 4.01Å; L97-Y101 HydrophobicContact CG-CD2 4.01Å; L97-Y101 HydrophobicContact CG-CE2 3.61Å; L97-Y101 WeakPolarHBondContact O-CD2 3.37Å; L97-Y101 PolarHBondContact O-N 3.06Å; A98-Y101 PolarHBondContact O-N 3.15Å; Y101-L104 CarbonylContact O-C 3.59Å; Y101-L104 PolarHBondContact O-N 3Å; Y101-G105 PolarHBondContact O-N 3.35Å; Y101-M106 HydrophobicContact CD1-CB 3.97Å; Y101-M106 HydrophobicContact CD1-CG 4.44Å; Y101-M106 HydrophobicContact CD1-SD 3.75Å; Y101-M106 HydrophobicContact CE1-SD 4.01Å; Y101-M106 HydrophobicContact CG-CB 4.42Å; Y101-M106 PolarHBondContact O-N 2.99Å; Y101-Q109 HydrophobicContact CD1-CB 3.92Å; Y101-Q109 HydrophobicContact CD2-CB 3.82Å; Y101-Q109 HydrophobicContact CE1-CB 4.11Å; Y101-Q109 HydrophobicContact CE2-CB 3.99Å; Y101-Q109 HydrophobicContact CG-CB 3.79Å; Y101-A113 HydrophobicContact CD2-CB 4.17Å; Y101-A113 HydrophobicContact CE2-CB 4.29Å
102	F	96.9	Very high	95.7	Very high	21 Å²	21	43.4 Å²	43.4	9%	0.092	22%	0.215	C	C	.	.	H	α-helix	trans	-60.4	-48.6	177.6	177.8	-86.4	0	0	0	111.8	A98 C99 T100 L104 G105 Y107 A110 L126 H129 L130 K133	A98-F102 PolarHBondContact O-N 3.2Å; C99-F102 WeakPolarHBondContact O-CB 3.34Å; C99-F102 PolarHBondContact O-N 2.83Å; T100-F102 VanDerWaalsContact C-N 3.28Å; T100-F102 PolarHBondContact O-N 2.57Å; F102-L104 VanDerWaalsContact C-N 3.27Å; F102-L104 PolarHBondContact O-N 2.9Å; F102-G105 PolarHBondContact O-N 2.83Å; F102-Y107 HydrophobicContact CD2-CD1 4.08Å; F102-Y107 HydrophobicContact CD2-CE1 4.21Å; F102-Y107 HydrophobicContact CE2-CD1 4.41Å; F102-Y107 HydrophobicContact CE2-CE1 4.27Å; F102-A110 HydrophobicContact CB-CB 4.17Å; F102-L126 HydrophobicContact CB-CD1 3.8Å; F102-L126 HydrophobicContact CD2-CD1 4.09Å; F102-L126 HydrophobicContact CG-CD1 4.01Å; F102-H129 HydrophobicContact CE2-CB 3.87Å; F102-H129 HydrophobicContact CZ-CB 3.96Å; F102-L130 HydrophobicContact CD2-CD2 3.73Å; F102-L130 HydrophobicContact CD2-CG 3.97Å; F102-L130 HydrophobicContact CE2-CD2 4.3Å; F102-L130 HydrophobicContact CE2-CG 4.42Å; F102-K133 HydrophobicContact CE2-CG 4.08Å
103	F	92.9	Very high	96.1	Very high	75 Å²	75	38 Å²	38	33%	0.329	19%	0.19	S	C	.	.	H	α-helix	trans	-70.5	-21.6	178.5	-80.3	-79.5	0	0	0	113.6	M2 F68 Y73 C99 T100 G105	M2-F103 HydrophobicContact SD-CE1 4.1Å; F68-F103 AromaticContact CE2-CD2 3.68Å; F68-F103 HydrophobicContact CE2-CD2 3.68Å; F68-F103 HydrophobicContact CE2-CE2 4.24Å; F68-F103 HydrophobicContact CE2-CG 4.46Å; F68-F103 AromaticContact CZ-CD2 3.49Å; F68-F103 HydrophobicContact CZ-CD2 3.49Å; F68-F103 VanDerWaalsContact CZ-CD2 3.49Å; F68-F103 AromaticContact CZ-CE2 3.56Å; F68-F103 HydrophobicContact CZ-CE2 3.56Å; F68-F103 HydrophobicContact CZ-CG 4.46Å; Y73-F103 HydrophobicContact CD1-CB 3.8Å; Y73-F103 HydrophobicContact CD1-CG 4.41Å; Y73-F103 HydrophobicContact CD2-CB 3.91Å; Y73-F103 HydrophobicContact CE1-CB 3.67Å; Y73-F103 HydrophobicContact CE1-CD1 4.28Å; Y73-F103 HydrophobicContact CE1-CD2 4.28Å; Y73-F103 AromaticContact CE1-CG 3.82Å; Y73-F103 HydrophobicContact CE1-CG 3.82Å; Y73-F103 HydrophobicContact CE2-CB 3.78Å; Y73-F103 HydrophobicContact CE2-CD1 4.26Å; Y73-F103 HydrophobicContact CE2-CG 4.29Å; Y73-F103 HydrophobicContact CG-CB 3.92Å; Y73-F103 AromaticContact CZ-CD1 3.76Å; Y73-F103 AromaticContact CZ-CG 3.75Å; Y73-F103 WeakPolarHBondContact OH-CD1 3.2Å; C99-F103 WeakPolarHBondContact O-CD2 3.47Å; C99-F103 PolarHBondContact O-N 2.92Å; C99-F103 VanDerWaalsContact O-N 3.09Å; T100-F103 PolarHBondContact O-N 2.67Å; F103-G105 VanDerWaalsContact C-N 3.26Å
104	L	93.3	Very high	96.3	Very high	41 Å²	41	37.9 Å²	37.9	22%	0.215	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-3.3	168.7	-70.2	170.7	0	0	0	113.6	K74 L77 T100 Y101 F102 M106	K74-L104 HydrophobicContact CG-CD2 4.31Å; L77-L104 HydrophobicContact CB-CD1 4.09Å; L77-L104 HydrophobicContact CD1-CD1 4.45Å; L77-L104 HydrophobicContact CD2-CD1 3.79Å; L77-L104 HydrophobicContact CG-CD1 4.34Å; T100-L104 HydrophobicContact CG2-CD1 4.15Å; T100-L104 WeakPolarHBondContact O-CG 3.47Å; T100-L104 PolarHBondContact O-N 3.35Å; Y101-L104 CarbonylContact O-C 3.59Å; Y101-L104 PolarHBondContact O-N 3Å; F102-L104 VanDerWaalsContact C-N 3.27Å; F102-L104 PolarHBondContact O-N 2.9Å; L104-M106 HydrophobicContact CB-CG 4.22Å; L104-M106 PolarHBondContact O-N 3.36Å
105	G	92.7	Very high	96.3	Very high	21 Å²	21	40.6 Å²	40.6	22%	0.216	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.9	10.6	-177.1	0	0	0	0	0	114.3	Y101 F102 F103 Y107	Y101-G105 PolarHBondContact O-N 3.35Å; F102-G105 PolarHBondContact O-N 2.83Å; F103-G105 VanDerWaalsContact C-N 3.26Å; G105-Y107 VanDerWaalsContact C-N 3.26Å; G105-Y107 PolarHBondContact O-N 3.43Å; G105-Y107 VanDerWaalsContact O-N 3.1Å
106	M	96.1	Very high	96.3	Very high	74 Å²	74	46.6 Å²	46.6	37%	0.365	23%	0.229	S	C	.	.			trans	-85.7	61.6	178.4	-62.5	-171.5	-171.8	0	0	110.6	Y101 L104 K108 Q109 A110	Y101-M106 HydrophobicContact CD1-CB 3.97Å; Y101-M106 HydrophobicContact CD1-CG 4.44Å; Y101-M106 HydrophobicContact CD1-SD 3.75Å; Y101-M106 HydrophobicContact CE1-SD 4.01Å; Y101-M106 HydrophobicContact CG-CB 4.42Å; Y101-M106 PolarHBondContact O-N 2.99Å; L104-M106 HydrophobicContact CB-CG 4.22Å; L104-M106 PolarHBondContact O-N 3.36Å; M106-K108 VanDerWaalsContact C-N 3.33Å; M106-K108 PolarHBondContact O-N 3.44Å; M106-Q109 HydrophobicContact CB-CB 4.2Å; M106-Q109 HydrophobicContact CB-CG 4.44Å; M106-Q109 PolarHBondContact O-N 3.01Å; M106-Q109 PolarHBondContact O-OE1 2.92Å; M106-A110 PolarHBondContact O-N 3.27Å
107	Y	97.1	Very high	96.1	Very high	57 Å²	57	44.9 Å²	44.9	22%	0.224	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-34.5	-167.6	-54.2	-51.1	0	0	0	114.3	F102 G105 A110 E111 L130 K133	F102-Y107 HydrophobicContact CD2-CD1 4.08Å; F102-Y107 HydrophobicContact CD2-CE1 4.21Å; F102-Y107 HydrophobicContact CE2-CD1 4.41Å; F102-Y107 HydrophobicContact CE2-CE1 4.27Å; G105-Y107 VanDerWaalsContact C-N 3.26Å; G105-Y107 PolarHBondContact O-N 3.43Å; G105-Y107 VanDerWaalsContact O-N 3.1Å; Y107-A110 PolarHBondContact O-N 2.84Å; Y107-E111 PolarHBondContact O-N 2.87Å; Y107-L130 HydrophobicContact CD1-CD2 4.08Å; Y107-L130 HydrophobicContact CG-CD2 4.39Å; Y107-K133 HydrophobicContact CD1-CG 4.36Å; Y107-K133 HydrophobicContact CE1-CD 4.37Å; Y107-K133 HydrophobicContact CE1-CG 4.13Å; Y107-K133 HydrophobicContact CE2-CD 4.4Å; Y107-K133 HydrophobicContact CG-CB 4.47Å
108	K	97.6	Very high	95.9	Very high	161 Å²	161	47.5 Å²	47.5	70%	0.7	24%	0.239	S	C	*	.	H	α-helix	trans	-67.1	-41.7	178.1	-67.3	-174.4	179.5	-178.2	0	111.5	M106 E111 A112 F134	M106-K108 VanDerWaalsContact C-N 3.33Å; M106-K108 PolarHBondContact O-N 3.44Å; K108-E111 PolarHBondContact O-N 2.95Å; K108-A112 PolarHBondContact O-N 3.16Å; K108-A112 VanDerWaalsContact O-N 3.1Å; K108-F134 HydrophobicContact CG-CE1 4.22Å; K108-F134 HydrophobicContact CG-CZ 4.18Å
109	Q	97.4	Very high	95.8	Very high	90 Å²	90	57 Å²	57	42%	0.421	28%	0.28	S	S	.	.	H	α-helix	trans	-67.9	-40.8	176	-63.9	86.7	-28.5	0	0	110.9	Y101 M106 E111 A112 A113	Y101-Q109 HydrophobicContact CD1-CB 3.92Å; Y101-Q109 HydrophobicContact CD2-CB 3.82Å; Y101-Q109 HydrophobicContact CE1-CB 4.11Å; Y101-Q109 HydrophobicContact CE2-CB 3.99Å; Y101-Q109 HydrophobicContact CG-CB 3.79Å; M106-Q109 HydrophobicContact CB-CB 4.2Å; M106-Q109 HydrophobicContact CB-CG 4.44Å; M106-Q109 PolarHBondContact O-N 3.01Å; M106-Q109 PolarHBondContact O-OE1 2.92Å; Q109-E111 VanDerWaalsContact C-N 3.35Å; Q109-E111 PolarHBondContact O-N 3.48Å; Q109-A112 PolarHBondContact O-N 2.88Å; Q109-A113 WeakPolarHBondContact O-CB 3.26Å; Q109-A113 PolarHBondContact O-N 3.42Å
110	A	97.9	Very high	95.6	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.5	-44.6	174.2	0	0	0	0	0	111.8	A98 F102 M106 Y107 G114 L130	A98-A110 WeakPolarHBondContact CB-O 3.47Å; A98-A110 WeakPolarHBondContact O-CB 3.48Å; F102-A110 HydrophobicContact CB-CB 4.17Å; M106-A110 PolarHBondContact O-N 3.27Å; Y107-A110 PolarHBondContact O-N 2.84Å; A110-G114 PolarHBondContact O-N 3.16Å; A110-L130 HydrophobicContact CB-CD1 3.98Å; A110-L130 HydrophobicContact CB-CD2 3.9Å
111	E	97.9	Very high	95.6	Very high	39 Å²	39	62.8 Å²	62.8	18%	0.182	31%	0.307	C	S	.	.	H	α-helix	trans	-64.7	-47	177.4	-171.5	-178.7	-138	0	0	111.9	Y107 K108 Q109 A113 G114 F115 L127 L130 F134 K139	Y107-E111 PolarHBondContact O-N 2.87Å; K108-E111 PolarHBondContact O-N 2.95Å; Q109-E111 VanDerWaalsContact C-N 3.35Å; Q109-E111 PolarHBondContact O-N 3.48Å; E111-A113 PolarHBondContact O-N 2.91Å; E111-G114 PolarHBondContact O-N 3.19Å; E111-F115 HydrophobicContact CG-CD2 3.78Å; E111-F115 HydrophobicContact CG-CE2 3.46Å; E111-F115 VanDerWaalsContact CG-CE2 3.46Å; E111-F115 VanDerWaalsContact O-CD2 3.29Å; E111-F115 WeakPolarHBondContact O-CD2 3.35Å; E111-F115 PolarHBondContact O-N 3.26Å; E111-L127 HydrophobicContact CG-CD2 4.46Å; E111-L130 HydrophobicContact CB-CD1 4.12Å; E111-F134 HydrophobicContact CB-CE2 4.14Å; E111-K139 IonicContact OE1-NZ 3.63Å; E111-K139 PolarHBondContact OE1-NZ 3.47Å; E111-K139 IonicContact OE2-NZ 2.7Å
112	A	97.2	Very high	95.5	Very high	57 Å²	57	64.3 Å²	64.3	47%	0.471	32%	0.317	S	S	.	.	H	α-helix	trans	-61.3	-43	179	0	0	0	0	0	112.5	K108 Q109 K116	K108-A112 PolarHBondContact O-N 3.16Å; K108-A112 VanDerWaalsContact O-N 3.1Å; Q109-A112 PolarHBondContact O-N 2.88Å; A112-K116 WeakPolarHBondContact O-CG 3.35Å; A112-K116 PolarHBondContact O-N 3.3Å
113	A	96.3	Very high	95.5	Very high	5 Å²	5	64.1 Å²	64.1	4%	0.041	32%	0.316	C	S	.	.	H	α-helix	trans	-67.8	-39.6	174.8	0	0	0	0	0	111.6	W94 A98 Y101 Q109 E111 F115 K116 A117	W94-A113 HydrophobicContact CE3-CB 4.22Å; A98-A113 HydrophobicContact CB-CB 3.72Å; Y101-A113 HydrophobicContact CD2-CB 4.17Å; Y101-A113 HydrophobicContact CE2-CB 4.29Å; Q109-A113 WeakPolarHBondContact O-CB 3.26Å; Q109-A113 PolarHBondContact O-N 3.42Å; E111-A113 PolarHBondContact O-N 2.91Å; A113-F115 VanDerWaalsContact C-N 3.32Å; A113-F115 PolarHBondContact O-N 3.5Å; A113-K116 WeakPolarHBondContact O-CB 3.46Å; A113-K116 PolarHBondContact O-N 3.28Å; A113-K116 VanDerWaalsContact O-N 3.08Å; A113-A117 PolarHBondContact O-N 2.99Å
114	G	96.2	Very high	95.7	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-59.4	-39.7	177.6	0	0	0	0	0	113	A110 E111 K116 A117 Q123	A110-G114 PolarHBondContact O-N 3.16Å; E111-G114 PolarHBondContact O-N 3.19Å; G114-K116 VanDerWaalsContact C-N 3.34Å; G114-A117 WeakPolarHBondContact O-CB 3.33Å; G114-A117 PolarHBondContact O-N 3.3Å; G114-Q123 WeakPolarHBondContact O-CG 3.37Å; G114-Q123 PolarHBondContact O-NE2 3.47Å
115	F	95.8	Very high	96	Very high	111 Å²	111	61.1 Å²	61.1	49%	0.487	30%	0.301	S	S	.	.	H	α-helix	trans	-75.4	-16.7	175.9	-75.8	-59	0	0	0	114.7	E111 A113 L127 F143	E111-F115 HydrophobicContact CG-CD2 3.78Å; E111-F115 HydrophobicContact CG-CE2 3.46Å; E111-F115 VanDerWaalsContact CG-CE2 3.46Å; E111-F115 VanDerWaalsContact O-CD2 3.29Å; E111-F115 WeakPolarHBondContact O-CD2 3.35Å; E111-F115 PolarHBondContact O-N 3.26Å; A113-F115 VanDerWaalsContact C-N 3.32Å; A113-F115 PolarHBondContact O-N 3.5Å; F115-L127 HydrophobicContact CD1-CD1 4.16Å; F115-L127 HydrophobicContact CE1-CD1 3.86Å; F115-L127 HydrophobicContact CE1-CD2 4.43Å; F115-L127 HydrophobicContact CE2-CD2 4.27Å; F115-L127 HydrophobicContact CZ-CD1 4.35Å; F115-L127 HydrophobicContact CZ-CD2 4.22Å; F115-F143 HydrophobicContact CE1-CZ 4.3Å; F115-F143 HydrophobicContact CZ-CZ 4.19Å
116	K	94	Very high	96.2	Very high	132 Å²	132	60.6 Å²	60.6	57%	0.574	29%	0.293	S	S	*	.	H	α-helix	trans	-79.6	-24.8	170.6	-70.5	177.6	179	-175.5	0	112.7	W94 A112 A113 G114	W94-K116 HydrophobicContact CB-CB 4.44Å; W94-K116 HydrophobicContact CD2-CB 3.82Å; W94-K116 HydrophobicContact CD2-CD 4.11Å; W94-K116 HydrophobicContact CE3-CB 4Å; W94-K116 HydrophobicContact CE3-CD 3.72Å; W94-K116 HydrophobicContact CG-CB 4.03Å; W94-K116 HydrophobicContact CH2-CD 3.76Å; W94-K116 HydrophobicContact CZ2-CD 4.11Å; W94-K116 HydrophobicContact CZ3-CD 3.54Å; A112-K116 WeakPolarHBondContact O-CG 3.35Å; A112-K116 PolarHBondContact O-N 3.3Å; A113-K116 WeakPolarHBondContact O-CB 3.46Å; A113-K116 PolarHBondContact O-N 3.28Å; A113-K116 VanDerWaalsContact O-N 3.08Å; G114-K116 VanDerWaalsContact C-N 3.34Å
117	A	92.9	Very high	96.3	Very high	8 Å²	8	57.3 Å²	57.3	7%	0.066	28%	0.277	C	S	.	.	S	Bend	trans	-68.7	151.5	175.9	0	0	0	0	0	111.6	W94 V95 A113 G114 Q123	W94-A117 HydrophobicContact CB-CB 3.71Å; V95-A117 HydrophobicContact CB-CB 3.88Å; A113-A117 PolarHBondContact O-N 2.99Å; G114-A117 WeakPolarHBondContact O-CB 3.33Å; G114-A117 PolarHBondContact O-N 3.3Å; A117-Q123 HydrophobicContact CB-CG 4.49Å; A117-Q123 PolarHBondContact O-NE2 3.29Å
118	S	93.1	Very high	96.3	Very high	57 Å²	57	54.7 Å²	54.7	40%	0.399	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-61.8	152.1	170.6	59.5	0	0	0	0	110.9	S91 S120	S91-S118 VanDerWaalsContact OG-CB 3.24Å; S91-S118 WeakPolarHBondContact OG-CB 3.48Å; S91-S118 PolarHBondContact OG-N 3.48Å; S91-S118 PolarHBondContact OG-OG 3.39Å; S118-S120 PolarHBondContact O-N 3.33Å; S118-S120 VanDerWaalsContact O-N 3.11Å
119	K	93.5	Very high	96.4	Very high	201 Å²	201	48.3 Å²	48.3	87%	0.874	24%	0.239	S	C	*	.	S	Bend	trans	-61.9	117.2	176.7	-71.3	-173.5	179.5	-178.3	0	110
120	S	94.6	Very high	96.4	Very high	46 Å²	46	44 Å²	44	32%	0.322	22%	0.22	S	C	.	.			trans	-146.3	165.4	178.8	70	0	0	0	0	110.8	S118 L122 Q123 N124	S118-S120 PolarHBondContact O-N 3.33Å; S118-S120 VanDerWaalsContact O-N 3.11Å; S120-L122 VanDerWaalsContact C-N 3.33Å; S120-L122 PolarHBondContact O-N 2.83Å; S120-Q123 PolarHBondContact O-N 3.04Å; S120-Q123 WeakPolarHBondContact OG-CB 3.22Å; S120-Q123 PolarHBondContact OG-N 3.23Å; S120-Q123 VanDerWaalsContact OG-N 3.16Å; S120-N124 PolarHBondContact O-N 2.81Å
121	R	95.5	Very high	96.4	Very high	91 Å²	91	44.1 Å²	44.1	34%	0.343	22%	0.22	S	C	.	.	H	α-helix	trans	-62.3	-42.5	177.5	-56.9	-179.4	70.4	144.8	22.2	111.8	N124 R125 V150 D153	R121-N124 PolarHBondContact O-N 3.37Å; R121-R125 WeakPolarHBondContact O-CG 3.34Å; R121-R125 PolarHBondContact O-N 3.35Å; R121-V150 VanDerWaalsContact NH1-CG1 3.34Å; R121-D153 IonicContact CZ-OD2 3.57Å; R121-D153 IonicContact NE-OD2 3.49Å; R121-D153 PolarHBondContact NE-OD2 3.25Å; R121-D153 IonicContact NH2-OD2 2.75Å; R121-D153 PolarHBondContact NH2-OD2 2.91Å
122	L	96.1	Very high	96.3	Very high	63 Å²	63	43.8 Å²	43.8	33%	0.33	22%	0.219	S	C	.	.	H	α-helix	trans	-62.4	-44.3	176.9	179.7	60.2	0	0	0	111.3	V95 S120 N124 R125 L126	V95-L122 HydrophobicContact CG1-CD2 4.08Å; V95-L122 HydrophobicContact CG2-CB 4.36Å; V95-L122 HydrophobicContact CG2-CD2 4.03Å; V95-L122 HydrophobicContact CG2-CG 3.82Å; S120-L122 VanDerWaalsContact C-N 3.33Å; S120-L122 PolarHBondContact O-N 2.83Å; L122-N124 PolarHBondContact O-N 3.19Å; L122-R125 PolarHBondContact O-N 2.78Å; L122-L126 WeakPolarHBondContact O-CB 3.09Å; L122-L126 PolarHBondContact O-N 2.88Å
123	Q	97.1	Very high	96.2	Very high	18 Å²	18	45 Å²	45	8%	0.084	21%	0.213	C	C	.	.	H	α-helix	trans	-58.9	-46.8	175.1	-176.2	-147	44.6	0	0	111.1	V95 G114 A117 S120 R125 L126 L127	V95-Q123 HydrophobicContact CG2-CB 4.11Å; G114-Q123 WeakPolarHBondContact O-CG 3.37Å; G114-Q123 PolarHBondContact O-NE2 3.47Å; A117-Q123 HydrophobicContact CB-CG 4.49Å; A117-Q123 PolarHBondContact O-NE2 3.29Å; S120-Q123 PolarHBondContact O-N 3.04Å; S120-Q123 WeakPolarHBondContact OG-CB 3.22Å; S120-Q123 PolarHBondContact OG-N 3.23Å; S120-Q123 VanDerWaalsContact OG-N 3.16Å; Q123-R125 PolarHBondContact O-N 3.37Å; Q123-L126 PolarHBondContact O-N 2.67Å; Q123-L127 HydrophobicContact CG-CD1 3.9Å; Q123-L127 HydrophobicContact CG-CG 4.34Å; Q123-L127 WeakPolarHBondContact O-CB 3.5Å; Q123-L127 WeakPolarHBondContact O-CG 3.39Å; Q123-L127 PolarHBondContact O-N 3.17Å
124	N	98	Very high	96.2	Very high	16 Å²	16	48.2 Å²	48.2	9%	0.086	23%	0.226	C	C	.	.	H	α-helix	trans	-59.9	-44.9	178.7	-172	78.5	0	0	0	111.9	S120 R121 L122 L127 F128 F143 N146	S120-N124 PolarHBondContact O-N 2.81Å; R121-N124 PolarHBondContact O-N 3.37Å; L122-N124 PolarHBondContact O-N 3.19Å; N124-L127 PolarHBondContact O-N 3.35Å; N124-F128 VanDerWaalsContact O-CB 3.22Å; N124-F128 WeakPolarHBondContact O-CB 3.45Å; N124-F128 PolarHBondContact O-N 3.27Å; N124-F143 PolarHBondContact ND2-O 3.26Å; N124-F143 WeakPolarHBondContact OD1-CD1 3.44Å; N124-N146 VanDerWaalsContact OD1-CB 3.29Å; N124-N146 WeakPolarHBondContact OD1-CB 3.4Å; N124-N146 PolarHBondContact OD1-ND2 3.42Å; N124-N146 VanDerWaalsContact OD1-ND2 3.12Å
125	R	98.1	Very high	96.1	Very high	36 Å²	36	54.7 Å²	54.7	14%	0.136	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-44.8	175.5	-70.1	-177.6	-67.5	-116.8	19.2	112	R121 L122 Q123 F128 H129 L147 E152 D153 S156	R121-R125 WeakPolarHBondContact O-CG 3.34Å; R121-R125 PolarHBondContact O-N 3.35Å; L122-R125 PolarHBondContact O-N 2.78Å; Q123-R125 PolarHBondContact O-N 3.37Å; R125-F128 WeakPolarHBondContact O-CB 3.33Å; R125-F128 PolarHBondContact O-N 3.3Å; R125-H129 PolarHBondContact O-CD2 3.15Å; R125-H129 PolarHBondContact O-N 2.83Å; R125-L147 HydrophobicContact CG-CD2 4.23Å; R125-E152 WeakPolarHBondContact CD-O 3.38Å; R125-E152 VanDerWaalsContact CZ-CB 3.46Å; R125-D153 VanDerWaalsContact CD-OD1 3.28Å; R125-D153 WeakPolarHBondContact CD-OD1 3.46Å; R125-D153 WeakPolarHBondContact CG-OD1 3.34Å; R125-D153 IonicContact CZ-OD1 3.63Å; R125-D153 IonicContact NE-OD1 2.85Å; R125-D153 IonicContact NH1-OD1 2.78Å; R125-D153 PolarHBondContact NH1-OD1 3.29Å; R125-S156 WeakPolarHBondContact CD-OG 3.47Å
126	L	97.9	Very high	96.1	Very high	10 Å²	10	51.9 Å²	51.9	5%	0.052	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-49.7	176.9	175.3	66	0	0	0	111.6	V95 A98 F102 L122 Q123 F128 H129 L130	V95-L126 HydrophobicContact CG2-CD2 4.42Å; A98-L126 HydrophobicContact CB-CD2 3.3Å; F102-L126 HydrophobicContact CB-CD1 3.8Å; F102-L126 HydrophobicContact CD2-CD1 4.09Å; F102-L126 HydrophobicContact CG-CD1 4.01Å; L122-L126 WeakPolarHBondContact O-CB 3.09Å; L122-L126 PolarHBondContact O-N 2.88Å; Q123-L126 PolarHBondContact O-N 2.67Å; L126-F128 VanDerWaalsContact C-N 3.29Å; L126-F128 PolarHBondContact O-N 2.88Å; L126-H129 PolarHBondContact O-N 2.96Å; L126-L130 HydrophobicContact CD1-CD1 4.26Å; L126-L130 HydrophobicContact CG-CD1 4.01Å; L126-L130 WeakPolarHBondContact O-CG 3.43Å; L126-L130 PolarHBondContact O-N 3.05Å
127	L	98.2	Very high	96.2	Very high	5 Å²	5	49.8 Å²	49.8	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-65.8	-32.8	179.4	-67.4	175.7	0	0	0	112.1	E111 F115 Q123 N124 L130 A131 F143	E111-L127 HydrophobicContact CG-CD2 4.46Å; F115-L127 HydrophobicContact CD1-CD1 4.16Å; F115-L127 HydrophobicContact CE1-CD1 3.86Å; F115-L127 HydrophobicContact CE1-CD2 4.43Å; F115-L127 HydrophobicContact CE2-CD2 4.27Å; F115-L127 HydrophobicContact CZ-CD1 4.35Å; F115-L127 HydrophobicContact CZ-CD2 4.22Å; Q123-L127 HydrophobicContact CG-CD1 3.9Å; Q123-L127 HydrophobicContact CG-CG 4.34Å; Q123-L127 WeakPolarHBondContact O-CB 3.5Å; Q123-L127 WeakPolarHBondContact O-CG 3.39Å; Q123-L127 PolarHBondContact O-N 3.17Å; N124-L127 PolarHBondContact O-N 3.35Å; L127-L130 HydrophobicContact CD2-CD1 4.2Å; L127-L130 PolarHBondContact O-N 3.19Å; L127-A131 WeakPolarHBondContact O-CB 3.5Å; L127-A131 PolarHBondContact O-N 3.48Å; L127-F143 HydrophobicContact CB-CD1 4.16Å; L127-F143 HydrophobicContact CB-CD2 3.95Å; L127-F143 HydrophobicContact CB-CE1 3.86Å; L127-F143 HydrophobicContact CB-CE2 3.64Å; L127-F143 HydrophobicContact CB-CG 4.21Å; L127-F143 HydrophobicContact CB-CZ 3.6Å; L127-F143 HydrophobicContact CD1-CE1 3.79Å; L127-F143 HydrophobicContact CD1-CZ 3.81Å; L127-F143 HydrophobicContact CG-CE1 4.48Å; L127-F143 HydrophobicContact CG-CZ 4.24Å
128	F	98.1	Very high	96.4	Very high	3 Å²	3	58.2 Å²	58.2	1%	0.013	28%	0.279	C	S	.	.	H	α-helix	trans	-60.9	-47.2	171.4	180	-126.9	0	0	0	111.6	N124 R125 L126 A131 H132 L140 F143 H144 L147 L157 I160	N124-F128 VanDerWaalsContact O-CB 3.22Å; N124-F128 WeakPolarHBondContact O-CB 3.45Å; N124-F128 PolarHBondContact O-N 3.27Å; R125-F128 WeakPolarHBondContact O-CB 3.33Å; R125-F128 PolarHBondContact O-N 3.3Å; L126-F128 VanDerWaalsContact C-N 3.29Å; L126-F128 PolarHBondContact O-N 2.88Å; F128-A131 PolarHBondContact O-N 2.96Å; F128-H132 PolarHBondContact O-N 3.37Å; F128-L140 HydrophobicContact CD2-CD1 3.5Å; F128-L140 HydrophobicContact CD2-CG 4.26Å; F128-L140 HydrophobicContact CE2-CD1 3.41Å; F128-L140 VanDerWaalsContact CE2-CD1 3.41Å; F128-L140 HydrophobicContact CE2-CG 3.89Å; F128-L140 HydrophobicContact CG-CD1 4.42Å; F128-L140 HydrophobicContact CZ-CD1 4.31Å; F128-L140 VanDerWaalsContact O-CD1 3.29Å; F128-L140 WeakPolarHBondContact O-CD1 3.39Å; F128-F143 HydrophobicContact CB-CB 3.84Å; F128-F143 HydrophobicContact CD2-CB 4.11Å; F128-F143 HydrophobicContact CG-CB 4.42Å; F128-H144 HydrophobicContact CD2-CB 4.42Å; F128-H144 HydrophobicContact CE2-CB 3.81Å; F128-H144 HydrophobicContact CZ-CB 4.44Å; F128-L147 HydrophobicContact CD1-CD1 4.05Å; F128-L147 HydrophobicContact CE1-CD1 3.71Å; F128-L147 HydrophobicContact CZ-CD1 4.02Å; F128-L157 HydrophobicContact CE1-CD1 4.49Å; F128-L157 HydrophobicContact CZ-CD1 4.19Å; F128-I160 HydrophobicContact CD1-CG1 3.75Å; F128-I160 HydrophobicContact CE1-CB 3.92Å; F128-I160 HydrophobicContact CE1-CD1 4.4Å; F128-I160 HydrophobicContact CE1-CG1 3.21Å; F128-I160 HydrophobicContact CE2-CG1 4.34Å; F128-I160 HydrophobicContact CZ-CB 3.94Å; F128-I160 HydrophobicContact CZ-CG1 3.55Å; F128-I160 HydrophobicContact CZ-CG2 4.04Å
129	H	98.1	Very high	96.6	Very high	26 Å²	26	58.7 Å²	58.7	12%	0.12	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-36.4	174.6	-76.3	-70.9	0	0	0	113.3	F102 R125 L126 H132 K133 I160	F102-H129 HydrophobicContact CE2-CB 3.87Å; F102-H129 HydrophobicContact CZ-CB 3.96Å; R125-H129 PolarHBondContact O-CD2 3.15Å; R125-H129 PolarHBondContact O-N 2.83Å; L126-H129 PolarHBondContact O-N 2.96Å; H129-H132 PolarHBondContact O-N 2.99Å; H129-K133 WeakPolarHBondContact O-CG 3.42Å; H129-K133 PolarHBondContact O-N 2.84Å; H129-K133 VanDerWaalsContact O-N 3.08Å; H129-I160 WeakPolarHBondContact ND1-CD1 3.49Å
130	L	98.1	Very high	96.7	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-67.1	-42.6	175.5	-77.1	166.2	0	0	0	112.4	F102 Y107 A110 E111 L126 L127 H132 K133 F134	F102-L130 HydrophobicContact CD2-CD2 3.73Å; F102-L130 HydrophobicContact CD2-CG 3.97Å; F102-L130 HydrophobicContact CE2-CD2 4.3Å; F102-L130 HydrophobicContact CE2-CG 4.42Å; Y107-L130 HydrophobicContact CD1-CD2 4.08Å; Y107-L130 HydrophobicContact CG-CD2 4.39Å; A110-L130 HydrophobicContact CB-CD1 3.98Å; A110-L130 HydrophobicContact CB-CD2 3.9Å; E111-L130 HydrophobicContact CB-CD1 4.12Å; L126-L130 HydrophobicContact CD1-CD1 4.26Å; L126-L130 HydrophobicContact CG-CD1 4.01Å; L126-L130 WeakPolarHBondContact O-CG 3.43Å; L126-L130 PolarHBondContact O-N 3.05Å; L127-L130 HydrophobicContact CD2-CD1 4.2Å; L127-L130 PolarHBondContact O-N 3.19Å; L130-H132 PolarHBondContact O-N 3.2Å; L130-K133 WeakPolarHBondContact O-CA 3.47Å; L130-K133 WeakPolarHBondContact O-CB 3.5Å; L130-K133 PolarHBondContact O-N 3.5Å; L130-F134 HydrophobicContact CB-CD2 4.48Å; L130-F134 HydrophobicContact CB-CE2 4.37Å; L130-F134 HydrophobicContact CD2-CE2 4.24Å; L130-F134 WeakPolarHBondContact O-CD2 3.41Å; L130-F134 PolarHBondContact O-N 2.99Å
131	A	97.8	Very high	96.9	Very high	1 Å²	1	51 Å²	51	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-57.2	-41.2	176	0	0	0	0	0	111.4	L127 F128 F134 N135 D136 K139 L140 F143	L127-A131 WeakPolarHBondContact O-CB 3.5Å; L127-A131 PolarHBondContact O-N 3.48Å; F128-A131 PolarHBondContact O-N 2.96Å; A131-F134 PolarHBondContact O-N 2.87Å; A131-N135 PolarHBondContact O-N 3.37Å; A131-D136 PolarHBondContact O-N 3.35Å; A131-K139 HydrophobicContact CB-CB 3.76Å; A131-L140 HydrophobicContact CB-CB 4.04Å; A131-L140 HydrophobicContact CB-CD1 4.19Å; A131-F143 HydrophobicContact CB-CD2 4.19Å; A131-F143 HydrophobicContact CB-CE2 4.46Å
132	H	96.1	Very high	97	Very high	33 Å²	33	48.9 Å²	48.9	15%	0.153	24%	0.236	C	C	.	.	H	α-helix	trans	-62	-45.1	171.8	176.1	-82.5	0	0	0	111.9	F128 H129 L130 F134 N135 L140 I160	F128-H132 PolarHBondContact O-N 3.37Å; H129-H132 PolarHBondContact O-N 2.99Å; L130-H132 PolarHBondContact O-N 3.2Å; H132-F134 PolarHBondContact O-N 3.19Å; H132-N135 PolarHBondContact O-N 2.81Å; H132-N135 VanDerWaalsContact O-N 3.1Å; H132-N135 PolarHBondContact O-OD1 3.36Å; H132-L140 HydrophobicContact CB-CD1 3.87Å; H132-I160 HydrophobicContact CB-CD1 3.7Å
133	K	94.7	Very high	97	Very high	81 Å²	81	47 Å²	47	35%	0.352	23%	0.225	S	C	.	.	H	α-helix	trans	-62.3	-27	177.6	-71.6	-62.8	-173.8	-174.6	0	113.8	F102 Y107 H129 L130	F102-K133 HydrophobicContact CE2-CG 4.08Å; Y107-K133 HydrophobicContact CD1-CG 4.36Å; Y107-K133 HydrophobicContact CE1-CD 4.37Å; Y107-K133 HydrophobicContact CE1-CG 4.13Å; Y107-K133 HydrophobicContact CE2-CD 4.4Å; Y107-K133 HydrophobicContact CG-CB 4.47Å; H129-K133 WeakPolarHBondContact O-CG 3.42Å; H129-K133 PolarHBondContact O-N 2.84Å; H129-K133 VanDerWaalsContact O-N 3.08Å; L130-K133 WeakPolarHBondContact O-CA 3.47Å; L130-K133 WeakPolarHBondContact O-CB 3.5Å; L130-K133 PolarHBondContact O-N 3.5Å
134	F	96.1	Very high	97	Very high	73 Å²	73	49.7 Å²	49.7	32%	0.32	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	1.5	176.4	-67.8	-56.9	0	0	0	114.2	K108 E111 L130 A131 H132 D136	K108-F134 HydrophobicContact CG-CE1 4.22Å; K108-F134 HydrophobicContact CG-CZ 4.18Å; E111-F134 HydrophobicContact CB-CE2 4.14Å; L130-F134 HydrophobicContact CB-CD2 4.48Å; L130-F134 HydrophobicContact CB-CE2 4.37Å; L130-F134 HydrophobicContact CD2-CE2 4.24Å; L130-F134 WeakPolarHBondContact O-CD2 3.41Å; L130-F134 PolarHBondContact O-N 2.99Å; A131-F134 PolarHBondContact O-N 2.87Å; H132-F134 PolarHBondContact O-N 3.19Å; F134-D136 PolarHBondContact O-N 3.02Å
135	N	93.8	Very high	96.9	Very high	136 Å²	136	56.4 Å²	56.4	73%	0.727	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	32.5	-171.5	-64.4	-26	0	0	0	113.1	A131 H132 E137	A131-N135 PolarHBondContact O-N 3.37Å; H132-N135 PolarHBondContact O-N 2.81Å; H132-N135 VanDerWaalsContact O-N 3.1Å; H132-N135 PolarHBondContact O-OD1 3.36Å; N135-E137 PolarHBondContact O-N 3.11Å
136	D	96.8	Very high	96.9	Very high	52 Å²	52	59.2 Å²	59.2	28%	0.278	29%	0.286	S	S	.	.			trans	-92.3	86	177.4	-171.9	-23	0	0	0	110.1	A131 F134 K138 K139 L140	A131-D136 PolarHBondContact O-N 3.35Å; F134-D136 PolarHBondContact O-N 3.02Å; D136-K138 PolarHBondContact O-N 3.43Å; D136-K138 PolarHBondContact OD1-N 3.01Å; D136-K139 HydrophobicContact CB-CB 4.19Å; D136-K139 HydrophobicContact CB-CD 4.43Å; D136-K139 PolarHBondContact O-N 2.85Å; D136-K139 PolarHBondContact OD1-N 3.39Å; D136-K139 WeakPolarHBondContact OD2-CD 3.42Å; D136-K139 WeakPolarHBondContact OD2-CE 3.33Å; D136-K139 VanDerWaalsContact OD2-CG 3.25Å; D136-K139 WeakPolarHBondContact OD2-CG 3.37Å; D136-K139 IonicContact OD2-NZ 2.69Å; D136-L140 WeakPolarHBondContact O-CB 3.45Å; D136-L140 PolarHBondContact O-N 3.44Å
137	E	95	Very high	96.8	Very high	89 Å²	89	59.9 Å²	59.9	42%	0.416	29%	0.29	S	S	.	.	H	α-helix	trans	-60.1	-31.2	-178.5	-70.4	-66.2	153.2	0	0	112.7	N135 L140 M141 R164	N135-E137 PolarHBondContact O-N 3.11Å; E137-L140 PolarHBondContact O-N 3.27Å; E137-M141 WeakPolarHBondContact O-CB 3.46Å; E137-M141 VanDerWaalsContact O-CG 3.29Å; E137-M141 WeakPolarHBondContact O-CG 3.49Å; E137-M141 PolarHBondContact O-N 3Å; E137-R164 IonicContact OE1-CZ 3.99Å; E137-R164 IonicContact OE1-NH1 3.94Å; E137-R164 PolarHBondContact OE1-NH1 3.33Å; E137-R164 IonicContact OE1-NH2 2.7Å; E137-R164 PolarHBondContact OE1-NH2 3.07Å; E137-R164 IonicContact OE2-CZ 3.57Å; E137-R164 IonicContact OE2-NH1 3.4Å; E137-R164 PolarHBondContact OE2-NH1 2.81Å; E137-R164 IonicContact OE2-NH2 3.33Å
138	K	97.5	Very high	96.7	Very high	185 Å²	185	65 Å²	65	80%	0.804	31%	0.313	S	S	*	.	H	α-helix	trans	-67.7	-49.2	179.5	-69.2	-177.6	-179	177.7	0	110.6	D136 L140 M141 S142	D136-K138 PolarHBondContact O-N 3.43Å; D136-K138 PolarHBondContact OD1-N 3.01Å; K138-L140 VanDerWaalsContact C-N 3.33Å; K138-M141 PolarHBondContact O-N 3.47Å; K138-S142 PolarHBondContact O-N 3.48Å; K138-S142 VanDerWaalsContact O-N 3.09Å
139	K	97.3	Very high	96.5	Very high	67 Å²	67	71 Å²	71	29%	0.291	35%	0.345	S	S	.	.	H	α-helix	trans	-63	-42.5	174.6	-76.5	-175.3	-172.6	173.3	0	111.2	E111 A131 D136 M141 S142 F143	E111-K139 IonicContact OE1-NZ 3.63Å; E111-K139 PolarHBondContact OE1-NZ 3.47Å; E111-K139 IonicContact OE2-NZ 2.7Å; A131-K139 HydrophobicContact CB-CB 3.76Å; D136-K139 HydrophobicContact CB-CB 4.19Å; D136-K139 HydrophobicContact CB-CD 4.43Å; D136-K139 PolarHBondContact O-N 2.85Å; D136-K139 PolarHBondContact OD1-N 3.39Å; D136-K139 WeakPolarHBondContact OD2-CD 3.42Å; D136-K139 WeakPolarHBondContact OD2-CE 3.33Å; D136-K139 VanDerWaalsContact OD2-CG 3.25Å; D136-K139 WeakPolarHBondContact OD2-CG 3.37Å; D136-K139 IonicContact OD2-NZ 2.69Å; K139-M141 VanDerWaalsContact C-N 3.33Å; K139-M141 PolarHBondContact O-N 3.16Å; K139-S142 WeakPolarHBondContact CA-OG 3.35Å; K139-S142 PolarHBondContact O-N 3.17Å; K139-S142 VanDerWaalsContact O-N 3.09Å; K139-S142 PolarHBondContact O-OG 3.3Å; K139-F143 HydrophobicContact CB-CD2 4.29Å; K139-F143 HydrophobicContact CB-CE2 3.94Å; K139-F143 HydrophobicContact CD-CE2 4.5Å; K139-F143 HydrophobicContact CG-CE2 4.43Å; K139-F143 WeakPolarHBondContact O-CD2 3.39Å; K139-F143 PolarHBondContact O-N 3.31Å
140	L	96.7	Very high	96.4	Very high	2 Å²	2	71.8 Å²	71.8	1%	0.01	35%	0.352	C	S	.	.	H	α-helix	trans	-56.5	-48.3	-179.9	-172.1	70.9	0	0	0	111.1	F128 A131 H132 D136 E137 K138 S142 F143 H144 R164	F128-L140 HydrophobicContact CD2-CD1 3.5Å; F128-L140 HydrophobicContact CD2-CG 4.26Å; F128-L140 HydrophobicContact CE2-CD1 3.41Å; F128-L140 VanDerWaalsContact CE2-CD1 3.41Å; F128-L140 HydrophobicContact CE2-CG 3.89Å; F128-L140 HydrophobicContact CG-CD1 4.42Å; F128-L140 HydrophobicContact CZ-CD1 4.31Å; F128-L140 VanDerWaalsContact O-CD1 3.29Å; F128-L140 WeakPolarHBondContact O-CD1 3.39Å; A131-L140 HydrophobicContact CB-CB 4.04Å; A131-L140 HydrophobicContact CB-CD1 4.19Å; H132-L140 HydrophobicContact CB-CD1 3.87Å; D136-L140 WeakPolarHBondContact O-CB 3.45Å; D136-L140 PolarHBondContact O-N 3.44Å; E137-L140 PolarHBondContact O-N 3.27Å; K138-L140 VanDerWaalsContact C-N 3.33Å; L140-S142 VanDerWaalsContact C-N 3.35Å; L140-S142 PolarHBondContact O-N 3.05Å; L140-F143 PolarHBondContact O-N 2.88Å; L140-H144 VanDerWaalsContact O-CB 3.28Å; L140-H144 WeakPolarHBondContact O-CB 3.36Å; L140-H144 PolarHBondContact O-N 2.91Å; L140-R164 VanDerWaalsContact CD2-NH1 3.33Å
141	M	97	Very high	96.3	Very high	82 Å²	82	73.5 Å²	73.5	40%	0.404	36%	0.362	S	S	.	.	H	α-helix	trans	-65.5	-36.6	176.9	-67.9	-55.2	108.1	0	0	112.6	E137 K138 K139 H144 Q145	E137-M141 WeakPolarHBondContact O-CB 3.46Å; E137-M141 VanDerWaalsContact O-CG 3.29Å; E137-M141 WeakPolarHBondContact O-CG 3.49Å; E137-M141 PolarHBondContact O-N 3Å; K138-M141 PolarHBondContact O-N 3.47Å; K139-M141 VanDerWaalsContact C-N 3.33Å; K139-M141 PolarHBondContact O-N 3.16Å; M141-H144 WeakPolarHBondContact O-CB 3.33Å; M141-H144 PolarHBondContact O-N 2.95Å; M141-Q145 WeakPolarHBondContact O-CG 3.44Å; M141-Q145 PolarHBondContact O-N 3.19Å; M141-Q145 VanDerWaalsContact O-N 3.15Å
142	S	97.4	Very high	96.3	Very high	48 Å²	48	78.3 Å²	78.3	34%	0.336	39%	0.385	S	S	.	.	H	α-helix	trans	-65	-41.1	177.4	76.7	0	0	0	0	112.9	K138 K139 L140 N146	K138-S142 PolarHBondContact O-N 3.48Å; K138-S142 VanDerWaalsContact O-N 3.09Å; K139-S142 WeakPolarHBondContact CA-OG 3.35Å; K139-S142 PolarHBondContact O-N 3.17Å; K139-S142 VanDerWaalsContact O-N 3.09Å; K139-S142 PolarHBondContact O-OG 3.3Å; L140-S142 VanDerWaalsContact C-N 3.35Å; L140-S142 PolarHBondContact O-N 3.05Å; S142-N146 PolarHBondContact O-ND2 2.94Å
143	F	97.5	Very high	96.4	Very high	24 Å²	24	76.9 Å²	76.9	11%	0.105	38%	0.378	C	S	.	.	H	α-helix	trans	-77.2	-30.4	177.8	-62.2	-54.1	0	0	0	112.1	F115 N124 L127 F128 A131 K139 L140 Q145 N146	F115-F143 HydrophobicContact CE1-CZ 4.3Å; F115-F143 HydrophobicContact CZ-CZ 4.19Å; N124-F143 PolarHBondContact ND2-O 3.26Å; N124-F143 WeakPolarHBondContact OD1-CD1 3.44Å; L127-F143 HydrophobicContact CB-CD1 4.16Å; L127-F143 HydrophobicContact CB-CD2 3.95Å; L127-F143 HydrophobicContact CB-CE1 3.86Å; L127-F143 HydrophobicContact CB-CE2 3.64Å; L127-F143 HydrophobicContact CB-CG 4.21Å; L127-F143 HydrophobicContact CB-CZ 3.6Å; L127-F143 HydrophobicContact CD1-CE1 3.79Å; L127-F143 HydrophobicContact CD1-CZ 3.81Å; L127-F143 HydrophobicContact CG-CE1 4.48Å; L127-F143 HydrophobicContact CG-CZ 4.24Å; F128-F143 HydrophobicContact CB-CB 3.84Å; F128-F143 HydrophobicContact CD2-CB 4.11Å; F128-F143 HydrophobicContact CG-CB 4.42Å; A131-F143 HydrophobicContact CB-CD2 4.19Å; A131-F143 HydrophobicContact CB-CE2 4.46Å; K139-F143 HydrophobicContact CB-CD2 4.29Å; K139-F143 HydrophobicContact CB-CE2 3.94Å; K139-F143 HydrophobicContact CD-CE2 4.5Å; K139-F143 HydrophobicContact CG-CE2 4.43Å; K139-F143 WeakPolarHBondContact O-CD2 3.39Å; K139-F143 PolarHBondContact O-N 3.31Å; L140-F143 PolarHBondContact O-N 2.88Å; F143-Q145 VanDerWaalsContact C-N 3.32Å; F143-Q145 PolarHBondContact O-N 2.98Å; F143-N146 PolarHBondContact O-N 3.41Å
144	H	96.8	Very high	96.5	Very high	74 Å²	74	74.1 Å²	74.1	34%	0.343	37%	0.367	S	S	.	.	H	α-helix	trans	-57.6	-43.7	171.2	176.1	-98.9	0	0	0	111.8	F128 L140 M141 N146 L147	F128-H144 HydrophobicContact CD2-CB 4.42Å; F128-H144 HydrophobicContact CE2-CB 3.81Å; F128-H144 HydrophobicContact CZ-CB 4.44Å; L140-H144 VanDerWaalsContact O-CB 3.28Å; L140-H144 WeakPolarHBondContact O-CB 3.36Å; L140-H144 PolarHBondContact O-N 2.91Å; M141-H144 WeakPolarHBondContact O-CB 3.33Å; M141-H144 PolarHBondContact O-N 2.95Å; H144-N146 PolarHBondContact O-N 3.42Å; H144-N146 VanDerWaalsContact O-N 3.15Å; H144-L147 WeakPolarHBondContact O-CB 3.35Å; H144-L147 PolarHBondContact O-N 3.28Å
145	Q	96.8	Very high	96.6	Very high	156 Å²	156	73.2 Å²	73.2	73%	0.729	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.7	178.8	-73.1	173.3	1.5	0	0	114	M141 F143	M141-Q145 WeakPolarHBondContact O-CG 3.44Å; M141-Q145 PolarHBondContact O-N 3.19Å; M141-Q145 VanDerWaalsContact O-N 3.15Å; F143-Q145 VanDerWaalsContact C-N 3.32Å; F143-Q145 PolarHBondContact O-N 2.98Å
146	N	96.6	Very high	96.8	Very high	95 Å²	95	67.5 Å²	67.5	51%	0.508	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-7.1	178.2	-61.4	-34.1	0	0	0	113.2	N124 S142 F143 H144	N124-N146 VanDerWaalsContact OD1-CB 3.29Å; N124-N146 WeakPolarHBondContact OD1-CB 3.4Å; N124-N146 PolarHBondContact OD1-ND2 3.42Å; N124-N146 VanDerWaalsContact OD1-ND2 3.12Å; S142-N146 PolarHBondContact O-ND2 2.94Å; F143-N146 PolarHBondContact O-N 3.41Å; H144-N146 PolarHBondContact O-N 3.42Å; H144-N146 VanDerWaalsContact O-N 3.15Å
147	L	96.9	Very high	96.9	Very high	25 Å²	25	66 Å²	66	13%	0.131	33%	0.328	C	S	.	.			trans	-70	140.2	175.7	-62.3	177.4	0	0	0	109.8	R125 F128 H144 D153 L157	R125-L147 HydrophobicContact CG-CD2 4.23Å; F128-L147 HydrophobicContact CD1-CD1 4.05Å; F128-L147 HydrophobicContact CE1-CD1 3.71Å; F128-L147 HydrophobicContact CZ-CD1 4.02Å; H144-L147 WeakPolarHBondContact O-CB 3.35Å; H144-L147 PolarHBondContact O-N 3.28Å; L147-D153 HydrophobicContact CB-CB 4.33Å; L147-D153 HydrophobicContact CD2-CB 4.07Å; L147-L157 HydrophobicContact CD1-CB 4.23Å; L147-L157 HydrophobicContact CD1-CD1 4.36Å
148	Q	95.6	Very high	97	Very high	113 Å²	113	61.8 Å²	61.8	53%	0.528	31%	0.308	S	S	.	.			trans	-114.7	173.3	178.5	-50.3	173.4	2.9	0	0	110.7	V150 D153 Q154	Q148-V150 PolarHBondContact O-N 3.09Å; Q148-D153 PolarHBondContact N-OD2 3.23Å; Q148-D153 VanDerWaalsContact N-OD2 3.08Å; Q148-D153 WeakPolarHBondContact O-CB 3.44Å; Q148-Q154 PolarHBondContact O-NE2 3.26Å
149	D	94.3	Very high	97	Very high	128 Å²	128	54.3 Å²	54.3	68%	0.684	28%	0.279	S	S	*	.	S	Bend	trans	-81	68.4	176	-162.9	25.6	0	0	0	111.5
150	V	96.1	Very high	97	Very high	42 Å²	42	51.4 Å²	51.4	26%	0.255	27%	0.266	S	S	.	.	S	Bend	trans	-129.6	158.3	165.2	-51.2	0	0	0	0	110.5	R121 Q148 E152 D153 Q154	R121-V150 VanDerWaalsContact NH1-CG1 3.34Å; Q148-V150 PolarHBondContact O-N 3.09Å; V150-E152 WeakPolarHBondContact CG2-OE2 3.19Å; V150-E152 PolarHBondContact O-N 2.9Å; V150-D153 HydrophobicContact CG2-CB 4.11Å; V150-D153 PolarHBondContact O-N 2.86Å; V150-Q154 VanDerWaalsContact O-CG 3.31Å; V150-Q154 WeakPolarHBondContact O-CG 3.39Å; V150-Q154 PolarHBondContact O-N 3.36Å
151	T	96.4	Very high	97	Very high	37 Å²	37	53.3 Å²	53.3	23%	0.227	28%	0.275	C	S	.	.	H	α-helix	trans	-46.3	-54.2	-176.1	-52.5	0	0	0	0	113.5	D153 Q154 L155 I177 Y184	T151-D153 PolarHBondContact O-N 2.85Å; T151-Q154 PolarHBondContact O-N 3.22Å; T151-L155 HydrophobicContact CG2-CD1 3.87Å; T151-L155 HydrophobicContact CG2-CG 4.3Å; T151-L155 WeakPolarHBondContact O-CB 3.29Å; T151-L155 VanDerWaalsContact O-CG 3.22Å; T151-L155 WeakPolarHBondContact O-CG 3.2Å; T151-L155 PolarHBondContact O-N 3.47Å; T151-I177 HydrophobicContact CG2-CG2 4.27Å; T151-Y184 HydrophobicContact CG2-CE2 3.78Å
152	E	96.6	Very high	97	Very high	103 Å²	103	51.9 Å²	51.9	48%	0.481	27%	0.265	S	S	.	.	H	α-helix	trans	-67.5	-35.6	-173.6	-60.2	87.6	165.6	0	0	113.3	R125 V150 S156	R125-E152 WeakPolarHBondContact CD-O 3.38Å; R125-E152 VanDerWaalsContact CZ-CB 3.46Å; V150-E152 WeakPolarHBondContact CG2-OE2 3.19Å; V150-E152 PolarHBondContact O-N 2.9Å; E152-S156 PolarHBondContact O-N 3.08Å; E152-S156 VanDerWaalsContact O-N 3.12Å; E152-S156 PolarHBondContact O-OG 3.32Å
153	D	98.2	Very high	96.7	Very high	3 Å²	3	52 Å²	52	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-70.9	-43.1	176.6	-71	-4.6	0	0	0	110.1	R121 R125 L147 Q148 V150 T151 S156 L157	R121-D153 IonicContact CZ-OD2 3.57Å; R121-D153 IonicContact NE-OD2 3.49Å; R121-D153 PolarHBondContact NE-OD2 3.25Å; R121-D153 IonicContact NH2-OD2 2.75Å; R121-D153 PolarHBondContact NH2-OD2 2.91Å; R125-D153 VanDerWaalsContact CD-OD1 3.28Å; R125-D153 WeakPolarHBondContact CD-OD1 3.46Å; R125-D153 WeakPolarHBondContact CG-OD1 3.34Å; R125-D153 IonicContact CZ-OD1 3.63Å; R125-D153 IonicContact NE-OD1 2.85Å; R125-D153 IonicContact NH1-OD1 2.78Å; R125-D153 PolarHBondContact NH1-OD1 3.29Å; L147-D153 HydrophobicContact CB-CB 4.33Å; L147-D153 HydrophobicContact CD2-CB 4.07Å; Q148-D153 PolarHBondContact N-OD2 3.23Å; Q148-D153 VanDerWaalsContact N-OD2 3.08Å; Q148-D153 WeakPolarHBondContact O-CB 3.44Å; V150-D153 HydrophobicContact CG2-CB 4.11Å; V150-D153 PolarHBondContact O-N 2.86Å; T151-D153 PolarHBondContact O-N 2.85Å; D153-S156 WeakPolarHBondContact O-CB 3.48Å; D153-S156 PolarHBondContact O-N 3.37Å; D153-L157 WeakPolarHBondContact O-CB 2.82Å; D153-L157 PolarHBondContact O-N 3.4Å
154	Q	98.1	Very high	96.4	Very high	22 Å²	22	55 Å²	55	10%	0.103	27%	0.272	C	S	.	.	H	α-helix	trans	-65	-39	176.6	-64.7	-54.4	-54.8	0	0	112	Q148 V150 T151 S156 L157 A158 I173 I177	Q148-Q154 PolarHBondContact O-NE2 3.26Å; V150-Q154 VanDerWaalsContact O-CG 3.31Å; V150-Q154 WeakPolarHBondContact O-CG 3.39Å; V150-Q154 PolarHBondContact O-N 3.36Å; T151-Q154 PolarHBondContact O-N 3.22Å; Q154-S156 VanDerWaalsContact C-N 3.33Å; Q154-S156 PolarHBondContact O-N 3.23Å; Q154-L157 WeakPolarHBondContact O-CB 3.28Å; Q154-L157 PolarHBondContact O-N 3.42Å; Q154-A158 WeakPolarHBondContact O-CB 3.29Å; Q154-A158 PolarHBondContact O-N 3.11Å; Q154-I173 HydrophobicContact CB-CG2 3.92Å; Q154-I173 WeakPolarHBondContact O-CG2 3.4Å; Q154-I177 HydrophobicContact CB-CD1 3.92Å
155	L	98	Very high	96.1	Very high	54 Å²	54	54.3 Å²	54.3	28%	0.283	28%	0.275	S	S	.	.	H	α-helix	trans	-64.8	-37.1	174.2	-70.7	175.6	0	0	0	112.4	T151 S159 Y174 I177 L187	T151-L155 HydrophobicContact CG2-CD1 3.87Å; T151-L155 HydrophobicContact CG2-CG 4.3Å; T151-L155 WeakPolarHBondContact O-CB 3.29Å; T151-L155 VanDerWaalsContact O-CG 3.22Å; T151-L155 WeakPolarHBondContact O-CG 3.2Å; T151-L155 PolarHBondContact O-N 3.47Å; L155-S159 WeakPolarHBondContact O-CB 3.45Å; L155-S159 PolarHBondContact O-N 2.74Å; L155-Y174 HydrophobicContact CD2-CD1 3.94Å; L155-Y174 HydrophobicContact CD2-CE1 3.86Å; L155-I177 HydrophobicContact CD2-CD1 3.66Å; L155-I177 HydrophobicContact CG-CD1 3.95Å; L155-L187 HydrophobicContact CD2-CD1 4.4Å; L155-L187 HydrophobicContact CD2-CD2 3.5Å
156	S	97.9	Very high	96	Very high	16 Å²	16	50.4 Å²	50.4	11%	0.112	26%	0.257	C	S	.	.	H	α-helix	trans	-67.1	-41.8	175.1	-57.2	0	0	0	0	111.3	R125 E152 D153 Q154 S159 I160	R125-S156 WeakPolarHBondContact CD-OG 3.47Å; E152-S156 PolarHBondContact O-N 3.08Å; E152-S156 VanDerWaalsContact O-N 3.12Å; E152-S156 PolarHBondContact O-OG 3.32Å; D153-S156 WeakPolarHBondContact O-CB 3.48Å; D153-S156 PolarHBondContact O-N 3.37Å; Q154-S156 VanDerWaalsContact C-N 3.33Å; Q154-S156 PolarHBondContact O-N 3.23Å; S156-S159 PolarHBondContact O-N 3.39Å; S156-I160 PolarHBondContact O-N 3.04Å
157	L	98	Very high	95.9	Very high	22 Å²	22	47.5 Å²	47.5	12%	0.115	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-49.6	173.7	-177.9	56.9	0	0	0	111.8	F128 L147 D153 Q154 S159 I160 H161 I173	F128-L157 HydrophobicContact CE1-CD1 4.49Å; F128-L157 HydrophobicContact CZ-CD1 4.19Å; L147-L157 HydrophobicContact CD1-CB 4.23Å; L147-L157 HydrophobicContact CD1-CD1 4.36Å; D153-L157 WeakPolarHBondContact O-CB 2.82Å; D153-L157 PolarHBondContact O-N 3.4Å; Q154-L157 WeakPolarHBondContact O-CB 3.28Å; Q154-L157 PolarHBondContact O-N 3.42Å; L157-S159 VanDerWaalsContact C-N 3.26Å; L157-S159 PolarHBondContact O-N 3.01Å; L157-I160 PolarHBondContact O-N 3.15Å; L157-I160 VanDerWaalsContact O-N 3.11Å; L157-H161 PolarHBondContact O-CD2 2.84Å; L157-H161 VanDerWaalsContact O-CD2 3.27Å; L157-H161 PolarHBondContact O-N 3.09Å; L157-I173 HydrophobicContact CB-CD1 4.33Å; L157-I173 HydrophobicContact CD2-CD1 3.99Å; L157-I173 HydrophobicContact CG-CD1 3.84Å
158	A	98.1	Very high	95.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.7	-38.6	176.4	0	0	0	0	0	112.1	Q154 H161 Y162 A170 I173 Y174	Q154-A158 WeakPolarHBondContact O-CB 3.29Å; Q154-A158 PolarHBondContact O-N 3.11Å; A158-H161 PolarHBondContact O-N 3.46Å; A158-Y162 PolarHBondContact O-N 3.39Å; A158-A170 WeakPolarHBondContact O-CB 3.46Å; A158-I173 HydrophobicContact CB-CB 3.95Å; A158-I173 HydrophobicContact CB-CD1 4.08Å; A158-I173 HydrophobicContact CB-CG2 3.84Å; A158-Y174 HydrophobicContact CB-CD1 4.02Å; A158-Y174 HydrophobicContact CB-CE1 3.47Å; A158-Y174 VanDerWaalsContact CB-CE1 3.47Å; A158-Y174 HydrophobicContact CB-CE2 4.14Å
159	S	97.2	Very high	96	Very high	27 Å²	27	48.8 Å²	48.8	19%	0.189	25%	0.245	C	C	.	.	H	α-helix	trans	-64.9	-39.7	175	175.6	0	0	0	0	112.8	L155 S156 L157 Y162 M163	L155-S159 WeakPolarHBondContact O-CB 3.45Å; L155-S159 PolarHBondContact O-N 2.74Å; S156-S159 PolarHBondContact O-N 3.39Å; L157-S159 VanDerWaalsContact C-N 3.26Å; L157-S159 PolarHBondContact O-N 3.01Å; S159-Y162 PolarHBondContact O-N 2.79Å; S159-M163 WeakPolarHBondContact O-CG 3.47Å; S159-M163 PolarHBondContact O-N 3Å
160	I	97.2	Very high	96.1	Very high	6 Å²	6	42.7 Å²	42.7	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-65.7	-43.4	173.1	-68.9	-53	0	0	0	110.8	F128 H129 H132 S156 L157 Y162 M163 R164	F128-I160 HydrophobicContact CD1-CG1 3.75Å; F128-I160 HydrophobicContact CE1-CB 3.92Å; F128-I160 HydrophobicContact CE1-CD1 4.4Å; F128-I160 HydrophobicContact CE1-CG1 3.21Å; F128-I160 HydrophobicContact CE2-CG1 4.34Å; F128-I160 HydrophobicContact CZ-CB 3.94Å; F128-I160 HydrophobicContact CZ-CG1 3.55Å; F128-I160 HydrophobicContact CZ-CG2 4.04Å; H129-I160 WeakPolarHBondContact ND1-CD1 3.49Å; H132-I160 HydrophobicContact CB-CD1 3.7Å; S156-I160 PolarHBondContact O-N 3.04Å; L157-I160 PolarHBondContact O-N 3.15Å; L157-I160 VanDerWaalsContact O-N 3.11Å; I160-Y162 VanDerWaalsContact C-N 3.33Å; I160-Y162 PolarHBondContact O-N 3.26Å; I160-M163 HydrophobicContact CD1-CE 3.36Å; I160-M163 HydrophobicContact CG1-CE 4.45Å; I160-M163 PolarHBondContact O-N 3.39Å; I160-M163 VanDerWaalsContact O-N 3.16Å; I160-R164 HydrophobicContact CG2-CG 4.25Å; I160-R164 WeakPolarHBondContact O-CB 3.4Å; I160-R164 WeakPolarHBondContact O-CG 3.25Å; I160-R164 PolarHBondContact O-N 3.37Å
161	H	96.8	Very high	96.2	Very high	42 Å²	42	40.7 Å²	40.7	19%	0.194	20%	0.2	C	C	.	.	H	α-helix	trans	-55.4	-49.2	174.4	-82.8	-70.2	0	0	0	111.4	L157 A158 M163 R164 S165 H166 E169 A170	L157-H161 PolarHBondContact O-CD2 2.84Å; L157-H161 VanDerWaalsContact O-CD2 3.27Å; L157-H161 PolarHBondContact O-N 3.09Å; A158-H161 PolarHBondContact O-N 3.46Å; H161-M163 PolarHBondContact O-N 2.94Å; H161-R164 CarbonylContact O-C 3.51Å; H161-R164 PolarHBondContact O-N 3.17Å; H161-S165 PolarHBondContact O-N 2.93Å; H161-H166 HydrophobicContact CB-CB 4.05Å; H161-H166 AromaticContact ND1-ND1 3.72Å; H161-H166 WeakPolarHBondContact O-CA 3.22Å; H161-H166 WeakPolarHBondContact O-CB 3.46Å; H161-H166 PolarHBondContact O-N 3.37Å; H161-E169 HydrophobicContact CB-CB 4.3Å; H161-E169 WeakPolarHBondContact ND1-CB 3.44Å; H161-A170 HydrophobicContact CB-CB 3.99Å
162	Y	95.8	Very high	96.3	Very high	52 Å²	52	43.1 Å²	43.1	20%	0.204	21%	0.211	C	C	.	.	H	α-helix	trans	-56.9	-46.3	175	178.5	-84.7	0	0	0	112.3	A158 S159 I160 R164 S165 Y167 L193 K197	A158-Y162 PolarHBondContact O-N 3.39Å; S159-Y162 PolarHBondContact O-N 2.79Å; I160-Y162 VanDerWaalsContact C-N 3.33Å; I160-Y162 PolarHBondContact O-N 3.26Å; Y162-R164 VanDerWaalsContact C-N 3.29Å; Y162-R164 PolarHBondContact O-N 3.34Å; Y162-S165 PolarHBondContact O-N 2.88Å; Y162-S165 VanDerWaalsContact O-N 3.08Å; Y162-Y167 AromaticContact CD2-CD1 3.72Å; Y162-Y167 HydrophobicContact CD2-CD1 3.72Å; Y162-Y167 AromaticContact CD2-CE1 3.85Å; Y162-Y167 HydrophobicContact CD2-CE1 3.85Å; Y162-Y167 AromaticContact CE2-CD1 4Å; Y162-Y167 HydrophobicContact CE2-CD1 4Å; Y162-Y167 AromaticContact CE2-CE1 3.84Å; Y162-Y167 HydrophobicContact CE2-CE1 3.84Å; Y162-Y167 HydrophobicContact CG-CD1 4.4Å; Y162-Y167 HydrophobicContact CG-CE1 4.32Å; Y162-Y167 WeakPolarHBondContact O-CE1 3.27Å; Y162-L193 HydrophobicContact CE2-CB 4.33Å; Y162-K197 HydrophobicContact CE2-CG 4.23Å
163	M	92.2	Very high	96.4	Very high	52 Å²	52	39 Å²	39	26%	0.256	19%	0.192	S	C	.	.	H	α-helix	trans	-68.3	-26.9	-179.4	-73.3	-170.7	-64.1	0	0	113.5	S159 I160 H161 S165	S159-M163 WeakPolarHBondContact O-CG 3.47Å; S159-M163 PolarHBondContact O-N 3Å; I160-M163 HydrophobicContact CD1-CE 3.36Å; I160-M163 HydrophobicContact CG1-CE 4.45Å; I160-M163 PolarHBondContact O-N 3.39Å; I160-M163 VanDerWaalsContact O-N 3.16Å; H161-M163 PolarHBondContact O-N 2.94Å; M163-S165 VanDerWaalsContact C-N 3.26Å
164	R	91.6	Very high	96.4	Very high	87 Å²	87	39.3 Å²	39.3	33%	0.328	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	10.3	172.4	-66.3	-176.4	69.4	145.8	10.9	113.1	E137 L140 I160 H161 Y162 H166	E137-R164 IonicContact OE1-CZ 3.99Å; E137-R164 IonicContact OE1-NH1 3.94Å; E137-R164 PolarHBondContact OE1-NH1 3.33Å; E137-R164 IonicContact OE1-NH2 2.7Å; E137-R164 PolarHBondContact OE1-NH2 3.07Å; E137-R164 IonicContact OE2-CZ 3.57Å; E137-R164 IonicContact OE2-NH1 3.4Å; E137-R164 PolarHBondContact OE2-NH1 2.81Å; E137-R164 IonicContact OE2-NH2 3.33Å; L140-R164 VanDerWaalsContact CD2-NH1 3.33Å; I160-R164 HydrophobicContact CG2-CG 4.25Å; I160-R164 WeakPolarHBondContact O-CB 3.4Å; I160-R164 WeakPolarHBondContact O-CG 3.25Å; I160-R164 PolarHBondContact O-N 3.37Å; H161-R164 CarbonylContact O-C 3.51Å; H161-R164 PolarHBondContact O-N 3.17Å; Y162-R164 VanDerWaalsContact C-N 3.29Å; Y162-R164 PolarHBondContact O-N 3.34Å; R164-H166 PolarHBondContact O-CD2 2.94Å; R164-H166 PolarHBondContact O-N 3.4Å
165	S	90.7	Very high	96.4	Very high	58 Å²	58	42.5 Å²	42.5	41%	0.406	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	17.9	-175.7	-53.8	0	0	0	0	115.3	H161 Y162 M163 Y167	H161-S165 PolarHBondContact O-N 2.93Å; Y162-S165 PolarHBondContact O-N 2.88Å; Y162-S165 VanDerWaalsContact O-N 3.08Å; M163-S165 VanDerWaalsContact C-N 3.26Å; S165-Y167 WeakPolarHBondContact O-CD2 3.09Å; S165-Y167 PolarHBondContact O-N 3.33Å; S165-Y167 VanDerWaalsContact O-N 3.08Å; S165-Y167 PolarHBondContact OG-OH 3.41Å
166	H	93.7	Very high	96.3	Very high	75 Å²	75	45.1 Å²	45.1	35%	0.347	21%	0.213	S	C	.	.			trans	-84.7	64.8	171.7	-60.2	165.7	0	0	0	109.4	H161 R164 Q168 E169 A170	H161-H166 HydrophobicContact CB-CB 4.05Å; H161-H166 AromaticContact ND1-ND1 3.72Å; H161-H166 WeakPolarHBondContact O-CA 3.22Å; H161-H166 WeakPolarHBondContact O-CB 3.46Å; H161-H166 PolarHBondContact O-N 3.37Å; R164-H166 PolarHBondContact O-CD2 2.94Å; R164-H166 PolarHBondContact O-N 3.4Å; H166-Q168 VanDerWaalsContact C-N 3.35Å; H166-Q168 PolarHBondContact O-N 3.15Å; H166-E169 VanDerWaalsContact C-OE2 3.25Å; H166-E169 WeakPolarHBondContact CA-OE2 3.28Å; H166-E169 HydrophobicContact CB-CB 4.42Å; H166-E169 WeakPolarHBondContact CB-OE2 3.43Å; H166-A170 PolarHBondContact O-N 2.76Å
167	Y	95.3	Very high	96.3	Very high	34 Å²	34	44.9 Å²	44.9	13%	0.133	21%	0.21	C	C	.	.	H	α-helix	trans	-68.7	-32.6	-169.3	-56.8	-63	0	0	0	113.1	Y162 S165 A170 I171 K197 L198	Y162-Y167 AromaticContact CD2-CD1 3.72Å; Y162-Y167 HydrophobicContact CD2-CD1 3.72Å; Y162-Y167 AromaticContact CD2-CE1 3.85Å; Y162-Y167 HydrophobicContact CD2-CE1 3.85Å; Y162-Y167 AromaticContact CE2-CD1 4Å; Y162-Y167 HydrophobicContact CE2-CD1 4Å; Y162-Y167 AromaticContact CE2-CE1 3.84Å; Y162-Y167 HydrophobicContact CE2-CE1 3.84Å; Y162-Y167 HydrophobicContact CG-CD1 4.4Å; Y162-Y167 HydrophobicContact CG-CE1 4.32Å; Y162-Y167 WeakPolarHBondContact O-CE1 3.27Å; S165-Y167 WeakPolarHBondContact O-CD2 3.09Å; S165-Y167 PolarHBondContact O-N 3.33Å; S165-Y167 VanDerWaalsContact O-N 3.08Å; S165-Y167 PolarHBondContact OG-OH 3.41Å; Y167-A170 PolarHBondContact O-N 2.87Å; Y167-I171 WeakPolarHBondContact O-CD1 3.14Å; Y167-I171 VanDerWaalsContact O-CG1 3.24Å; Y167-I171 WeakPolarHBondContact O-CG1 3.37Å; Y167-I171 PolarHBondContact O-N 3.46Å; Y167-K197 HydrophobicContact CD1-CB 3.89Å; Y167-K197 HydrophobicContact CD1-CG 4.44Å; Y167-K197 HydrophobicContact CD2-CB 3.98Å; Y167-K197 HydrophobicContact CE1-CB 3.61Å; Y167-K197 HydrophobicContact CE1-CG 3.84Å; Y167-K197 HydrophobicContact CE2-CB 3.72Å; Y167-K197 HydrophobicContact CG-CB 4.06Å; Y167-L198 HydrophobicContact CD2-CD2 3.97Å; Y167-L198 HydrophobicContact CD2-CG 4.24Å; Y167-L198 HydrophobicContact CG-CD2 4.42Å; Y167-L198 HydrophobicContact CG-CG 4.34Å
168	Q	95.9	Very high	96.2	Very high	80 Å²	80	45.1 Å²	45.1	37%	0.374	21%	0.212	S	C	.	.	H	α-helix	trans	-67.1	-43.6	-179.9	-174.1	56.6	53.2	0	0	111.1	H166 A170 I171 D172	H166-Q168 VanDerWaalsContact C-N 3.35Å; H166-Q168 PolarHBondContact O-N 3.15Å; Q168-A170 VanDerWaalsContact C-N 3.32Å; Q168-A170 PolarHBondContact O-N 2.84Å; Q168-I171 WeakPolarHBondContact O-CB 3.46Å; Q168-I171 PolarHBondContact O-N 2.98Å; Q168-I171 VanDerWaalsContact O-N 3.15Å; Q168-D172 PolarHBondContact NE2-OD1 2.98Å; Q168-D172 VanDerWaalsContact O-CG 3.22Å; Q168-D172 PolarHBondContact O-N 3.45Å
169	E	97.3	Very high	96.1	Very high	85 Å²	85	51.7 Å²	51.7	40%	0.397	25%	0.246	S	C	.	.	H	α-helix	trans	-63.7	-38.8	176.5	-63.7	86.1	160.3	0	0	111.4	H161 H166 D172 I173	H161-E169 HydrophobicContact CB-CB 4.3Å; H161-E169 WeakPolarHBondContact ND1-CB 3.44Å; H166-E169 VanDerWaalsContact C-OE2 3.25Å; H166-E169 WeakPolarHBondContact CA-OE2 3.28Å; H166-E169 HydrophobicContact CB-CB 4.42Å; H166-E169 WeakPolarHBondContact CB-OE2 3.43Å; E169-D172 PolarHBondContact O-N 3.43Å; E169-I173 WeakPolarHBondContact O-CG1 3.14Å; E169-I173 PolarHBondContact O-N 3.15Å
170	A	98.2	Very high	96	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.8	-44.5	172.8	0	0	0	0	0	111.7	A158 H161 H166 Y167 Q168 D172 I173 Y174	A158-A170 WeakPolarHBondContact O-CB 3.46Å; H161-A170 HydrophobicContact CB-CB 3.99Å; H166-A170 PolarHBondContact O-N 2.76Å; Y167-A170 PolarHBondContact O-N 2.87Å; Q168-A170 VanDerWaalsContact C-N 3.32Å; Q168-A170 PolarHBondContact O-N 2.84Å; A170-D172 PolarHBondContact O-N 2.96Å; A170-I173 PolarHBondContact O-N 3.26Å; A170-Y174 HydrophobicContact CB-CD2 4.48Å; A170-Y174 HydrophobicContact CB-CE2 4.05Å; A170-Y174 WeakPolarHBondContact O-CD2 3.31Å; A170-Y174 VanDerWaalsContact O-CG 3.32Å; A170-Y174 PolarHBondContact O-N 2.9Å
171	I	98.2	Very high	95.9	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.7	-46.7	176.2	-71.9	162.3	0	0	0	110.9	Y167 Q168 I173 Y174 K175 V191 C194 Y195 L198	Y167-I171 WeakPolarHBondContact O-CD1 3.14Å; Y167-I171 VanDerWaalsContact O-CG1 3.24Å; Y167-I171 WeakPolarHBondContact O-CG1 3.37Å; Y167-I171 PolarHBondContact O-N 3.46Å; Q168-I171 WeakPolarHBondContact O-CB 3.46Å; Q168-I171 PolarHBondContact O-N 2.98Å; Q168-I171 VanDerWaalsContact O-N 3.15Å; I171-I173 VanDerWaalsContact C-N 3.31Å; I171-I173 PolarHBondContact O-N 3.4Å; I171-Y174 PolarHBondContact O-N 2.92Å; I171-K175 HydrophobicContact CG2-CD 3.77Å; I171-K175 HydrophobicContact CG2-CG 4.08Å; I171-K175 WeakPolarHBondContact O-CB 3.48Å; I171-K175 WeakPolarHBondContact O-CG 3.3Å; I171-K175 PolarHBondContact O-N 3.15Å; I171-V191 HydrophobicContact CG2-CG1 4.47Å; I171-C194 HydrophobicContact CD1-CB 3.55Å; I171-C194 HydrophobicContact CG1-CB 3.3Å; I171-Y195 HydrophobicContact CD1-CD1 3.8Å; I171-Y195 HydrophobicContact CD1-CE1 3.73Å; I171-Y195 HydrophobicContact CD1-CG 4.27Å; I171-L198 HydrophobicContact CD1-CD1 3.63Å
172	D	98.2	Very high	95.7	Very high	88 Å²	88	65.9 Å²	65.9	47%	0.471	31%	0.306	S	S	.	.	H	α-helix	trans	-61.3	-41.9	-177	-66.6	-16.9	0	0	0	111.1	Q168 E169 A170 R176	Q168-D172 PolarHBondContact NE2-OD1 2.98Å; Q168-D172 VanDerWaalsContact O-CG 3.22Å; Q168-D172 PolarHBondContact O-N 3.45Å; E169-D172 PolarHBondContact O-N 3.43Å; A170-D172 PolarHBondContact O-N 2.96Å; D172-R176 WeakPolarHBondContact O-CB 3.49Å; D172-R176 PolarHBondContact O-N 3.38Å
173	I	98.1	Very high	95.6	Very high	15 Å²	15	69.3 Å²	69.3	8%	0.077	32%	0.324	C	S	.	.	H	α-helix	trans	-64.6	-49.3	174.8	-64	166.5	0	0	0	111.1	Q154 L157 A158 E169 A170 I171 K175 R176 I177	Q154-I173 HydrophobicContact CB-CG2 3.92Å; Q154-I173 WeakPolarHBondContact O-CG2 3.4Å; L157-I173 HydrophobicContact CB-CD1 4.33Å; L157-I173 HydrophobicContact CD2-CD1 3.99Å; L157-I173 HydrophobicContact CG-CD1 3.84Å; A158-I173 HydrophobicContact CB-CB 3.95Å; A158-I173 HydrophobicContact CB-CD1 4.08Å; A158-I173 HydrophobicContact CB-CG2 3.84Å; E169-I173 WeakPolarHBondContact O-CG1 3.14Å; E169-I173 PolarHBondContact O-N 3.15Å; A170-I173 PolarHBondContact O-N 3.26Å; I171-I173 VanDerWaalsContact C-N 3.31Å; I171-I173 PolarHBondContact O-N 3.4Å; I173-K175 PolarHBondContact O-N 3.4Å; I173-R176 PolarHBondContact O-N 2.99Å; I173-I177 HydrophobicContact CG2-CD1 3.93Å; I173-I177 WeakPolarHBondContact O-CG1 3.39Å; I173-I177 PolarHBondContact O-N 3.48Å
174	Y	98.3	Very high	95.7	Very high	11 Å²	11	71.3 Å²	71.3	4%	0.043	33%	0.329	C	S	.	.	H	α-helix	trans	-62	-42.7	-179.2	-67.2	-44.2	0	0	0	112.4	L155 A158 A170 I171 I177 L178 L187 V191	L155-Y174 HydrophobicContact CD2-CD1 3.94Å; L155-Y174 HydrophobicContact CD2-CE1 3.86Å; A158-Y174 HydrophobicContact CB-CD1 4.02Å; A158-Y174 HydrophobicContact CB-CE1 3.47Å; A158-Y174 VanDerWaalsContact CB-CE1 3.47Å; A158-Y174 HydrophobicContact CB-CE2 4.14Å; A170-Y174 HydrophobicContact CB-CD2 4.48Å; A170-Y174 HydrophobicContact CB-CE2 4.05Å; A170-Y174 WeakPolarHBondContact O-CD2 3.31Å; A170-Y174 VanDerWaalsContact O-CG 3.32Å; A170-Y174 PolarHBondContact O-N 2.9Å; I171-Y174 PolarHBondContact O-N 2.92Å; Y174-I177 PolarHBondContact O-N 3.35Å; Y174-L178 WeakPolarHBondContact O-CB 3.32Å; Y174-L178 WeakPolarHBondContact O-CG 3.13Å; Y174-L178 PolarHBondContact O-N 3Å; Y174-L187 HydrophobicContact CD1-CD2 3.95Å; Y174-L187 HydrophobicContact CE1-CD2 4.31Å; Y174-V191 VanDerWaalsContact CB-CG2 3.46Å; Y174-V191 HydrophobicContact CD2-CG2 4.22Å; Y174-V191 HydrophobicContact CG-CG2 4.22Å
175	K	97.1	Very high	95.9	Very high	89 Å²	89	69.7 Å²	69.7	39%	0.387	33%	0.326	S	S	.	.	H	α-helix	trans	-63.8	-43.9	177.1	-77.3	-174.4	176	-175.3	0	111.6	I171 I173 I177 L178 L179 Y195	I171-K175 HydrophobicContact CG2-CD 3.77Å; I171-K175 HydrophobicContact CG2-CG 4.08Å; I171-K175 WeakPolarHBondContact O-CB 3.48Å; I171-K175 WeakPolarHBondContact O-CG 3.3Å; I171-K175 PolarHBondContact O-N 3.15Å; I173-K175 PolarHBondContact O-N 3.4Å; K175-I177 VanDerWaalsContact C-N 3.33Å; K175-I177 PolarHBondContact O-N 3.2Å; K175-L178 PolarHBondContact O-N 2.86Å; K175-L179 WeakPolarHBondContact O-CG 3.43Å; K175-L179 PolarHBondContact O-N 3.44Å; K175-Y195 WeakPolarHBondContact CE-OH 3.5Å; K175-Y195 PolarHBondContact NZ-OH 2.67Å
176	R	97.4	Very high	96.1	Very high	109 Å²	109	69.1 Å²	69.1	41%	0.411	33%	0.326	S	S	.	.	H	α-helix	trans	-57.7	-46.5	175.9	-175.9	178.4	59.6	179.7	-2.2	111.3	D172 I173 L178 L179	D172-R176 WeakPolarHBondContact O-CB 3.49Å; D172-R176 PolarHBondContact O-N 3.38Å; I173-R176 PolarHBondContact O-N 2.99Å; R176-L178 VanDerWaalsContact C-N 3.33Å; R176-L178 PolarHBondContact O-N 3.47Å; R176-L179 WeakPolarHBondContact O-CB 3.39Å; R176-L179 PolarHBondContact O-N 2.83Å
177	I	97.7	Very high	96.2	Very high	11 Å²	11	66.1 Å²	66.1	6%	0.056	31%	0.312	C	S	.	.	H	α-helix	trans	-62.8	-40.3	177.1	-64.5	169.2	0	0	0	111.5	T151 Q154 L155 I173 Y174 K175 L179 D180 N181 Y184 L187	T151-I177 HydrophobicContact CG2-CG2 4.27Å; Q154-I177 HydrophobicContact CB-CD1 3.92Å; L155-I177 HydrophobicContact CD2-CD1 3.66Å; L155-I177 HydrophobicContact CG-CD1 3.95Å; I173-I177 HydrophobicContact CG2-CD1 3.93Å; I173-I177 WeakPolarHBondContact O-CG1 3.39Å; I173-I177 PolarHBondContact O-N 3.48Å; Y174-I177 PolarHBondContact O-N 3.35Å; K175-I177 VanDerWaalsContact C-N 3.33Å; K175-I177 PolarHBondContact O-N 3.2Å; I177-L179 VanDerWaalsContact C-N 3.3Å; I177-L179 PolarHBondContact O-N 3.47Å; I177-D180 PolarHBondContact O-N 3.29Å; I177-N181 PolarHBondContact O-N 3Å; I177-N181 PolarHBondContact O-ND2 3.31Å; I177-Y184 HydrophobicContact CG2-CD2 3.88Å; I177-Y184 HydrophobicContact CG2-CE2 4.25Å; I177-L187 HydrophobicContact CB-CD1 4.09Å; I177-L187 HydrophobicContact CG2-CD1 3.58Å
178	L	96.2	Very high	96.3	Very high	27 Å²	27	65.7 Å²	65.7	14%	0.141	31%	0.312	C	S	.	.	H	α-helix	trans	-66.7	-26.7	179	-85.7	165.7	0	0	0	114	Y174 K175 R176 D180 L187 V191	Y174-L178 WeakPolarHBondContact O-CB 3.32Å; Y174-L178 WeakPolarHBondContact O-CG 3.13Å; Y174-L178 PolarHBondContact O-N 3Å; K175-L178 PolarHBondContact O-N 2.86Å; R176-L178 VanDerWaalsContact C-N 3.33Å; R176-L178 PolarHBondContact O-N 3.47Å; L178-D180 VanDerWaalsContact C-N 3.34Å; L178-L187 HydrophobicContact CD1-CB 3.72Å; L178-L187 HydrophobicContact CD2-CB 3.96Å; L178-L187 HydrophobicContact CD2-CD1 4.36Å; L178-L187 HydrophobicContact CG-CB 3.75Å; L178-L187 HydrophobicContact CG-CD1 3.98Å; L178-V191 HydrophobicContact CD1-CG2 4.26Å
179	L	95.7	Very high	96.4	Very high	137 Å²	137	62.3 Å²	62.3	72%	0.717	30%	0.297	S	S	*	.	H	α-helix	trans	-64.3	-41.9	174.8	-72.3	171.7	0	0	0	111.1	K175 R176 I177	K175-L179 WeakPolarHBondContact O-CG 3.43Å; K175-L179 PolarHBondContact O-N 3.44Å; R176-L179 WeakPolarHBondContact O-CB 3.39Å; R176-L179 PolarHBondContact O-N 2.83Å; I177-L179 VanDerWaalsContact C-N 3.3Å; I177-L179 PolarHBondContact O-N 3.47Å
180	D	94.1	Very high	96.5	Very high	132 Å²	132	63.9 Å²	63.9	71%	0.706	30%	0.3	S	S	*	.	H	α-helix	trans	-86.2	-27	-178	-61.4	-31.8	0	0	0	112.9	I177 L178	I177-D180 PolarHBondContact O-N 3.29Å; L178-D180 VanDerWaalsContact C-N 3.34Å
181	N	95.5	Very high	96.5	Very high	34 Å²	34	64 Å²	64	18%	0.182	30%	0.301	C	S	.	.			trans	-130.7	71.9	-173.2	-50.5	-94.5	0	0	0	110.8	I177 E183 Y184	I177-N181 PolarHBondContact O-N 3Å; I177-N181 PolarHBondContact O-ND2 3.31Å; N181-E183 WeakPolarHBondContact CA-OE2 3.37Å; N181-E183 PolarHBondContact O-N 3.49Å; N181-E183 VanDerWaalsContact O-N 3.12Å; N181-Y184 HydrophobicContact CB-CD1 4.27Å; N181-Y184 HydrophobicContact CB-CD2 3.44Å; N181-Y184 VanDerWaalsContact CB-CD2 3.44Å; N181-Y184 HydrophobicContact CB-CE1 4.34Å; N181-Y184 HydrophobicContact CB-CE2 3.5Å; N181-Y184 VanDerWaalsContact CB-CE2 3.5Å; N181-Y184 HydrophobicContact CB-CG 3.84Å; N181-Y184 WeakPolarHBondContact O-CB 3.41Å; N181-Y184 PolarHBondContact O-N 3.36Å
182	R	92.8	Very high	96.5	Very high	208 Å²	208	64 Å²	64	79%	0.785	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.8	-174.2	-62.7	-174	71.8	145.6	3	113.6	Y184	R182-Y184 VanDerWaalsContact C-N 3.29Å
183	E	93.5	Very high	96.4	Very high	124 Å²	124	61.1 Å²	61.1	58%	0.579	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-12.6	176.5	72.3	-78.4	-172.2	0	0	113.8	N181 L185	N181-E183 WeakPolarHBondContact CA-OE2 3.37Å; N181-E183 PolarHBondContact O-N 3.49Å; N181-E183 VanDerWaalsContact O-N 3.12Å; E183-L185 PolarHBondContact O-N 2.92Å
184	Y	95.5	Very high	96.4	Very high	93 Å²	93	60.4 Å²	60.4	37%	0.365	28%	0.282	S	S	.	.			trans	-77.4	57.4	177.4	-67.7	-6.9	0	0	0	112.3	T151 I177 N181 R182 A186 L187	T151-Y184 HydrophobicContact CG2-CE2 3.78Å; I177-Y184 HydrophobicContact CG2-CD2 3.88Å; I177-Y184 HydrophobicContact CG2-CE2 4.25Å; N181-Y184 HydrophobicContact CB-CD1 4.27Å; N181-Y184 HydrophobicContact CB-CD2 3.44Å; N181-Y184 VanDerWaalsContact CB-CD2 3.44Å; N181-Y184 HydrophobicContact CB-CE1 4.34Å; N181-Y184 HydrophobicContact CB-CE2 3.5Å; N181-Y184 VanDerWaalsContact CB-CE2 3.5Å; N181-Y184 HydrophobicContact CB-CG 3.84Å; N181-Y184 WeakPolarHBondContact O-CB 3.41Å; N181-Y184 PolarHBondContact O-N 3.36Å; R182-Y184 VanDerWaalsContact C-N 3.29Å; Y184-A186 PolarHBondContact O-N 3.31Å; Y184-L187 HydrophobicContact CD2-CD1 4.09Å; Y184-L187 HydrophobicContact CG-CD1 4.46Å; Y184-L187 WeakPolarHBondContact O-CB 3.23Å; Y184-L187 PolarHBondContact O-N 3.38Å
185	L	94.2	Very high	96.4	Very high	53 Å²	53	61 Å²	61	28%	0.277	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-37.8	-172.9	-65.3	176	0	0	0	113.5	E183 L187 N188 Y211 Q214	E183-L185 PolarHBondContact O-N 2.92Å; L185-L187 PolarHBondContact O-N 3.37Å; L185-N188 WeakPolarHBondContact O-CB 3.15Å; L185-N188 PolarHBondContact O-N 2.86Å; L185-N188 PolarHBondContact O-ND2 3.47Å; L185-Y211 HydrophobicContact CB-CD2 3.98Å; L185-Y211 HydrophobicContact CB-CE2 4.33Å; L185-Y211 WeakPolarHBondContact O-CD2 3.41Å; L185-Q214 HydrophobicContact CD1-CB 4.02Å; L185-Q214 HydrophobicContact CD1-CG 4.08Å
186	A	94.9	Very high	96.4	Very high	47 Å²	47	59 Å²	59	39%	0.388	27%	0.274	S	S	.	.	H	α-helix	trans	-59.9	-26.6	-179.1	0	0	0	0	0	113.5	Y184 N188 V189 Y190 Y211	Y184-A186 PolarHBondContact O-N 3.31Å; A186-N188 PolarHBondContact O-N 3.02Å; A186-V189 WeakPolarHBondContact O-CB 3.43Å; A186-V189 PolarHBondContact O-N 2.88Å; A186-Y190 VanDerWaalsContact O-CD2 3.31Å; A186-Y190 WeakPolarHBondContact O-CD2 3.49Å; A186-Y190 PolarHBondContact O-N 3.13Å; A186-Y211 HydrophobicContact CB-CE2 4.38Å
187	L	97.2	Very high	96.1	Very high	12 Å²	12	57.2 Å²	57.2	6%	0.063	27%	0.269	C	S	.	.	H	α-helix	trans	-62.8	-27.5	176.5	-62.5	-178.5	0	0	0	112.3	L155 Y174 I177 L178 Y184 L185 V189 Y190 V191	L155-L187 HydrophobicContact CD2-CD1 4.4Å; L155-L187 HydrophobicContact CD2-CD2 3.5Å; Y174-L187 HydrophobicContact CD1-CD2 3.95Å; Y174-L187 HydrophobicContact CE1-CD2 4.31Å; I177-L187 HydrophobicContact CB-CD1 4.09Å; I177-L187 HydrophobicContact CG2-CD1 3.58Å; L178-L187 HydrophobicContact CD1-CB 3.72Å; L178-L187 HydrophobicContact CD2-CB 3.96Å; L178-L187 HydrophobicContact CD2-CD1 4.36Å; L178-L187 HydrophobicContact CG-CB 3.75Å; L178-L187 HydrophobicContact CG-CD1 3.98Å; Y184-L187 HydrophobicContact CD2-CD1 4.09Å; Y184-L187 HydrophobicContact CG-CD1 4.46Å; Y184-L187 WeakPolarHBondContact O-CB 3.23Å; Y184-L187 PolarHBondContact O-N 3.38Å; L185-L187 PolarHBondContact O-N 3.37Å; L187-V189 PolarHBondContact O-N 3.36Å; L187-Y190 HydrophobicContact CD2-CD2 4.33Å; L187-Y190 PolarHBondContact O-N 3.48Å; L187-Y190 VanDerWaalsContact O-N 3.13Å; L187-V191 WeakPolarHBondContact O-CG2 3.18Å; L187-V191 PolarHBondContact O-N 3.47Å
188	N	97.5	Very high	95.8	Very high	24 Å²	24	59.1 Å²	59.1	13%	0.128	28%	0.279	C	S	.	.	H	α-helix	trans	-60.3	-36.6	172.3	-64.3	-73.6	0	0	0	111.5	L185 A186 V191 A192 V207	L185-N188 WeakPolarHBondContact O-CB 3.15Å; L185-N188 PolarHBondContact O-N 2.86Å; L185-N188 PolarHBondContact O-ND2 3.47Å; A186-N188 PolarHBondContact O-N 3.02Å; N188-V191 PolarHBondContact O-N 3.16Å; N188-A192 VanDerWaalsContact O-CB 3.26Å; N188-A192 WeakPolarHBondContact O-CB 3.46Å; N188-A192 PolarHBondContact O-N 3.4Å; N188-V207 HydrophobicContact CB-CG1 4.04Å; N188-V207 VanDerWaalsContact O-CG1 3.32Å; N188-V207 WeakPolarHBondContact O-CG1 3.29Å
189	V	97.8	Very high	95.6	Very high	10 Å²	10	61.5 Å²	61.5	6%	0.061	29%	0.292	C	S	.	.	H	α-helix	trans	-65.4	-41.3	175.5	-176	0	0	0	0	110.8	A186 L187 A192 L193 L208 Y211 I220 A221	A186-V189 WeakPolarHBondContact O-CB 3.43Å; A186-V189 PolarHBondContact O-N 2.88Å; L187-V189 PolarHBondContact O-N 3.36Å; V189-A192 PolarHBondContact O-N 3.48Å; V189-L193 HydrophobicContact CG1-CD1 4.46Å; V189-L193 WeakPolarHBondContact O-CB 3.18Å; V189-L193 WeakPolarHBondContact O-CG 3.37Å; V189-L193 PolarHBondContact O-N 3.18Å; V189-L208 HydrophobicContact CG1-CD1 4.34Å; V189-L208 HydrophobicContact CG2-CD1 4.2Å; V189-Y211 HydrophobicContact CG2-CD1 3.34Å; V189-Y211 HydrophobicContact CG2-CD2 3.83Å; V189-Y211 HydrophobicContact CG2-CE1 3.62Å; V189-Y211 HydrophobicContact CG2-CE2 4.09Å; V189-Y211 HydrophobicContact CG2-CG 3.44Å; V189-Y211 VanDerWaalsContact CG2-CG 3.44Å; V189-I220 HydrophobicContact CG1-CG2 4.1Å; V189-A221 HydrophobicContact CG2-CB 4.36Å
190	Y	98	Very high	95.6	Very high	118 Å²	118	61.3 Å²	61.3	46%	0.463	28%	0.283	S	S	.	.	H	α-helix	trans	-67.9	-40.2	177.6	-69.5	-77.4	0	0	0	112.6	A186 L187 L193 C194	A186-Y190 VanDerWaalsContact O-CD2 3.31Å; A186-Y190 WeakPolarHBondContact O-CD2 3.49Å; A186-Y190 PolarHBondContact O-N 3.13Å; L187-Y190 HydrophobicContact CD2-CD2 4.33Å; L187-Y190 PolarHBondContact O-N 3.48Å; L187-Y190 VanDerWaalsContact O-N 3.13Å; Y190-L193 HydrophobicContact CD1-CD1 4.41Å; Y190-L193 WeakPolarHBondContact O-CB 3.49Å; Y190-L193 PolarHBondContact O-N 2.9Å; Y190-C194 PolarHBondContact O-N 3.12Å; Y190-C194 PolarHBondContact O-SG 3.46Å
191	V	98.2	Very high	95.7	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-62.1	-46.2	172.3	174.3	0	0	0	0	110.5	I171 Y174 L178 L187 N188 L193 C194 Y195 V207	I171-V191 HydrophobicContact CG2-CG1 4.47Å; Y174-V191 VanDerWaalsContact CB-CG2 3.46Å; Y174-V191 HydrophobicContact CD2-CG2 4.22Å; Y174-V191 HydrophobicContact CG-CG2 4.22Å; L178-V191 HydrophobicContact CD1-CG2 4.26Å; L187-V191 WeakPolarHBondContact O-CG2 3.18Å; L187-V191 PolarHBondContact O-N 3.47Å; N188-V191 PolarHBondContact O-N 3.16Å; V191-L193 VanDerWaalsContact C-N 3.31Å; V191-L193 PolarHBondContact O-N 2.92Å; V191-C194 WeakPolarHBondContact O-CB 3.41Å; V191-C194 PolarHBondContact O-N 3.03Å; V191-C194 VanDerWaalsContact O-N 3.15Å; V191-Y195 HydrophobicContact CG1-CD2 3.71Å; V191-Y195 HydrophobicContact CG1-CE2 3.49Å; V191-Y195 VanDerWaalsContact CG1-CE2 3.49Å; V191-Y195 WeakPolarHBondContact O-CD2 3.31Å; V191-Y195 PolarHBondContact O-N 2.91Å; V191-V207 HydrophobicContact CB-CG1 4.07Å; V191-V207 HydrophobicContact CG1-CG1 3.95Å; V191-V207 HydrophobicContact CG1-CG2 4.47Å
192	A	98.3	Very high	95.8	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.6	-38.7	176.3	0	0	0	0	0	112.3	N188 V189 Y195 Y196 S204 V207 L208 L224	N188-A192 VanDerWaalsContact O-CB 3.26Å; N188-A192 WeakPolarHBondContact O-CB 3.46Å; N188-A192 PolarHBondContact O-N 3.4Å; V189-A192 PolarHBondContact O-N 3.48Å; A192-Y195 PolarHBondContact O-N 2.92Å; A192-Y196 WeakPolarHBondContact O-CB 3.33Å; A192-Y196 PolarHBondContact O-N 2.74Å; A192-S204 WeakPolarHBondContact CB-O 3.49Å; A192-S204 WeakPolarHBondContact O-CB 3.44Å; A192-S204 PolarHBondContact O-OG 3.12Å; A192-V207 HydrophobicContact CB-CB 4.32Å; A192-V207 HydrophobicContact CB-CG1 4.28Å; A192-L208 HydrophobicContact CB-CB 3.92Å; A192-L208 HydrophobicContact CB-CD1 4.22Å; A192-L224 HydrophobicContact CB-CD2 3.87Å
193	L	97.3	Very high	96	Very high	27 Å²	27	52.2 Å²	52.2	14%	0.141	25%	0.25	C	C	.	.	H	α-helix	trans	-62.5	-41.2	174.1	-79.1	170.3	0	0	0	112.1	Y162 V189 Y190 V191 Y196 K197 L224	Y162-L193 HydrophobicContact CE2-CB 4.33Å; V189-L193 HydrophobicContact CG1-CD1 4.46Å; V189-L193 WeakPolarHBondContact O-CB 3.18Å; V189-L193 WeakPolarHBondContact O-CG 3.37Å; V189-L193 PolarHBondContact O-N 3.18Å; Y190-L193 HydrophobicContact CD1-CD1 4.41Å; Y190-L193 WeakPolarHBondContact O-CB 3.49Å; Y190-L193 PolarHBondContact O-N 2.9Å; V191-L193 VanDerWaalsContact C-N 3.31Å; V191-L193 PolarHBondContact O-N 2.92Å; L193-Y196 WeakPolarHBondContact O-CB 3.24Å; L193-Y196 PolarHBondContact O-N 3.14Å; L193-K197 WeakPolarHBondContact O-CG 3.44Å; L193-K197 PolarHBondContact O-N 3.32Å; L193-L224 HydrophobicContact CB-CD2 4.49Å; L193-L224 HydrophobicContact CD2-CD1 3.76Å; L193-L224 HydrophobicContact CD2-CD2 3.72Å; L193-L224 HydrophobicContact CD2-CG 4.24Å; L193-L224 HydrophobicContact CG-CD2 3.78Å
194	C	97.7	Very high	96.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-45.2	175.7	-61.3	0	0	0	0	110.8	I171 Y190 V191 Y196 K197 L198	I171-C194 HydrophobicContact CD1-CB 3.55Å; I171-C194 HydrophobicContact CG1-CB 3.3Å; Y190-C194 PolarHBondContact O-N 3.12Å; Y190-C194 PolarHBondContact O-SG 3.46Å; V191-C194 WeakPolarHBondContact O-CB 3.41Å; V191-C194 PolarHBondContact O-N 3.03Å; V191-C194 VanDerWaalsContact O-N 3.15Å; C194-Y196 VanDerWaalsContact C-N 3.32Å; C194-Y196 PolarHBondContact O-N 3.42Å; C194-K197 PolarHBondContact O-N 3.26Å; C194-K197 VanDerWaalsContact O-N 3.1Å; C194-L198 WeakPolarHBondContact O-CG 3.26Å; C194-L198 PolarHBondContact O-N 3.47Å
195	Y	97.9	Very high	96.3	Very high	23 Å²	23	44.2 Å²	44.2	9%	0.09	22%	0.216	C	C	.	.	H	α-helix	trans	-62.1	-37.8	176	-78.4	-49	0	0	0	113.4	I171 K175 V191 A192 K197 L198 D199 Y200 V203 V207	I171-Y195 HydrophobicContact CD1-CD1 3.8Å; I171-Y195 HydrophobicContact CD1-CE1 3.73Å; I171-Y195 HydrophobicContact CD1-CG 4.27Å; K175-Y195 WeakPolarHBondContact CE-OH 3.5Å; K175-Y195 PolarHBondContact NZ-OH 2.67Å; V191-Y195 HydrophobicContact CG1-CD2 3.71Å; V191-Y195 HydrophobicContact CG1-CE2 3.49Å; V191-Y195 VanDerWaalsContact CG1-CE2 3.49Å; V191-Y195 WeakPolarHBondContact O-CD2 3.31Å; V191-Y195 PolarHBondContact O-N 2.91Å; A192-Y195 PolarHBondContact O-N 2.92Å; Y195-K197 VanDerWaalsContact C-N 3.32Å; Y195-K197 PolarHBondContact O-N 3.26Å; Y195-L198 CarbonylContact O-C 3.48Å; Y195-L198 PolarHBondContact O-N 2.99Å; Y195-D199 PolarHBondContact O-N 3.03Å; Y195-Y200 AromaticContact CD1-CD2 3.77Å; Y195-Y200 HydrophobicContact CD1-CD2 3.77Å; Y195-Y200 HydrophobicContact CD1-CG 4.48Å; Y195-Y200 HydrophobicContact CE1-CD2 4.09Å; Y195-Y200 PolarHBondContact O-N 3.19Å; Y195-V203 HydrophobicContact CD1-CG1 4.2Å; Y195-V203 HydrophobicContact CD2-CG1 3.7Å; Y195-V203 HydrophobicContact CE1-CG1 4.15Å; Y195-V203 HydrophobicContact CE2-CG1 3.64Å; Y195-V203 HydrophobicContact CG-CB 4.4Å; Y195-V203 HydrophobicContact CG-CG1 3.98Å; Y195-V207 HydrophobicContact CD2-CG2 4.19Å; Y195-V207 HydrophobicContact CE2-CG2 4.14Å
196	Y	96.7	Very high	96.5	Very high	47 Å²	47	48.4 Å²	48.4	18%	0.184	23%	0.234	C	C	.	.	H	α-helix	trans	-60	-43.2	172.2	178.1	-88.1	0	0	0	111.7	A192 L193 C194 L198 D199 Y201 L224 C227 N228 R231	A192-Y196 WeakPolarHBondContact O-CB 3.33Å; A192-Y196 PolarHBondContact O-N 2.74Å; L193-Y196 WeakPolarHBondContact O-CB 3.24Å; L193-Y196 PolarHBondContact O-N 3.14Å; C194-Y196 VanDerWaalsContact C-N 3.32Å; C194-Y196 PolarHBondContact O-N 3.42Å; Y196-L198 VanDerWaalsContact C-N 3.27Å; Y196-L198 PolarHBondContact O-N 2.97Å; Y196-D199 PolarHBondContact O-N 3.2Å; Y196-D199 VanDerWaalsContact O-N 3.11Å; Y196-Y201 AromaticContact CD2-CD1 3.76Å; Y196-Y201 HydrophobicContact CD2-CD1 3.76Å; Y196-Y201 AromaticContact CD2-CE1 3.99Å; Y196-Y201 HydrophobicContact CD2-CE1 3.99Å; Y196-Y201 AromaticContact CE2-CD1 3.98Å; Y196-Y201 HydrophobicContact CE2-CD1 3.98Å; Y196-Y201 AromaticContact CE2-CE1 3.95Å; Y196-Y201 HydrophobicContact CE2-CE1 3.95Å; Y196-Y201 HydrophobicContact CG-CD1 4.48Å; Y196-L224 HydrophobicContact CD1-CD1 4.41Å; Y196-L224 HydrophobicContact CD2-CD1 3.87Å; Y196-L224 HydrophobicContact CG-CD1 3.79Å; Y196-C227 HydrophobicContact CD2-CB 4.42Å; Y196-C227 HydrophobicContact CE2-CB 3.59Å; Y196-N228 VanDerWaalsContact CD2-OD1 3.3Å; Y196-N228 WeakPolarHBondContact CD2-OD1 3.32Å; Y196-R231 HydrophobicContact CE2-CG 4.17Å
197	K	91.9	Very high	96.6	Very high	72 Å²	72	47.5 Å²	47.5	31%	0.313	22%	0.223	S	C	.	.	H	α-helix	trans	-72.2	-19.2	178.5	-71.1	-68.5	-176	179.9	0	113.6	Y162 Y167 L193 C194 Y195 D199 E286	Y162-K197 HydrophobicContact CE2-CG 4.23Å; Y167-K197 HydrophobicContact CD1-CB 3.89Å; Y167-K197 HydrophobicContact CD1-CG 4.44Å; Y167-K197 HydrophobicContact CD2-CB 3.98Å; Y167-K197 HydrophobicContact CE1-CB 3.61Å; Y167-K197 HydrophobicContact CE1-CG 3.84Å; Y167-K197 HydrophobicContact CE2-CB 3.72Å; Y167-K197 HydrophobicContact CG-CB 4.06Å; L193-K197 WeakPolarHBondContact O-CG 3.44Å; L193-K197 PolarHBondContact O-N 3.32Å; C194-K197 PolarHBondContact O-N 3.26Å; C194-K197 VanDerWaalsContact O-N 3.1Å; Y195-K197 VanDerWaalsContact C-N 3.32Å; Y195-K197 PolarHBondContact O-N 3.26Å; K197-D199 VanDerWaalsContact C-N 3.31Å; K197-E286 IonicContact NZ-OE1 3.86Å; K197-E286 PolarHBondContact NZ-OE1 3Å
198	L	91.8	Very high	96.6	Very high	50 Å²	50	47 Å²	47	26%	0.262	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	8.9	169.8	-69.3	172.4	0	0	0	113	Y167 I171 C194 Y195 Y196 Y200	Y167-L198 HydrophobicContact CD2-CD2 3.97Å; Y167-L198 HydrophobicContact CD2-CG 4.24Å; Y167-L198 HydrophobicContact CG-CD2 4.42Å; Y167-L198 HydrophobicContact CG-CG 4.34Å; I171-L198 HydrophobicContact CD1-CD1 3.63Å; C194-L198 WeakPolarHBondContact O-CG 3.26Å; C194-L198 PolarHBondContact O-N 3.47Å; Y195-L198 CarbonylContact O-C 3.48Å; Y195-L198 PolarHBondContact O-N 2.99Å; Y196-L198 VanDerWaalsContact C-N 3.27Å; Y196-L198 PolarHBondContact O-N 2.97Å; L198-Y200 HydrophobicContact CB-CD2 4.11Å; L198-Y200 HydrophobicContact CB-CE2 4.26Å; L198-Y200 HydrophobicContact CB-CG 4.47Å; L198-Y200 PolarHBondContact O-N 3.13Å; L198-Y200 VanDerWaalsContact O-N 3.13Å
199	D	91.2	Very high	96.6	Very high	78 Å²	78	47.7 Å²	47.7	42%	0.417	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	16	-178	-60.2	-35.5	0	0	0	115.5	Y195 Y196 K197 Y201	Y195-D199 PolarHBondContact O-N 3.03Å; Y196-D199 PolarHBondContact O-N 3.2Å; Y196-D199 VanDerWaalsContact O-N 3.11Å; K197-D199 VanDerWaalsContact C-N 3.31Å; D199-Y201 VanDerWaalsContact C-N 3.27Å; D199-Y201 HydrophobicContact CB-CE1 4.34Å; D199-Y201 HydrophobicContact CB-CE2 4.18Å; D199-Y201 VanDerWaalsContact CG-OH 3.24Å; D199-Y201 PolarHBondContact O-N 3.09Å; D199-Y201 VanDerWaalsContact O-N 3.11Å; D199-Y201 VanDerWaalsContact OD1-CZ 3.27Å; D199-Y201 PolarHBondContact OD1-OH 2.86Å
200	Y	95	Very high	96.5	Very high	133 Å²	133	50.4 Å²	50.4	52%	0.522	25%	0.247	S	C	.	.			trans	-87	65.3	171.8	-58	-25.5	0	0	0	110.4	Y195 L198 D202 V203 S204	Y195-Y200 AromaticContact CD1-CD2 3.77Å; Y195-Y200 HydrophobicContact CD1-CD2 3.77Å; Y195-Y200 HydrophobicContact CD1-CG 4.48Å; Y195-Y200 HydrophobicContact CE1-CD2 4.09Å; Y195-Y200 PolarHBondContact O-N 3.19Å; L198-Y200 HydrophobicContact CB-CD2 4.11Å; L198-Y200 HydrophobicContact CB-CE2 4.26Å; L198-Y200 HydrophobicContact CB-CG 4.47Å; L198-Y200 PolarHBondContact O-N 3.13Å; L198-Y200 VanDerWaalsContact O-N 3.13Å; Y200-D202 PolarHBondContact O-N 3.25Å; Y200-V203 PolarHBondContact O-N 3.48Å; Y200-S204 WeakPolarHBondContact O-CB 3.3Å; Y200-S204 PolarHBondContact O-N 3.05Å
201	Y	96.8	Very high	96.4	Very high	29 Å²	29	46.2 Å²	46.2	11%	0.114	23%	0.23	C	C	.	.	H	α-helix	trans	-63.5	-38.1	-172.3	-50.2	-56.5	0	0	0	113.5	Y196 D199 S204 Q205 N228 R231 L232	Y196-Y201 AromaticContact CD2-CD1 3.76Å; Y196-Y201 HydrophobicContact CD2-CD1 3.76Å; Y196-Y201 AromaticContact CD2-CE1 3.99Å; Y196-Y201 HydrophobicContact CD2-CE1 3.99Å; Y196-Y201 AromaticContact CE2-CD1 3.98Å; Y196-Y201 HydrophobicContact CE2-CD1 3.98Å; Y196-Y201 AromaticContact CE2-CE1 3.95Å; Y196-Y201 HydrophobicContact CE2-CE1 3.95Å; Y196-Y201 HydrophobicContact CG-CD1 4.48Å; D199-Y201 VanDerWaalsContact C-N 3.27Å; D199-Y201 HydrophobicContact CB-CE1 4.34Å; D199-Y201 HydrophobicContact CB-CE2 4.18Å; D199-Y201 VanDerWaalsContact CG-OH 3.24Å; D199-Y201 PolarHBondContact O-N 3.09Å; D199-Y201 VanDerWaalsContact O-N 3.11Å; D199-Y201 VanDerWaalsContact OD1-CZ 3.27Å; D199-Y201 PolarHBondContact OD1-OH 2.86Å; Y201-S204 WeakPolarHBondContact O-CB 3.46Å; Y201-S204 PolarHBondContact O-N 2.9Å; Y201-Q205 WeakPolarHBondContact O-CB 3.38Å; Y201-Q205 PolarHBondContact O-N 3.34Å; Y201-N228 PolarHBondContact O-OD1 3.21Å; Y201-R231 HydrophobicContact CD1-CB 4.04Å; Y201-R231 HydrophobicContact CD1-CG 4.2Å; Y201-R231 HydrophobicContact CD2-CB 3.66Å; Y201-R231 HydrophobicContact CE1-CB 4.01Å; Y201-R231 HydrophobicContact CE1-CG 3.83Å; Y201-R231 HydrophobicContact CE2-CB 3.59Å; Y201-R231 HydrophobicContact CE2-CG 4.16Å; Y201-R231 HydrophobicContact CG-CB 3.88Å; Y201-R231 PolarHBondContact OH-NE 3.47Å; Y201-R231 PolarHBondContact OH-NH2 2.93Å; Y201-L232 HydrophobicContact CD2-CD2 4.4Å
202	D	96.9	Very high	96.2	Very high	99 Å²	99	47.2 Å²	47.2	53%	0.529	24%	0.235	S	C	.	.	H	α-helix	trans	-62.1	-48.9	176.5	-66	-48.1	0	0	0	110.9	Y200 S204 Q205 E206 L232	Y200-D202 PolarHBondContact O-N 3.25Å; D202-S204 VanDerWaalsContact C-N 3.33Å; D202-S204 PolarHBondContact O-N 3.06Å; D202-Q205 PolarHBondContact O-N 3.31Å; D202-Q205 VanDerWaalsContact O-N 3.15Å; D202-E206 PolarHBondContact O-N 3.49Å; D202-L232 WeakPolarHBondContact OD1-CD1 3.35Å; D202-L232 VanDerWaalsContact OD1-CD2 3.24Å; D202-L232 WeakPolarHBondContact OD1-CD2 3.46Å
203	V	97.6	Very high	96.1	Very high	55 Å²	55	54.6 Å²	54.6	33%	0.333	27%	0.27	S	S	.	.	H	α-helix	trans	-63.8	-39.9	177.3	-174.8	0	0	0	0	110.9	Y195 Y200 Q205 E206 V207	Y195-V203 HydrophobicContact CD1-CG1 4.2Å; Y195-V203 HydrophobicContact CD2-CG1 3.7Å; Y195-V203 HydrophobicContact CE1-CG1 4.15Å; Y195-V203 HydrophobicContact CE2-CG1 3.64Å; Y195-V203 HydrophobicContact CG-CB 4.4Å; Y195-V203 HydrophobicContact CG-CG1 3.98Å; Y200-V203 PolarHBondContact O-N 3.48Å; V203-Q205 VanDerWaalsContact C-N 3.3Å; V203-Q205 PolarHBondContact O-N 3.39Å; V203-E206 PolarHBondContact O-N 2.8Å; V203-V207 HydrophobicContact CG1-CG2 4.39Å; V203-V207 WeakPolarHBondContact O-CG2 3.33Å; V203-V207 PolarHBondContact O-N 3.01Å
204	S	98.3	Very high	95.9	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-56.7	-46.2	173.7	-178.5	0	0	0	0	111	A192 Y200 Y201 D202 L208 N228	A192-S204 WeakPolarHBondContact CB-O 3.49Å; A192-S204 WeakPolarHBondContact O-CB 3.44Å; A192-S204 PolarHBondContact O-OG 3.12Å; Y200-S204 WeakPolarHBondContact O-CB 3.3Å; Y200-S204 PolarHBondContact O-N 3.05Å; Y201-S204 WeakPolarHBondContact O-CB 3.46Å; Y201-S204 PolarHBondContact O-N 2.9Å; D202-S204 VanDerWaalsContact C-N 3.33Å; D202-S204 PolarHBondContact O-N 3.06Å; S204-L208 WeakPolarHBondContact O-CB 3.49Å; S204-L208 PolarHBondContact O-N 3.12Å; S204-N228 PolarHBondContact OG-ND2 3.33Å; S204-N228 PolarHBondContact OG-OD1 3.09Å
205	Q	97.4	Very high	95.7	Very high	49 Å²	49	62.5 Å²	62.5	23%	0.229	31%	0.307	C	S	.	.	H	α-helix	trans	-66.7	-40.6	-180	-176.5	169.6	-24.9	0	0	112.6	Y201 D202 V203 L208 A209 N228 H229	Y201-Q205 WeakPolarHBondContact O-CB 3.38Å; Y201-Q205 PolarHBondContact O-N 3.34Å; D202-Q205 PolarHBondContact O-N 3.31Å; D202-Q205 VanDerWaalsContact O-N 3.15Å; V203-Q205 VanDerWaalsContact C-N 3.3Å; V203-Q205 PolarHBondContact O-N 3.39Å; Q205-L208 PolarHBondContact O-N 2.78Å; Q205-A209 WeakPolarHBondContact O-CB 3.02Å; Q205-A209 PolarHBondContact O-N 3.26Å; Q205-N228 HydrophobicContact CB-CB 4.5Å; Q205-H229 PolarHBondContact NE2-NE2 3.09Å; Q205-H229 PolarHBondContact OE1-CD2 3.01Å
206	E	97.6	Very high	95.3	Very high	140 Å²	140	65.5 Å²	65.5	65%	0.654	33%	0.33	S	S	*	.	H	α-helix	trans	-62	-48.5	176.1	-72.7	-177.9	175.5	0	0	112.2	D202 V203 L208 A209	D202-E206 PolarHBondContact O-N 3.49Å; V203-E206 PolarHBondContact O-N 2.8Å; E206-L208 VanDerWaalsContact C-N 3.32Å; E206-L208 PolarHBondContact O-N 2.85Å; E206-A209 WeakPolarHBondContact O-CB 3.36Å; E206-A209 PolarHBondContact O-N 3.46Å
207	V	97.2	Very high	94.8	Very high	28 Å²	28	68.9 Å²	68.9	17%	0.17	35%	0.351	C	S	.	.	H	α-helix	trans	-64.4	-40.6	178.4	176.8	0	0	0	0	110.7	N188 V191 A192 Y195 V203 A209 V210	N188-V207 HydrophobicContact CB-CG1 4.04Å; N188-V207 VanDerWaalsContact O-CG1 3.32Å; N188-V207 WeakPolarHBondContact O-CG1 3.29Å; V191-V207 HydrophobicContact CB-CG1 4.07Å; V191-V207 HydrophobicContact CG1-CG1 3.95Å; V191-V207 HydrophobicContact CG1-CG2 4.47Å; A192-V207 HydrophobicContact CB-CB 4.32Å; A192-V207 HydrophobicContact CB-CG1 4.28Å; Y195-V207 HydrophobicContact CD2-CG2 4.19Å; Y195-V207 HydrophobicContact CE2-CG2 4.14Å; V203-V207 HydrophobicContact CG1-CG2 4.39Å; V203-V207 WeakPolarHBondContact O-CG2 3.33Å; V203-V207 PolarHBondContact O-N 3.01Å; V207-A209 VanDerWaalsContact C-N 3.29Å; V207-A209 PolarHBondContact O-N 3.03Å; V207-V210 WeakPolarHBondContact O-CB 3.37Å; V207-V210 PolarHBondContact O-N 3.44Å
208	L	97.3	Very high	94.5	Very high	1 Å²	1	66.4 Å²	66.4	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-65.2	-33.2	178.8	-170.1	60.9	0	0	0	112.6	V189 A192 S204 Q205 E206 V210 Y211 L212 A221 L224 K225	V189-L208 HydrophobicContact CG1-CD1 4.34Å; V189-L208 HydrophobicContact CG2-CD1 4.2Å; A192-L208 HydrophobicContact CB-CB 3.92Å; A192-L208 HydrophobicContact CB-CD1 4.22Å; S204-L208 WeakPolarHBondContact O-CB 3.49Å; S204-L208 PolarHBondContact O-N 3.12Å; Q205-L208 PolarHBondContact O-N 2.78Å; E206-L208 VanDerWaalsContact C-N 3.32Å; E206-L208 PolarHBondContact O-N 2.85Å; L208-V210 VanDerWaalsContact C-N 3.27Å; L208-V210 PolarHBondContact O-N 3.13Å; L208-Y211 PolarHBondContact O-N 3.5Å; L208-Y211 VanDerWaalsContact O-N 3.17Å; L208-L212 HydrophobicContact CD2-CD1 4.44Å; L208-L212 HydrophobicContact CG-CD1 4.01Å; L208-L212 HydrophobicContact CG-CG 4.46Å; L208-L212 PolarHBondContact O-N 3.47Å; L208-A221 HydrophobicContact CD1-CB 3.74Å; L208-A221 WeakPolarHBondContact CD2-O 3.27Å; L208-A221 HydrophobicContact CG-CB 4.49Å; L208-L224 HydrophobicContact CD1-CD2 4.1Å; L208-L224 HydrophobicContact CD2-CB 3.93Å; L208-L224 HydrophobicContact CD2-CD2 4Å; L208-L224 HydrophobicContact CD2-CG 3.87Å; L208-K225 HydrophobicContact CD2-CB 3.9Å
209	A	96.9	Very high	94.3	Very high	39 Å²	39	65.6 Å²	65.6	32%	0.322	34%	0.34	S	S	.	.	H	α-helix	trans	-61.4	-34.5	177.8	0	0	0	0	0	112.5	Q205 E206 V207 Y211 L212 Q213	Q205-A209 WeakPolarHBondContact O-CB 3.02Å; Q205-A209 PolarHBondContact O-N 3.26Å; E206-A209 WeakPolarHBondContact O-CB 3.36Å; E206-A209 PolarHBondContact O-N 3.46Å; V207-A209 VanDerWaalsContact C-N 3.29Å; V207-A209 PolarHBondContact O-N 3.03Å; A209-Y211 VanDerWaalsContact C-N 3.25Å; A209-Y211 PolarHBondContact O-N 3.38Å; A209-L212 PolarHBondContact O-N 2.92Å; A209-Q213 WeakPolarHBondContact O-CB 3.22Å; A209-Q213 VanDerWaalsContact O-CG 3.29Å; A209-Q213 WeakPolarHBondContact O-CG 3.42Å; A209-Q213 PolarHBondContact O-N 3.21Å
210	V	95.6	Very high	94.2	Very high	68 Å²	68	66.2 Å²	66.2	41%	0.412	34%	0.342	S	S	.	.	H	α-helix	trans	-57.7	-41	175.7	179.9	0	0	0	0	111.2	V207 L208	V207-V210 WeakPolarHBondContact O-CB 3.37Å; V207-V210 PolarHBondContact O-N 3.44Å; L208-V210 VanDerWaalsContact C-N 3.27Å; L208-V210 PolarHBondContact O-N 3.13Å
211	Y	96.6	Very high	94.1	Very high	30 Å²	30	59.9 Å²	59.9	12%	0.118	32%	0.317	C	S	.	.	H	α-helix	trans	-74.5	-45.3	177.6	179.9	-98.3	0	0	0	112	L185 A186 V189 L208 A209 Q213 Q214 I215 S218 A221	L185-Y211 HydrophobicContact CB-CD2 3.98Å; L185-Y211 HydrophobicContact CB-CE2 4.33Å; L185-Y211 WeakPolarHBondContact O-CD2 3.41Å; A186-Y211 HydrophobicContact CB-CE2 4.38Å; V189-Y211 HydrophobicContact CG2-CD1 3.34Å; V189-Y211 HydrophobicContact CG2-CD2 3.83Å; V189-Y211 HydrophobicContact CG2-CE1 3.62Å; V189-Y211 HydrophobicContact CG2-CE2 4.09Å; V189-Y211 HydrophobicContact CG2-CG 3.44Å; V189-Y211 VanDerWaalsContact CG2-CG 3.44Å; L208-Y211 PolarHBondContact O-N 3.5Å; L208-Y211 VanDerWaalsContact O-N 3.17Å; A209-Y211 VanDerWaalsContact C-N 3.25Å; A209-Y211 PolarHBondContact O-N 3.38Å; Y211-Q213 VanDerWaalsContact C-N 3.28Å; Y211-Q213 PolarHBondContact O-N 3.03Å; Y211-Q214 PolarHBondContact O-N 3.32Å; Y211-Q214 VanDerWaalsContact O-N 3.09Å; Y211-I215 HydrophobicContact CE1-CB 4.16Å; Y211-I215 HydrophobicContact CE2-CD1 3.71Å; Y211-I215 HydrophobicContact CE2-CG1 4.44Å; Y211-I215 PolarHBondContact O-N 3.1Å; Y211-S218 WeakPolarHBondContact CE1-OG 3.48Å; Y211-A221 HydrophobicContact CD1-CB 3.68Å; Y211-A221 HydrophobicContact CE1-CB 3.8Å
212	L	94.6	Very high	93.9	Very high	24 Å²	24	59.2 Å²	59.2	13%	0.126	32%	0.316	C	S	.	.	H	α-helix	trans	-66	-26	-179.5	-74.7	171.4	0	0	0	113.6	L208 A209 Q214 I215 P216 A221 L222 K225	L208-L212 HydrophobicContact CD2-CD1 4.44Å; L208-L212 HydrophobicContact CG-CD1 4.01Å; L208-L212 HydrophobicContact CG-CG 4.46Å; L208-L212 PolarHBondContact O-N 3.47Å; A209-L212 PolarHBondContact O-N 2.92Å; L212-Q214 PolarHBondContact O-N 3.21Å; L212-I215 CarbonylContact O-C 3.5Å; L212-P216 WeakPolarHBondContact O-CA 3.44Å; L212-P216 WeakPolarHBondContact O-CB 3.21Å; L212-A221 HydrophobicContact CD2-CB 3.56Å; L212-A221 HydrophobicContact CG-CB 3.96Å; L212-L222 HydrophobicContact CD1-CD2 4.41Å; L212-L222 HydrophobicContact CD2-CD2 3.98Å; L212-L222 HydrophobicContact CD2-CG 3.96Å; L212-K225 HydrophobicContact CD1-CB 4.35Å; L212-K225 HydrophobicContact CD1-CD 3.91Å
213	Q	95.7	Very high	93.7	Very high	155 Å²	155	55.3 Å²	55.3	72%	0.724	30%	0.295	S	S	*	.	H	α-helix	trans	-61.7	-32.1	172.2	-80.6	176.1	9.5	0	0	112.5	A209 Y211	A209-Q213 WeakPolarHBondContact O-CB 3.22Å; A209-Q213 VanDerWaalsContact O-CG 3.29Å; A209-Q213 WeakPolarHBondContact O-CG 3.42Å; A209-Q213 PolarHBondContact O-N 3.21Å; Y211-Q213 VanDerWaalsContact C-N 3.28Å; Y211-Q213 PolarHBondContact O-N 3.03Å
214	Q	94.1	Very high	93.6	Very high	134 Å²	134	53 Å²	53	63%	0.626	28%	0.28	S	S	*	.	H	α-helix	trans	-94.8	-34.1	-179.9	-62.4	-67.2	-7.7	0	0	112.2	L185 Y211 L212	L185-Q214 HydrophobicContact CD1-CB 4.02Å; L185-Q214 HydrophobicContact CD1-CG 4.08Å; Y211-Q214 PolarHBondContact O-N 3.32Å; Y211-Q214 VanDerWaalsContact O-N 3.09Å; L212-Q214 PolarHBondContact O-N 3.21Å
215	I	91.7	Very high	93.5	Very high	59 Å²	59	55.4 Å²	55.4	30%	0.303	29%	0.291	S	S	.	.			trans	-131.3	74.4	-176.6	-50.2	-177.6	0	0	0	108.9	Y211 L212 D217 S218	Y211-I215 HydrophobicContact CE1-CB 4.16Å; Y211-I215 HydrophobicContact CE2-CD1 3.71Å; Y211-I215 HydrophobicContact CE2-CG1 4.44Å; Y211-I215 PolarHBondContact O-N 3.1Å; L212-I215 CarbonylContact O-C 3.5Å; I215-D217 VanDerWaalsContact C-N 3.25Å; I215-D217 WeakPolarHBondContact CG2-OD1 3.44Å; I215-D217 PolarHBondContact O-N 3.13Å; I215-S218 PolarHBondContact O-N 3.05Å
216	P	89.7	Confident	93.4	Very high	86 Å²	86	53 Å²	53	56%	0.558	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-18.3	-171.6	27.4	-35.6	0	0	0	114.1	L212 L222	L212-P216 WeakPolarHBondContact O-CA 3.44Å; L212-P216 WeakPolarHBondContact O-CB 3.21Å; P216-L222 VanDerWaalsContact O-CD1 3.28Å; P216-L222 WeakPolarHBondContact O-CD1 3.4Å
217	D	85.8	Confident	93.3	Very high	117 Å²	117	47.1 Å²	47.1	63%	0.626	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	4.7	-177.3	63.5	-22.2	0	0	0	113.6	I215 T219	I215-D217 VanDerWaalsContact C-N 3.25Å; I215-D217 WeakPolarHBondContact CG2-OD1 3.44Å; I215-D217 PolarHBondContact O-N 3.13Å; D217-T219 PolarHBondContact O-N 3.15Å; D217-T219 VanDerWaalsContact O-N 3.11Å
218	S	87.7	Confident	93.4	Very high	20 Å²	20	45.8 Å²	45.8	14%	0.14	25%	0.246	C	C	.	.			trans	-65.4	114	-178.9	177.6	0	0	0	0	112.2	Y211 I215 I220 A221 L222	Y211-S218 WeakPolarHBondContact CE1-OG 3.48Å; I215-S218 PolarHBondContact O-N 3.05Å; S218-I220 VanDerWaalsContact C-N 3.33Å; S218-I220 PolarHBondContact O-N 3.08Å; S218-A221 PolarHBondContact O-N 3.3Å; S218-L222 WeakPolarHBondContact O-CB 3.46Å; S218-L222 PolarHBondContact O-N 3.37Å
219	T	86.3	Confident	93.4	Very high	33 Å²	33	46.7 Å²	46.7	20%	0.202	25%	0.25	C	C	.	.	H	α-helix	trans	-61	-39	-178.5	-45	0	0	0	0	113.1	D217 N223 L245 F253 A256 I260	D217-T219 PolarHBondContact O-N 3.15Å; D217-T219 VanDerWaalsContact O-N 3.11Å; T219-N223 WeakPolarHBondContact O-CB 3.37Å; T219-N223 PolarHBondContact O-N 3.39Å; T219-L245 HydrophobicContact CG2-CD1 4.19Å; T219-L245 HydrophobicContact CG2-CD2 4.17Å; T219-F253 HydrophobicContact CG2-CD2 4.26Å; T219-F253 HydrophobicContact CG2-CE2 3.87Å; T219-A256 HydrophobicContact CG2-CB 3.41Å; T219-A256 VanDerWaalsContact CG2-CB 3.41Å; T219-I260 HydrophobicContact CG2-CD1 4.44Å
220	I	89.2	Confident	93.4	Very high	92 Å²	92	47.8 Å²	47.8	47%	0.472	25%	0.247	S	C	.	.	H	α-helix	trans	-66.7	-44.9	179.5	-63.4	170.8	0	0	0	110.2	V189 S218 L224 F255	V189-I220 HydrophobicContact CG1-CG2 4.1Å; S218-I220 VanDerWaalsContact C-N 3.33Å; S218-I220 PolarHBondContact O-N 3.08Å; I220-L224 PolarHBondContact O-N 3.28Å; I220-L224 VanDerWaalsContact O-N 3.08Å; I220-F255 HydrophobicContact CG1-CE2 4.49Å; I220-F255 HydrophobicContact CG1-CZ 4.28Å
221	A	92.6	Very high	93.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-70.5	-44.9	-178.7	0	0	0	0	0	111.6	V189 L208 Y211 L212 S218 N223 L224 K225	V189-A221 HydrophobicContact CG2-CB 4.36Å; L208-A221 HydrophobicContact CD1-CB 3.74Å; L208-A221 WeakPolarHBondContact CD2-O 3.27Å; L208-A221 HydrophobicContact CG-CB 4.49Å; Y211-A221 HydrophobicContact CD1-CB 3.68Å; Y211-A221 HydrophobicContact CE1-CB 3.8Å; L212-A221 HydrophobicContact CD2-CB 3.56Å; L212-A221 HydrophobicContact CG-CB 3.96Å; S218-A221 PolarHBondContact O-N 3.3Å; A221-N223 VanDerWaalsContact C-N 3.31Å; A221-N223 PolarHBondContact O-N 3.26Å; A221-L224 PolarHBondContact O-N 3.5Å; A221-K225 PolarHBondContact O-N 3.19Å
222	L	92.5	Very high	93.2	Very high	15 Å²	15	51.4 Å²	51.4	8%	0.079	26%	0.257	C	S	.	.	H	α-helix	trans	-64	-35.3	176.1	-75	175.2	0	0	0	112.4	L212 P216 S218 K225 A226 L245	L212-L222 HydrophobicContact CD1-CD2 4.41Å; L212-L222 HydrophobicContact CD2-CD2 3.98Å; L212-L222 HydrophobicContact CD2-CG 3.96Å; P216-L222 VanDerWaalsContact O-CD1 3.28Å; P216-L222 WeakPolarHBondContact O-CD1 3.4Å; S218-L222 WeakPolarHBondContact O-CB 3.46Å; S218-L222 PolarHBondContact O-N 3.37Å; L222-K225 HydrophobicContact CD2-CD 4.23Å; L222-K225 WeakPolarHBondContact O-CB 3.47Å; L222-K225 PolarHBondContact O-N 2.97Å; L222-A226 PolarHBondContact O-N 3.31Å; L222-L245 HydrophobicContact CB-CD1 3.63Å; L222-L245 HydrophobicContact CB-CD2 3.83Å; L222-L245 HydrophobicContact CB-CG 3.79Å; L222-L245 HydrophobicContact CD1-CD2 3.32Å; L222-L245 HydrophobicContact CD1-CG 3.79Å; L222-L245 HydrophobicContact CG-CD2 4.2Å; L222-L245 HydrophobicContact CG-CG 4.45Å
223	N	92.9	Very high	93.2	Very high	16 Å²	16	56.4 Å²	56.4	9%	0.086	28%	0.275	C	S	.	.	H	α-helix	trans	-62.1	-45.9	171.6	178.8	78.5	0	0	0	112.1	T219 A221 K225 A226 C227 L259 N263	T219-N223 WeakPolarHBondContact O-CB 3.37Å; T219-N223 PolarHBondContact O-N 3.39Å; A221-N223 VanDerWaalsContact C-N 3.31Å; A221-N223 PolarHBondContact O-N 3.26Å; N223-K225 VanDerWaalsContact C-N 3.31Å; N223-K225 PolarHBondContact O-N 2.84Å; N223-A226 WeakPolarHBondContact O-CB 3.4Å; N223-A226 PolarHBondContact O-N 3.37Å; N223-C227 PolarHBondContact O-N 2.92Å; N223-C227 PolarHBondContact O-SG 2.99Å; N223-C227 VanDerWaalsContact O-SG 3.35Å; N223-L259 HydrophobicContact CB-CD2 4.38Å; N223-N263 PolarHBondContact OD1-ND2 3.39Å
224	L	95.1	Very high	93.1	Very high	7 Å²	7	53 Å²	53	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-63.5	-38.6	176	-179.1	59.5	0	0	0	111.8	A192 L193 Y196 L208 I220 A221 A226 C227 N228	A192-L224 HydrophobicContact CB-CD2 3.87Å; L193-L224 HydrophobicContact CB-CD2 4.49Å; L193-L224 HydrophobicContact CD2-CD1 3.76Å; L193-L224 HydrophobicContact CD2-CD2 3.72Å; L193-L224 HydrophobicContact CD2-CG 4.24Å; L193-L224 HydrophobicContact CG-CD2 3.78Å; Y196-L224 HydrophobicContact CD1-CD1 4.41Å; Y196-L224 HydrophobicContact CD2-CD1 3.87Å; Y196-L224 HydrophobicContact CG-CD1 3.79Å; L208-L224 HydrophobicContact CD1-CD2 4.1Å; L208-L224 HydrophobicContact CD2-CB 3.93Å; L208-L224 HydrophobicContact CD2-CD2 4Å; L208-L224 HydrophobicContact CD2-CG 3.87Å; I220-L224 PolarHBondContact O-N 3.28Å; I220-L224 VanDerWaalsContact O-N 3.08Å; A221-L224 PolarHBondContact O-N 3.5Å; L224-A226 VanDerWaalsContact C-N 3.34Å; L224-A226 PolarHBondContact O-N 3.01Å; L224-C227 WeakPolarHBondContact O-CB 3.46Å; L224-C227 PolarHBondContact O-N 3.19Å; L224-N228 PolarHBondContact O-N 3.47Å
225	K	96.3	Very high	93.1	Very high	50 Å²	50	47.2 Å²	47.2	22%	0.217	24%	0.238	C	C	.	.	H	α-helix	trans	-59.4	-45	174.2	-174.4	-173.9	175.6	-156.1	0	111.2	L208 L212 A221 L222 N223 C227 N228 H229 E241	L208-K225 HydrophobicContact CD2-CB 3.9Å; L212-K225 HydrophobicContact CD1-CB 4.35Å; L212-K225 HydrophobicContact CD1-CD 3.91Å; A221-K225 PolarHBondContact O-N 3.19Å; L222-K225 HydrophobicContact CD2-CD 4.23Å; L222-K225 WeakPolarHBondContact O-CB 3.47Å; L222-K225 PolarHBondContact O-N 2.97Å; N223-K225 VanDerWaalsContact C-N 3.31Å; N223-K225 PolarHBondContact O-N 2.84Å; K225-C227 VanDerWaalsContact C-N 3.32Å; K225-C227 PolarHBondContact O-N 2.99Å; K225-N228 WeakPolarHBondContact O-CB 3.42Å; K225-N228 PolarHBondContact O-N 3.14Å; K225-H229 PolarHBondContact O-CD2 3.25Å; K225-H229 PolarHBondContact O-N 2.83Å; K225-E241 WeakPolarHBondContact CD-OE2 3.42Å; K225-E241 WeakPolarHBondContact CE-OE1 3.45Å; K225-E241 VanDerWaalsContact CE-OE2 3.27Å; K225-E241 WeakPolarHBondContact CE-OE2 3.43Å; K225-E241 IonicContact NZ-OE1 2.67Å; K225-E241 PolarHBondContact NZ-OE1 3.42Å; K225-E241 IonicContact NZ-OE2 2.92Å; K225-E241 PolarHBondContact NZ-OE2 2.87Å
226	A	95.8	Very high	93.3	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.3	-42.2	174.9	0	0	0	0	0	111.8	L222 N223 L224 H229 F230 A238 E241 L242 F267	L222-A226 PolarHBondContact O-N 3.31Å; N223-A226 WeakPolarHBondContact O-CB 3.4Å; N223-A226 PolarHBondContact O-N 3.37Å; L224-A226 VanDerWaalsContact C-N 3.34Å; L224-A226 PolarHBondContact O-N 3.01Å; A226-H229 PolarHBondContact O-N 3.41Å; A226-F230 PolarHBondContact O-N 3.44Å; A226-A238 VanDerWaalsContact O-CB 3.24Å; A226-A238 WeakPolarHBondContact O-CB 3.37Å; A226-E241 HydrophobicContact CB-CB 3.87Å; A226-L242 HydrophobicContact CB-CD1 4.49Å; A226-L242 HydrophobicContact CB-CD2 3.64Å; A226-L242 HydrophobicContact CB-CG 3.7Å; A226-F267 HydrophobicContact CB-CE2 3.96Å; A226-F267 HydrophobicContact CB-CZ 4.26Å
227	C	96.4	Very high	93.6	Very high	16 Å²	16	52.2 Å²	52.2	11%	0.108	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-42.9	173.8	-64.9	0	0	0	0	112.5	Y196 N223 L224 K225 H229 F230 R231	Y196-C227 HydrophobicContact CD2-CB 4.42Å; Y196-C227 HydrophobicContact CE2-CB 3.59Å; N223-C227 PolarHBondContact O-N 2.92Å; N223-C227 PolarHBondContact O-SG 2.99Å; N223-C227 VanDerWaalsContact O-SG 3.35Å; L224-C227 WeakPolarHBondContact O-CB 3.46Å; L224-C227 PolarHBondContact O-N 3.19Å; K225-C227 VanDerWaalsContact C-N 3.32Å; K225-C227 PolarHBondContact O-N 2.99Å; C227-H229 PolarHBondContact O-N 2.92Å; C227-F230 WeakPolarHBondContact O-CB 3.38Å; C227-F230 PolarHBondContact O-N 2.99Å; C227-R231 WeakPolarHBondContact O-CG 3.43Å; C227-R231 PolarHBondContact O-N 3.29Å
228	N	97.6	Very high	94	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58.3	-48	173.7	-81.8	-37.6	0	0	0	111.3	Y196 Y201 S204 Q205 L224 K225 F230 R231 L232	Y196-N228 VanDerWaalsContact CD2-OD1 3.3Å; Y196-N228 WeakPolarHBondContact CD2-OD1 3.32Å; Y201-N228 PolarHBondContact O-OD1 3.21Å; S204-N228 PolarHBondContact OG-ND2 3.33Å; S204-N228 PolarHBondContact OG-OD1 3.09Å; Q205-N228 HydrophobicContact CB-CB 4.5Å; L224-N228 PolarHBondContact O-N 3.47Å; K225-N228 WeakPolarHBondContact O-CB 3.42Å; K225-N228 PolarHBondContact O-N 3.14Å; N228-F230 VanDerWaalsContact C-N 3.27Å; N228-F230 PolarHBondContact O-N 3.49Å; N228-R231 PolarHBondContact O-N 3.39Å; N228-R231 VanDerWaalsContact O-N 3.09Å; N228-L232 WeakPolarHBondContact O-CB 3.31Å; N228-L232 WeakPolarHBondContact O-CG 3.45Å; N228-L232 PolarHBondContact O-N 2.95Å
229	H	97.3	Very high	94.3	Very high	20 Å²	20	47 Å²	47	9%	0.093	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-33.2	178.8	-80.1	-150	0	0	0	113.2	Q205 K225 A226 C227 R231 Y233 N234 A237 A238 E241	Q205-H229 PolarHBondContact NE2-NE2 3.09Å; Q205-H229 PolarHBondContact OE1-CD2 3.01Å; K225-H229 PolarHBondContact O-CD2 3.25Å; K225-H229 PolarHBondContact O-N 2.83Å; A226-H229 PolarHBondContact O-N 3.41Å; C227-H229 PolarHBondContact O-N 2.92Å; H229-R231 VanDerWaalsContact C-N 3.32Å; H229-Y233 HydrophobicContact CB-CD2 4.01Å; H229-Y233 HydrophobicContact CB-CE2 4.48Å; H229-Y233 AromaticContact CD2-CE2 3.76Å; H229-Y233 AromaticContact CG-CD2 3.89Å; H229-Y233 AromaticContact CG-CE2 3.94Å; H229-Y233 AromaticContact NE2-CE2 3.96Å; H229-Y233 WeakPolarHBondContact O-CA 3.43Å; H229-Y233 WeakPolarHBondContact O-CB 3.48Å; H229-Y233 PolarHBondContact O-N 3.32Å; H229-N234 PolarHBondContact O-N 2.99Å; H229-A237 HydrophobicContact CB-CB 4.36Å; H229-A238 HydrophobicContact CB-CB 4.44Å; H229-E241 IonicContact CE1-OE1 3.19Å; H229-E241 PolarHBondContact CE1-OE1 3.39Å; H229-E241 IonicContact ND1-OE1 3.91Å
230	F	96.9	Very high	94.6	Very high	61 Å²	61	48.3 Å²	48.3	27%	0.268	23%	0.231	S	C	.	.	H	α-helix	trans	-62.6	-41.8	174.6	-180	-117.3	0	0	0	111.8	A226 C227 N228 A238 V266 F267	A226-F230 PolarHBondContact O-N 3.44Å; C227-F230 WeakPolarHBondContact O-CB 3.38Å; C227-F230 PolarHBondContact O-N 2.99Å; N228-F230 VanDerWaalsContact C-N 3.27Å; N228-F230 PolarHBondContact O-N 3.49Å; F230-A238 HydrophobicContact CB-CB 3.67Å; F230-A238 HydrophobicContact CD2-CB 4.42Å; F230-V266 HydrophobicContact CE1-CG1 3.9Å; F230-V266 HydrophobicContact CZ-CG1 3.99Å; F230-F267 HydrophobicContact CB-CD1 3.8Å; F230-F267 HydrophobicContact CB-CE1 3.48Å; F230-F267 VanDerWaalsContact CB-CE1 3.48Å; F230-F267 HydrophobicContact CB-CZ 4.15Å; F230-F267 AromaticContact CD1-CD1 4Å; F230-F267 HydrophobicContact CD1-CD1 4Å; F230-F267 AromaticContact CD1-CE1 3.91Å; F230-F267 HydrophobicContact CD1-CE1 3.91Å; F230-F267 HydrophobicContact CD2-CB 4.42Å; F230-F267 AromaticContact CD2-CD1 3.4Å; F230-F267 HydrophobicContact CD2-CD1 3.4Å; F230-F267 VanDerWaalsContact CD2-CD1 3.4Å; F230-F267 AromaticContact CD2-CE1 3.99Å; F230-F267 HydrophobicContact CD2-CE1 3.99Å; F230-F267 HydrophobicContact CD2-CG 4.16Å; F230-F267 HydrophobicContact CE1-CD1 4.44Å; F230-F267 AromaticContact CE2-CD1 3.9Å; F230-F267 HydrophobicContact CE2-CD1 3.9Å; F230-F267 AromaticContact CG-CD1 3.45Å; F230-F267 HydrophobicContact CG-CD1 3.45Å; F230-F267 VanDerWaalsContact CG-CD1 3.45Å; F230-F267 AromaticContact CG-CE1 3.52Å; F230-F267 HydrophobicContact CG-CE1 3.52Å; F230-F267 HydrophobicContact CZ-CD1 4.39Å
231	R	94.4	Very high	94.7	Very high	129 Å²	129	45.5 Å²	45.5	49%	0.487	22%	0.217	S	C	.	.	H	α-helix	trans	-79	-36.4	-177.5	-57.8	-65.2	-80.7	-178.5	-6.9	112.7	Y196 Y201 C227 N228 H229	Y196-R231 HydrophobicContact CE2-CG 4.17Å; Y201-R231 HydrophobicContact CD1-CB 4.04Å; Y201-R231 HydrophobicContact CD1-CG 4.2Å; Y201-R231 HydrophobicContact CD2-CB 3.66Å; Y201-R231 HydrophobicContact CE1-CB 4.01Å; Y201-R231 HydrophobicContact CE1-CG 3.83Å; Y201-R231 HydrophobicContact CE2-CB 3.59Å; Y201-R231 HydrophobicContact CE2-CG 4.16Å; Y201-R231 HydrophobicContact CG-CB 3.88Å; Y201-R231 PolarHBondContact OH-NE 3.47Å; Y201-R231 PolarHBondContact OH-NH2 2.93Å; C227-R231 WeakPolarHBondContact O-CG 3.43Å; C227-R231 PolarHBondContact O-N 3.29Å; N228-R231 PolarHBondContact O-N 3.39Å; N228-R231 VanDerWaalsContact O-N 3.09Å; H229-R231 VanDerWaalsContact C-N 3.32Å
232	L	94.2	Very high	94.5	Very high	46 Å²	46	45.5 Å²	45.5	24%	0.241	22%	0.217	C	C	.	.	H	α-helix	trans	-82.2	-34	-178.9	-70.8	172.2	0	0	0	113.5	Y201 D202 N228	Y201-L232 HydrophobicContact CD2-CD2 4.4Å; D202-L232 WeakPolarHBondContact OD1-CD1 3.35Å; D202-L232 VanDerWaalsContact OD1-CD2 3.24Å; D202-L232 WeakPolarHBondContact OD1-CD2 3.46Å; N228-L232 WeakPolarHBondContact O-CB 3.31Å; N228-L232 WeakPolarHBondContact O-CG 3.45Å; N228-L232 PolarHBondContact O-N 2.95Å
233	Y	94.4	Very high	94	Very high	129 Å²	129	49.9 Å²	49.9	51%	0.506	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-83.6	-171.8	-45.6	-57.3	0	0	0	111.1	H229 A237	H229-Y233 HydrophobicContact CB-CD2 4.01Å; H229-Y233 HydrophobicContact CB-CE2 4.48Å; H229-Y233 AromaticContact CD2-CE2 3.76Å; H229-Y233 AromaticContact CG-CD2 3.89Å; H229-Y233 AromaticContact CG-CE2 3.94Å; H229-Y233 AromaticContact NE2-CE2 3.96Å; H229-Y233 WeakPolarHBondContact O-CA 3.43Å; H229-Y233 WeakPolarHBondContact O-CB 3.48Å; H229-Y233 PolarHBondContact O-N 3.32Å; Y233-A237 HydrophobicContact CD2-CB 4.32Å
234	N	93.6	Very high	93.3	Very high	82 Å²	82	51.2 Å²	51.2	44%	0.439	25%	0.246	S	C	.	.			trans	-175	174.2	-178.5	53.9	66.9	0	0	0	111.8	H229 R236 A237 A238	H229-N234 PolarHBondContact O-N 2.99Å; N234-R236 VanDerWaalsContact C-N 3.32Å; N234-R236 PolarHBondContact O-N 3.33Å; N234-R236 WeakPolarHBondContact OD1-CB 3.5Å; N234-R236 PolarHBondContact OD1-N 3.38Å; N234-A237 PolarHBondContact O-N 2.95Å; N234-A237 PolarHBondContact OD1-N 3.21Å; N234-A238 PolarHBondContact O-N 2.99Å
235	G	95	Very high	92.4	Very high	13 Å²	13	51.2 Å²	51.2	13%	0.134	25%	0.245	C	C	.	.	H	α-helix	trans	-56.8	-34.2	176	0	0	0	0	0	115.9	A238 E239 F267	G235-A238 PolarHBondContact O-N 3.15Å; G235-E239 WeakPolarHBondContact O-CB 3.45Å; G235-E239 PolarHBondContact O-N 3.1Å; G235-F267 VanDerWaalsContact CA-O 3.29Å; G235-F267 WeakPolarHBondContact CA-O 3.27Å
236	R	95.5	Very high	91.4	Very high	222 Å²	222	53.6 Å²	53.6	84%	0.838	26%	0.259	S	S	*	.	H	α-helix	trans	-70.8	-41.7	-178.9	-65.2	-178.3	179.9	171.6	0.5	111.7	N234 E239 A240	N234-R236 VanDerWaalsContact C-N 3.32Å; N234-R236 PolarHBondContact O-N 3.33Å; N234-R236 WeakPolarHBondContact OD1-CB 3.5Å; N234-R236 PolarHBondContact OD1-N 3.38Å; R236-E239 PolarHBondContact O-N 3.33Å; R236-A240 PolarHBondContact O-N 3.34Å; R236-A240 VanDerWaalsContact O-N 3.13Å
237	A	95.1	Very high	90.2	Very high	28 Å²	28	60.1 Å²	60.1	23%	0.231	29%	0.294	C	S	.	.	H	α-helix	trans	-61.7	-46.3	174.5	0	0	0	0	0	110.8	H229 Y233 N234 E239 A240 E241	H229-A237 HydrophobicContact CB-CB 4.36Å; Y233-A237 HydrophobicContact CD2-CB 4.32Å; N234-A237 PolarHBondContact O-N 2.95Å; N234-A237 PolarHBondContact OD1-N 3.21Å; A237-E239 PolarHBondContact O-N 2.97Å; A237-A240 PolarHBondContact O-N 3.21Å; A237-E241 PolarHBondContact O-N 3.42Å
238	A	95.8	Very high	88.8	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-61.6	-41.5	177.6	0	0	0	0	0	113.3	A226 H229 F230 N234 G235 A240 E241 L242 F267	A226-A238 VanDerWaalsContact O-CB 3.24Å; A226-A238 WeakPolarHBondContact O-CB 3.37Å; H229-A238 HydrophobicContact CB-CB 4.44Å; F230-A238 HydrophobicContact CB-CB 3.67Å; F230-A238 HydrophobicContact CD2-CB 4.42Å; N234-A238 PolarHBondContact O-N 2.99Å; G235-A238 PolarHBondContact O-N 3.15Å; A238-A240 PolarHBondContact O-N 3.17Å; A238-E241 PolarHBondContact O-N 3.46Å; A238-L242 PolarHBondContact O-N 3.35Å; A238-F267 HydrophobicContact CB-CB 4.48Å; A238-F267 HydrophobicContact CB-CD1 4.06Å; A238-F267 HydrophobicContact CB-CD2 3.48Å; A238-F267 VanDerWaalsContact CB-CD2 3.48Å; A238-F267 HydrophobicContact CB-CE1 4.14Å; A238-F267 HydrophobicContact CB-CE2 3.55Å; A238-F267 HydrophobicContact CB-CG 3.75Å; A238-F267 HydrophobicContact CB-CZ 3.89Å
239	E	94.3	Very high	86.8	Confident	28 Å²	28	67.7 Å²	67.7	13%	0.131	34%	0.34	C	S	.	.	H	α-helix	trans	-65.5	-36.7	177.1	178.9	173.2	161.6	0	0	112.5	G235 R236 A237 E241 L242 K243 L264 R268	G235-E239 WeakPolarHBondContact O-CB 3.45Å; G235-E239 PolarHBondContact O-N 3.1Å; R236-E239 PolarHBondContact O-N 3.33Å; A237-E239 PolarHBondContact O-N 2.97Å; E239-E241 VanDerWaalsContact C-N 3.29Å; E239-E241 PolarHBondContact O-N 3.31Å; E239-L242 PolarHBondContact O-N 3.17Å; E239-K243 HydrophobicContact CG-CD 4.41Å; E239-K243 HydrophobicContact CG-CG 4.47Å; E239-K243 PolarHBondContact O-N 3.24Å; E239-K243 WeakPolarHBondContact OE1-CE 3.36Å; E239-K243 IonicContact OE1-NZ 2.85Å; E239-K243 PolarHBondContact OE1-NZ 2.76Å; E239-L264 HydrophobicContact CB-CD2 4.35Å; E239-L264 HydrophobicContact CG-CD2 3.77Å; E239-R268 VanDerWaalsContact CD-NH2 3.32Å; E239-R268 IonicContact OE1-CZ 2.57Å; E239-R268 IonicContact OE1-NE 3.72Å; E239-R268 IonicContact OE1-NH2 2.67Å; E239-R268 PolarHBondContact OE1-NH2 3.45Å; E239-R268 IonicContact OE2-CZ 2.83Å; E239-R268 IonicContact OE2-NE 3.85Å; E239-R268 PolarHBondContact OE2-NE 3.26Å; E239-R268 IonicContact OE2-NH2 2.88Å
240	A	92.6	Very high	84.9	Confident	60 Å²	60	70.4 Å²	70.4	50%	0.496	36%	0.361	S	S	.	.	H	α-helix	trans	-61	-39.3	177.4	0	0	0	0	0	112	R236 A237 A238 K243	R236-A240 PolarHBondContact O-N 3.34Å; R236-A240 VanDerWaalsContact O-N 3.13Å; A237-A240 PolarHBondContact O-N 3.21Å; A238-A240 PolarHBondContact O-N 3.17Å; A240-K243 PolarHBondContact O-N 3.4Å
241	E	90.5	Very high	82.8	Confident	34 Å²	34	73.3 Å²	73.3	16%	0.159	39%	0.389	C	S	.	.	H	α-helix	trans	-63.5	-41.3	175	-65.7	-66	167.5	0	0	111.6	K225 A226 H229 A237 A238 E239 S244	K225-E241 WeakPolarHBondContact CD-OE2 3.42Å; K225-E241 WeakPolarHBondContact CE-OE1 3.45Å; K225-E241 VanDerWaalsContact CE-OE2 3.27Å; K225-E241 WeakPolarHBondContact CE-OE2 3.43Å; K225-E241 IonicContact NZ-OE1 2.67Å; K225-E241 PolarHBondContact NZ-OE1 3.42Å; K225-E241 IonicContact NZ-OE2 2.92Å; K225-E241 PolarHBondContact NZ-OE2 2.87Å; A226-E241 HydrophobicContact CB-CB 3.87Å; H229-E241 IonicContact CE1-OE1 3.19Å; H229-E241 PolarHBondContact CE1-OE1 3.39Å; H229-E241 IonicContact ND1-OE1 3.91Å; A237-E241 PolarHBondContact O-N 3.42Å; A238-E241 PolarHBondContact O-N 3.46Å; E239-E241 VanDerWaalsContact C-N 3.29Å; E239-E241 PolarHBondContact O-N 3.31Å; E241-S244 PolarHBondContact O-OG 2.98Å
242	L	87.2	Confident	80.8	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-72.8	-29.1	178.2	-66.9	-173.4	0	0	0	114	A226 A238 E239 S244 L245 M246 I260 N263 L264 F267	A226-L242 HydrophobicContact CB-CD1 4.49Å; A226-L242 HydrophobicContact CB-CD2 3.64Å; A226-L242 HydrophobicContact CB-CG 3.7Å; A238-L242 PolarHBondContact O-N 3.35Å; E239-L242 PolarHBondContact O-N 3.17Å; L242-S244 VanDerWaalsContact C-N 3.27Å; L242-S244 PolarHBondContact O-N 3.35Å; L242-L245 HydrophobicContact CD2-CD1 3.92Å; L242-L245 WeakPolarHBondContact O-CB 3.41Å; L242-L245 PolarHBondContact O-N 2.91Å; L242-L245 VanDerWaalsContact O-N 3.1Å; L242-M246 PolarHBondContact O-N 3.08Å; L242-M246 VanDerWaalsContact O-N 3.17Å; L242-I260 HydrophobicContact CD1-CG2 4.31Å; L242-I260 HydrophobicContact CD2-CG1 4.41Å; L242-N263 HydrophobicContact CD1-CB 3.91Å; L242-L264 HydrophobicContact CB-CD2 4.45Å; L242-L264 HydrophobicContact CD1-CD2 4.11Å; L242-L264 HydrophobicContact CD1-CG 4.18Å; L242-F267 HydrophobicContact CD1-CD2 3.94Å; L242-F267 HydrophobicContact CD1-CE2 3.51Å; L242-F267 HydrophobicContact CG-CE2 4.12Å
243	K	83.8	Confident	79.2	Confident	106 Å²	106	69.7 Å²	69.7	46%	0.461	39%	0.385	S	S	.	.	H	α-helix	trans	-60	-40.3	175.6	-80	175.7	178.3	160.2	0	111.7	E239 A240 L245 M246 D247	E239-K243 HydrophobicContact CG-CD 4.41Å; E239-K243 HydrophobicContact CG-CG 4.47Å; E239-K243 PolarHBondContact O-N 3.24Å; E239-K243 WeakPolarHBondContact OE1-CE 3.36Å; E239-K243 IonicContact OE1-NZ 2.85Å; E239-K243 PolarHBondContact OE1-NZ 2.76Å; A240-K243 PolarHBondContact O-N 3.4Å; K243-L245 PolarHBondContact O-N 3.45Å; K243-M246 PolarHBondContact O-N 3.37Å; K243-M246 VanDerWaalsContact O-N 3.08Å; K243-D247 PolarHBondContact O-N 3.45Å
244	S	76.7	Confident	77.9	Confident	45 Å²	45	68.7 Å²	68.7	32%	0.315	39%	0.385	S	S	.	.	H	α-helix	trans	-59.2	-28.2	176	78.1	0	0	0	0	113.6	E241 L242 N248	E241-S244 PolarHBondContact O-OG 2.98Å; L242-S244 VanDerWaalsContact C-N 3.27Å; L242-S244 PolarHBondContact O-N 3.35Å; S244-N248 PolarHBondContact O-ND2 3.14Å
245	L	76.5	Confident	76.7	Confident	6 Å²	6	69.2 Å²	69.2	3%	0.031	38%	0.384	C	S	.	.	H	α-helix	trans	-78.2	-40.7	174.7	-77	173.4	0	0	0	112.6	T219 L222 L242 K243 D247 N248 A249 F253 I260	T219-L245 HydrophobicContact CG2-CD1 4.19Å; T219-L245 HydrophobicContact CG2-CD2 4.17Å; L222-L245 HydrophobicContact CB-CD1 3.63Å; L222-L245 HydrophobicContact CB-CD2 3.83Å; L222-L245 HydrophobicContact CB-CG 3.79Å; L222-L245 HydrophobicContact CD1-CD2 3.32Å; L222-L245 HydrophobicContact CD1-CG 3.79Å; L222-L245 HydrophobicContact CG-CD2 4.2Å; L222-L245 HydrophobicContact CG-CG 4.45Å; L242-L245 HydrophobicContact CD2-CD1 3.92Å; L242-L245 WeakPolarHBondContact O-CB 3.41Å; L242-L245 PolarHBondContact O-N 2.91Å; L242-L245 VanDerWaalsContact O-N 3.1Å; K243-L245 PolarHBondContact O-N 3.45Å; L245-D247 VanDerWaalsContact C-N 3.27Å; L245-D247 PolarHBondContact O-N 2.84Å; L245-N248 PolarHBondContact O-N 2.95Å; L245-A249 PolarHBondContact O-N 3.25Å; L245-F253 HydrophobicContact CB-CE2 4.32Å; L245-F253 HydrophobicContact CB-CZ 4.17Å; L245-F253 WeakPolarHBondContact O-CZ 3.37Å; L245-I260 HydrophobicContact CB-CD1 4.41Å; L245-I260 HydrophobicContact CD1-CD1 4.34Å
246	M	74.8	Confident	75.9	Confident	100 Å²	100	68.6 Å²	68.6	49%	0.493	38%	0.377	S	S	.	.	H	α-helix	trans	-62.8	-36.5	-178.9	-69.7	-177.2	62	0	0	111.8	L242 K243 N248 I260 L264	L242-M246 PolarHBondContact O-N 3.08Å; L242-M246 VanDerWaalsContact O-N 3.17Å; K243-M246 PolarHBondContact O-N 3.37Å; K243-M246 VanDerWaalsContact O-N 3.08Å; M246-N248 VanDerWaalsContact C-N 3.3Å; M246-N248 PolarHBondContact O-N 3.22Å; M246-I260 HydrophobicContact CG-CG2 4.27Å; M246-I260 HydrophobicContact SD-CG2 4.35Å; M246-L264 HydrophobicContact SD-CD1 4.08Å
247	D	71.7	Confident	75.4	Confident	138 Å²	138	62.1 Å²	62.1	74%	0.738	36%	0.355	S	S	*	.	H	α-helix	trans	-70.9	-25.2	179.6	-65.1	-21.4	0	0	0	112.9	K243 L245	K243-D247 PolarHBondContact O-N 3.45Å; L245-D247 VanDerWaalsContact C-N 3.27Å; L245-D247 PolarHBondContact O-N 2.84Å
248	N	65.9	Low	75.1	Confident	126 Å²	126	63.9 Å²	63.9	67%	0.674	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	10.8	-174.2	-70	-43.5	0	0	0	114.1	S244 L245 M246 S250	S244-N248 PolarHBondContact O-ND2 3.14Å; L245-N248 PolarHBondContact O-N 2.95Å; M246-N248 VanDerWaalsContact C-N 3.3Å; M246-N248 PolarHBondContact O-N 3.22Å; N248-S250 PolarHBondContact O-N 3.44Å; N248-S250 VanDerWaalsContact O-N 3.17Å
249	A	57.2	Low	74.8	Confident	49 Å²	49	64.5 Å²	64.5	41%	0.405	36%	0.362	S	S	.	.			trans	-65.8	113.4	-169.7	0	0	0	0	0	113.6	L245 F253	L245-A249 PolarHBondContact O-N 3.25Å; A249-F253 HydrophobicContact CB-CB 4.14Å; A249-F253 HydrophobicContact CB-CD1 3.57Å; A249-F253 HydrophobicContact CB-CD2 3.82Å; A249-F253 HydrophobicContact CB-CE1 3.76Å; A249-F253 HydrophobicContact CB-CE2 3.98Å; A249-F253 HydrophobicContact CB-CG 3.61Å; A249-F253 HydrophobicContact CB-CZ 3.94Å
250	S	55.7	Low	74.6	Confident	76 Å²	76	63.4 Å²	63.4	53%	0.531	36%	0.357	S	S	.	.			trans	-87.4	177.4	168.2	45.4	0	0	0	0	111.9	N248 S252 F253	N248-S250 PolarHBondContact O-N 3.44Å; N248-S250 VanDerWaalsContact O-N 3.17Å; S250-S252 PolarHBondContact O-N 3.43Å; S250-S252 PolarHBondContact OG-OG 3.42Å; S250-F253 WeakPolarHBondContact O-CB 3.07Å; S250-F253 PolarHBondContact O-N 3.1Å
251	S	53.2	Low	74.6	Confident	122 Å²	122	66.1 Å²	66.1	85%	0.853	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-64.4	-19.9	-175.9	53.7	0	0	0	0	114.9	F253	S251-F253 PolarHBondContact O-N 3.32Å
252	S	53.2	Low	74.8	Confident	85 Å²	85	64.8 Å²	64.8	59%	0.594	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-72.9	2.5	174.9	45.9	0	0	0	0	113.8	S250 F255	S250-S252 PolarHBondContact O-N 3.43Å; S250-S252 PolarHBondContact OG-OG 3.42Å; S252-F255 WeakPolarHBondContact O-CD1 3.5Å
253	F	61.1	Low	75.2	Confident	15 Å²	15	65.4 Å²	65.4	7%	0.066	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-85.6	-7.9	-170.6	-155.1	-104.4	0	0	0	114.9	T219 L245 A249 S250 S251 F255 A256 K257 I260	T219-F253 HydrophobicContact CG2-CD2 4.26Å; T219-F253 HydrophobicContact CG2-CE2 3.87Å; L245-F253 HydrophobicContact CB-CE2 4.32Å; L245-F253 HydrophobicContact CB-CZ 4.17Å; L245-F253 WeakPolarHBondContact O-CZ 3.37Å; A249-F253 HydrophobicContact CB-CB 4.14Å; A249-F253 HydrophobicContact CB-CD1 3.57Å; A249-F253 HydrophobicContact CB-CD2 3.82Å; A249-F253 HydrophobicContact CB-CE1 3.76Å; A249-F253 HydrophobicContact CB-CE2 3.98Å; A249-F253 HydrophobicContact CB-CG 3.61Å; A249-F253 HydrophobicContact CB-CZ 3.94Å; S250-F253 WeakPolarHBondContact O-CB 3.07Å; S250-F253 PolarHBondContact O-N 3.1Å; S251-F253 PolarHBondContact O-N 3.32Å; F253-F255 VanDerWaalsContact C-N 3.35Å; F253-F255 PolarHBondContact O-N 3.2Å; F253-A256 HydrophobicContact CD2-CB 4.35Å; F253-A256 HydrophobicContact CG-CB 4.42Å; F253-A256 WeakPolarHBondContact O-CB 3.41Å; F253-A256 PolarHBondContact O-N 3.26Å; F253-K257 HydrophobicContact CD1-CD 4.48Å; F253-K257 HydrophobicContact CD1-CG 3.58Å; F253-K257 HydrophobicContact CE1-CG 4.12Å; F253-K257 WeakPolarHBondContact O-CG 3.19Å; F253-K257 PolarHBondContact O-N 3.41Å; F253-I260 HydrophobicContact CE1-CD1 3.67Å; F253-I260 HydrophobicContact CE2-CD1 4.08Å; F253-I260 HydrophobicContact CZ-CD1 3.26Å
254	E	66.2	Low	75.7	Confident	108 Å²	108	61 Å²	61	51%	0.505	33%	0.333	S	S	.	.	H	α-helix	trans	-54.5	-44.3	-174.3	-77.9	-59.9	147	0	0	113.7	A256 K257	E254-A256 VanDerWaalsContact C-N 3.27Å; E254-A256 PolarHBondContact O-N 3.26Å; E254-K257 PolarHBondContact O-N 3.25Å; E254-K257 IonicContact OE1-NZ 3.39Å; E254-K257 PolarHBondContact OE1-NZ 3.17Å; E254-K257 IonicContact OE2-NZ 2.94Å
255	F	69	Low	76.7	Confident	92 Å²	92	59.2 Å²	59.2	40%	0.404	32%	0.32	S	S	.	.	H	α-helix	trans	-65.2	-33.9	178.4	85	-91.4	0	0	0	112.3	L3 I220 S252 F253	L3-F255 HydrophobicContact CD1-CB 3.91Å; L3-F255 HydrophobicContact CD1-CD2 4.24Å; I220-F255 HydrophobicContact CG1-CE2 4.49Å; I220-F255 HydrophobicContact CG1-CZ 4.28Å; S252-F255 WeakPolarHBondContact O-CD1 3.5Å; F253-F255 VanDerWaalsContact C-N 3.35Å; F253-F255 PolarHBondContact O-N 3.2Å
256	A	78.6	Confident	77.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-77.9	-25.4	-177.9	0	0	0	0	0	112	T219 F253 E254 E258 L259 I260	T219-A256 HydrophobicContact CG2-CB 3.41Å; T219-A256 VanDerWaalsContact CG2-CB 3.41Å; F253-A256 HydrophobicContact CD2-CB 4.35Å; F253-A256 HydrophobicContact CG-CB 4.42Å; F253-A256 WeakPolarHBondContact O-CB 3.41Å; F253-A256 PolarHBondContact O-N 3.26Å; E254-A256 VanDerWaalsContact C-N 3.27Å; E254-A256 PolarHBondContact O-N 3.26Å; A256-E258 PolarHBondContact O-N 3.1Å; A256-L259 PolarHBondContact O-N 2.86Å; A256-I260 HydrophobicContact CB-CD1 4.18Å; A256-I260 VanDerWaalsContact O-CB 3.31Å; A256-I260 WeakPolarHBondContact O-CB 3.36Å; A256-I260 WeakPolarHBondContact O-CD1 3.1Å; A256-I260 WeakPolarHBondContact O-CG1 3.43Å; A256-I260 PolarHBondContact O-N 3.4Å
257	K	84.2	Confident	78.6	Confident	87 Å²	87	56.4 Å²	56.4	38%	0.378	31%	0.307	S	S	.	.	H	α-helix	trans	-56.6	-49.9	178.6	-71.9	179.3	-174.5	176.6	0	111.9	F253 E254 L259 I260 R261	F253-K257 HydrophobicContact CD1-CD 4.48Å; F253-K257 HydrophobicContact CD1-CG 3.58Å; F253-K257 HydrophobicContact CE1-CG 4.12Å; F253-K257 WeakPolarHBondContact O-CG 3.19Å; F253-K257 PolarHBondContact O-N 3.41Å; E254-K257 PolarHBondContact O-N 3.25Å; E254-K257 IonicContact OE1-NZ 3.39Å; E254-K257 PolarHBondContact OE1-NZ 3.17Å; E254-K257 IonicContact OE2-NZ 2.94Å; K257-L259 PolarHBondContact O-N 3.08Å; K257-I260 PolarHBondContact O-N 3.17Å; K257-R261 WeakPolarHBondContact O-CB 3.41Å; K257-R261 VanDerWaalsContact O-CG 3.23Å; K257-R261 WeakPolarHBondContact O-CG 3.34Å; K257-R261 PolarHBondContact O-N 3.42Å
258	E	88.2	Confident	79.8	Confident	65 Å²	65	54.6 Å²	54.6	30%	0.304	29%	0.29	S	S	.	.	H	α-helix	trans	-63.9	-42.3	-178.6	-68.4	-75.1	94.1	0	0	111.2	A256 R261 H262 L280	A256-E258 PolarHBondContact O-N 3.1Å; E258-R261 PolarHBondContact O-N 2.96Å; E258-R261 IonicContact OE1-NH1 3.6Å; E258-H262 WeakPolarHBondContact O-CB 3.41Å; E258-H262 PolarHBondContact O-N 3.19Å; E258-L280 HydrophobicContact CB-CD2 3.82Å; E258-L280 HydrophobicContact CG-CD2 4.2Å; E258-L280 WeakPolarHBondContact OE2-CD2 3.46Å
259	L	89.7	Confident	81.1	Confident	12 Å²	12	50.7 Å²	50.7	6%	0.063	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-46.3	175	172.5	57.3	0	0	0	112.9	M1 N223 A256 K257 R261 H262 N263	M1-L259 HydrophobicContact CE-CB 3.95Å; M1-L259 HydrophobicContact CE-CD1 3.1Å; M1-L259 HydrophobicContact CE-CD2 3.5Å; M1-L259 VanDerWaalsContact CE-CD2 3.5Å; M1-L259 HydrophobicContact CE-CG 3.63Å; M1-L259 HydrophobicContact SD-CD1 3.87Å; M1-L259 HydrophobicContact SD-CD2 3.19Å; M1-L259 WeakPolarHBondContact SD-CD2 3.39Å; M1-L259 HydrophobicContact SD-CG 4.02Å; N223-L259 HydrophobicContact CB-CD2 4.38Å; A256-L259 PolarHBondContact O-N 2.86Å; K257-L259 PolarHBondContact O-N 3.08Å; L259-R261 VanDerWaalsContact C-N 3.33Å; L259-H262 WeakPolarHBondContact O-CB 3.27Å; L259-H262 PolarHBondContact O-N 3.33Å; L259-N263 WeakPolarHBondContact O-CB 3.32Å; L259-N263 PolarHBondContact O-N 3.41Å
260	I	90.4	Very high	82.9	Confident	5 Å²	5	49 Å²	49	3%	0.026	27%	0.267	C	S	.	.	H	α-helix	trans	-63.6	-44.2	179.5	-71.9	167.6	0	0	0	109.3	T219 L242 L245 M246 F253 A256 K257 H262 N263 L264	T219-I260 HydrophobicContact CG2-CD1 4.44Å; L242-I260 HydrophobicContact CD1-CG2 4.31Å; L242-I260 HydrophobicContact CD2-CG1 4.41Å; L245-I260 HydrophobicContact CB-CD1 4.41Å; L245-I260 HydrophobicContact CD1-CD1 4.34Å; M246-I260 HydrophobicContact CG-CG2 4.27Å; M246-I260 HydrophobicContact SD-CG2 4.35Å; F253-I260 HydrophobicContact CE1-CD1 3.67Å; F253-I260 HydrophobicContact CE2-CD1 4.08Å; F253-I260 HydrophobicContact CZ-CD1 3.26Å; A256-I260 HydrophobicContact CB-CD1 4.18Å; A256-I260 VanDerWaalsContact O-CB 3.31Å; A256-I260 WeakPolarHBondContact O-CB 3.36Å; A256-I260 WeakPolarHBondContact O-CD1 3.1Å; A256-I260 WeakPolarHBondContact O-CG1 3.43Å; A256-I260 PolarHBondContact O-N 3.4Å; K257-I260 PolarHBondContact O-N 3.17Å; I260-H262 PolarHBondContact O-N 2.67Å; I260-N263 PolarHBondContact O-N 3.38Å; I260-L264 HydrophobicContact CG2-CD1 3.97Å; I260-L264 HydrophobicContact CG2-CG 4.34Å; I260-L264 WeakPolarHBondContact O-CB 3.16Å; I260-L264 VanDerWaalsContact O-CG 3.25Å; I260-L264 WeakPolarHBondContact O-CG 3.24Å; I260-L264 PolarHBondContact O-N 3.45Å
261	R	92.4	Very high	84.8	Confident	118 Å²	118	51.8 Å²	51.8	45%	0.445	27%	0.271	S	S	.	.	H	α-helix	trans	-59.7	-45.5	175.1	-72.3	176.9	74.9	-166.5	4.2	111.6	K257 E258 L259 L264 V265 V276	K257-R261 WeakPolarHBondContact O-CB 3.41Å; K257-R261 VanDerWaalsContact O-CG 3.23Å; K257-R261 WeakPolarHBondContact O-CG 3.34Å; K257-R261 PolarHBondContact O-N 3.42Å; E258-R261 PolarHBondContact O-N 2.96Å; E258-R261 IonicContact OE1-NH1 3.6Å; L259-R261 VanDerWaalsContact C-N 3.33Å; R261-L264 PolarHBondContact O-N 2.94Å; R261-V265 WeakPolarHBondContact O-CG2 3.49Å; R261-V265 PolarHBondContact O-N 3.09Å; R261-V276 HydrophobicContact CB-CG1 3.87Å
262	H	94.7	Very high	86.9	Confident	5 Å²	5	47.6 Å²	47.6	2%	0.023	25%	0.248	C	C	.	.	H	α-helix	trans	-55.6	-52	173.5	169.3	-85.7	0	0	0	111.6	E258 L259 I260 L264 V265 V266 L277 L280 I284 N290	E258-H262 WeakPolarHBondContact O-CB 3.41Å; E258-H262 PolarHBondContact O-N 3.19Å; L259-H262 WeakPolarHBondContact O-CB 3.27Å; L259-H262 PolarHBondContact O-N 3.33Å; I260-H262 PolarHBondContact O-N 2.67Å; H262-L264 VanDerWaalsContact C-N 3.33Å; H262-L264 PolarHBondContact O-N 3.28Å; H262-V265 WeakPolarHBondContact O-CB 3.44Å; H262-V265 PolarHBondContact O-N 3.26Å; H262-V265 VanDerWaalsContact O-N 3.17Å; H262-V266 PolarHBondContact O-N 3.05Å; H262-L277 VanDerWaalsContact CD2-CD2 3.47Å; H262-L277 WeakPolarHBondContact CD2-CD2 3.32Å; H262-L280 HydrophobicContact CB-CD1 3.8Å; H262-I284 HydrophobicContact CB-CD1 3.83Å; H262-N290 PolarHBondContact CE1-ND2 3.05Å; H262-N290 PolarHBondContact NE2-ND2 3.43Å
263	N	95.2	Very high	89	Confident	13 Å²	13	43.6 Å²	43.6	7%	0.07	22%	0.22	C	C	.	.	H	α-helix	trans	-65	-36.8	-176.8	-73.9	-2.8	0	0	0	112.3	N223 L242 L259 I260 V265 V266 F267	N223-N263 PolarHBondContact OD1-ND2 3.39Å; L242-N263 HydrophobicContact CD1-CB 3.91Å; L259-N263 WeakPolarHBondContact O-CB 3.32Å; L259-N263 PolarHBondContact O-N 3.41Å; I260-N263 PolarHBondContact O-N 3.38Å; N263-V265 VanDerWaalsContact C-N 3.33Å; N263-V265 PolarHBondContact O-N 2.66Å; N263-V266 PolarHBondContact O-N 2.72Å; N263-V266 VanDerWaalsContact O-N 3.17Å; N263-F267 HydrophobicContact CB-CD2 4.47Å; N263-F267 HydrophobicContact CB-CE1 4.45Å; N263-F267 HydrophobicContact CB-CE2 3.93Å; N263-F267 HydrophobicContact CB-CZ 3.92Å; N263-F267 WeakPolarHBondContact O-CB 3.49Å; N263-F267 WeakPolarHBondContact O-CD1 3.48Å; N263-F267 WeakPolarHBondContact O-CD2 3.34Å; N263-F267 WeakPolarHBondContact O-CG 3.49Å; N263-F267 PolarHBondContact O-N 2.82Å
264	L	95.2	Very high	90.7	Very high	15 Å²	15	47.1 Å²	47.1	8%	0.079	24%	0.239	C	C	.	.	H	α-helix	trans	-61.1	-39	174.4	-72.9	172.9	0	0	0	112.6	E239 L242 M246 I260 R261 H262 V266 F267 R268	E239-L264 HydrophobicContact CB-CD2 4.35Å; E239-L264 HydrophobicContact CG-CD2 3.77Å; L242-L264 HydrophobicContact CB-CD2 4.45Å; L242-L264 HydrophobicContact CD1-CD2 4.11Å; L242-L264 HydrophobicContact CD1-CG 4.18Å; M246-L264 HydrophobicContact SD-CD1 4.08Å; I260-L264 HydrophobicContact CG2-CD1 3.97Å; I260-L264 HydrophobicContact CG2-CG 4.34Å; I260-L264 WeakPolarHBondContact O-CB 3.16Å; I260-L264 VanDerWaalsContact O-CG 3.25Å; I260-L264 WeakPolarHBondContact O-CG 3.24Å; I260-L264 PolarHBondContact O-N 3.45Å; R261-L264 PolarHBondContact O-N 2.94Å; H262-L264 VanDerWaalsContact C-N 3.33Å; H262-L264 PolarHBondContact O-N 3.28Å; L264-V266 VanDerWaalsContact C-N 3.34Å; L264-F267 PolarHBondContact O-N 3.31Å; L264-R268 VanDerWaalsContact O-CB 3.32Å; L264-R268 WeakPolarHBondContact O-CB 3.34Å; L264-R268 VanDerWaalsContact O-CG 3.24Å; L264-R268 WeakPolarHBondContact O-CG 3.38Å; L264-R268 PolarHBondContact O-N 3.31Å
265	V	96.7	Very high	92.1	Very high	7 Å²	7	49.5 Å²	49.5	4%	0.042	25%	0.25	C	S	.	.	H	α-helix	trans	-60	-47.1	173.5	171.6	0	0	0	0	110.6	R261 H262 N263 R268 G269 G270 A273 V276 L277	R261-V265 WeakPolarHBondContact O-CG2 3.49Å; R261-V265 PolarHBondContact O-N 3.09Å; H262-V265 WeakPolarHBondContact O-CB 3.44Å; H262-V265 PolarHBondContact O-N 3.26Å; H262-V265 VanDerWaalsContact O-N 3.17Å; N263-V265 VanDerWaalsContact C-N 3.33Å; N263-V265 PolarHBondContact O-N 2.66Å; V265-R268 PolarHBondContact O-N 3.03Å; V265-G269 PolarHBondContact O-N 3.42Å; V265-G270 WeakPolarHBondContact O-CA 3.44Å; V265-G270 PolarHBondContact O-N 2.97Å; V265-A273 HydrophobicContact CG1-CB 3.78Å; V265-V276 HydrophobicContact CG2-CB 3.71Å; V265-V276 HydrophobicContact CG2-CG1 3.85Å; V265-V276 HydrophobicContact CG2-CG2 3.96Å; V265-L277 HydrophobicContact CB-CD2 4.43Å; V265-L277 HydrophobicContact CG1-CD1 4.02Å; V265-L277 HydrophobicContact CG1-CD2 4.27Å; V265-L277 HydrophobicContact CG1-CG 4.1Å
266	V	96.6	Very high	93.4	Very high	31 Å²	31	45.9 Å²	45.9	19%	0.188	24%	0.236	C	C	.	.	H	α-helix	trans	-63.2	-46.6	-179.8	178.4	0	0	0	0	110.8	F230 H262 N263 L264 R268 G269 N290	F230-V266 HydrophobicContact CE1-CG1 3.9Å; F230-V266 HydrophobicContact CZ-CG1 3.99Å; H262-V266 PolarHBondContact O-N 3.05Å; N263-V266 PolarHBondContact O-N 2.72Å; N263-V266 VanDerWaalsContact O-N 3.17Å; L264-V266 VanDerWaalsContact C-N 3.34Å; V266-R268 VanDerWaalsContact C-N 3.27Å; V266-R268 PolarHBondContact O-N 3.15Å; V266-G269 PolarHBondContact O-N 2.91Å; V266-N290 HydrophobicContact CG2-CB 4.25Å; V266-N290 VanDerWaalsContact CG2-ND2 3.34Å; V266-N290 WeakPolarHBondContact CG2-ND2 3.37Å
267	F	96.6	Very high	94.3	Very high	15 Å²	15	46 Å²	46	7%	0.066	24%	0.236	C	C	.	.	H	α-helix	trans	-66.6	-29.6	-178.2	-60.8	-13.8	0	0	0	112.6	A226 F230 G235 A238 L242 N263 L264 G269	A226-F267 HydrophobicContact CB-CE2 3.96Å; A226-F267 HydrophobicContact CB-CZ 4.26Å; F230-F267 HydrophobicContact CB-CD1 3.8Å; F230-F267 HydrophobicContact CB-CE1 3.48Å; F230-F267 VanDerWaalsContact CB-CE1 3.48Å; F230-F267 HydrophobicContact CB-CZ 4.15Å; F230-F267 AromaticContact CD1-CD1 4Å; F230-F267 HydrophobicContact CD1-CD1 4Å; F230-F267 AromaticContact CD1-CE1 3.91Å; F230-F267 HydrophobicContact CD1-CE1 3.91Å; F230-F267 HydrophobicContact CD2-CB 4.42Å; F230-F267 AromaticContact CD2-CD1 3.4Å; F230-F267 HydrophobicContact CD2-CD1 3.4Å; F230-F267 VanDerWaalsContact CD2-CD1 3.4Å; F230-F267 AromaticContact CD2-CE1 3.99Å; F230-F267 HydrophobicContact CD2-CE1 3.99Å; F230-F267 HydrophobicContact CD2-CG 4.16Å; F230-F267 HydrophobicContact CE1-CD1 4.44Å; F230-F267 AromaticContact CE2-CD1 3.9Å; F230-F267 HydrophobicContact CE2-CD1 3.9Å; F230-F267 AromaticContact CG-CD1 3.45Å; F230-F267 HydrophobicContact CG-CD1 3.45Å; F230-F267 VanDerWaalsContact CG-CD1 3.45Å; F230-F267 AromaticContact CG-CE1 3.52Å; F230-F267 HydrophobicContact CG-CE1 3.52Å; F230-F267 HydrophobicContact CZ-CD1 4.39Å; G235-F267 VanDerWaalsContact CA-O 3.29Å; G235-F267 WeakPolarHBondContact CA-O 3.27Å; A238-F267 HydrophobicContact CB-CB 4.48Å; A238-F267 HydrophobicContact CB-CD1 4.06Å; A238-F267 HydrophobicContact CB-CD2 3.48Å; A238-F267 VanDerWaalsContact CB-CD2 3.48Å; A238-F267 HydrophobicContact CB-CE1 4.14Å; A238-F267 HydrophobicContact CB-CE2 3.55Å; A238-F267 HydrophobicContact CB-CG 3.75Å; A238-F267 HydrophobicContact CB-CZ 3.89Å; L242-F267 HydrophobicContact CD1-CD2 3.94Å; L242-F267 HydrophobicContact CD1-CE2 3.51Å; L242-F267 HydrophobicContact CG-CE2 4.12Å; N263-F267 HydrophobicContact CB-CD2 4.47Å; N263-F267 HydrophobicContact CB-CE1 4.45Å; N263-F267 HydrophobicContact CB-CE2 3.93Å; N263-F267 HydrophobicContact CB-CZ 3.92Å; N263-F267 WeakPolarHBondContact O-CB 3.49Å; N263-F267 WeakPolarHBondContact O-CD1 3.48Å; N263-F267 WeakPolarHBondContact O-CD2 3.34Å; N263-F267 WeakPolarHBondContact O-CG 3.49Å; N263-F267 PolarHBondContact O-N 2.82Å; L264-F267 PolarHBondContact O-N 3.31Å; F267-G269 VanDerWaalsContact C-N 3.28Å; F267-G269 PolarHBondContact O-N 2.89Å
268	R	95.9	Very high	94.9	Very high	101 Å²	101	44.4 Å²	44.4	38%	0.381	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	14.4	174.6	-63.4	173.2	-176	162.8	-1.6	113.4	E239 L264 V265 V266 G270 E271	E239-R268 VanDerWaalsContact CD-NH2 3.32Å; E239-R268 IonicContact OE1-CZ 2.57Å; E239-R268 IonicContact OE1-NE 3.72Å; E239-R268 IonicContact OE1-NH2 2.67Å; E239-R268 PolarHBondContact OE1-NH2 3.45Å; E239-R268 IonicContact OE2-CZ 2.83Å; E239-R268 IonicContact OE2-NE 3.85Å; E239-R268 PolarHBondContact OE2-NE 3.26Å; E239-R268 IonicContact OE2-NH2 2.88Å; L264-R268 VanDerWaalsContact O-CB 3.32Å; L264-R268 WeakPolarHBondContact O-CB 3.34Å; L264-R268 VanDerWaalsContact O-CG 3.24Å; L264-R268 WeakPolarHBondContact O-CG 3.38Å; L264-R268 PolarHBondContact O-N 3.31Å; V265-R268 PolarHBondContact O-N 3.03Å; V266-R268 VanDerWaalsContact C-N 3.27Å; V266-R268 PolarHBondContact O-N 3.15Å; R268-G270 VanDerWaalsContact C-N 3.3Å; R268-G270 PolarHBondContact O-N 3.31Å; R268-E271 HydrophobicContact CB-CB 3.83Å
269	G	93.2	Very high	95.2	Very high	43 Å²	43	45.3 Å²	45.3	44%	0.443	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	19.4	173.6	0	0	0	0	0	115.2	V265 V266 F267 R297	V265-G269 PolarHBondContact O-N 3.42Å; V266-G269 PolarHBondContact O-N 2.91Å; F267-G269 VanDerWaalsContact C-N 3.28Å; F267-G269 PolarHBondContact O-N 2.89Å; G269-R297 PolarHBondContact O-NH1 3.38Å; G269-R297 VanDerWaalsContact O-NH1 3.12Å
270	G	95.3	Very high	95.5	Very high	14 Å²	14	44.8 Å²	44.8	14%	0.144	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	108	1.7	179.8	0	0	0	0	0	114.6	V265 R268 G272 A273	V265-G270 WeakPolarHBondContact O-CA 3.44Å; V265-G270 PolarHBondContact O-N 2.97Å; R268-G270 VanDerWaalsContact C-N 3.3Å; R268-G270 PolarHBondContact O-N 3.31Å; G270-G272 PolarHBondContact O-N 3.35Å; G270-A273 WeakPolarHBondContact O-CB 3.47Å; G270-A273 PolarHBondContact O-N 3.44Å
271	E	96.2	Very high	95.6	Very high	134 Å²	134	46 Å²	46	63%	0.626	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	124.7	175	-167.8	-171.1	163.7	0	0	111	R268 A273	R268-E271 HydrophobicContact CB-CB 3.83Å; E271-A273 VanDerWaalsContact C-N 3.31Å; E271-A273 PolarHBondContact O-N 3.39Å
272	G	96	Very high	95.4	Very high	35 Å²	35	45.5 Å²	45.5	36%	0.361	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	11.3	-177.8	0	0	0	0	0	115	G270 L274 Q275 V276	G270-G272 PolarHBondContact O-N 3.35Å; G272-L274 PolarHBondContact O-N 3.41Å; G272-Q275 PolarHBondContact O-N 3.19Å; G272-Q275 VanDerWaalsContact O-N 3.09Å; G272-V276 PolarHBondContact O-N 3.39Å
273	A	97	Very high	95.1	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.008	27%	0.271	C	S	.	.	H	α-helix	trans	-52.3	-49.6	-175.9	0	0	0	0	0	113.8	V265 G270 E271 Q275 V276 L277 P278 Y294	V265-A273 HydrophobicContact CG1-CB 3.78Å; G270-A273 WeakPolarHBondContact O-CB 3.47Å; G270-A273 PolarHBondContact O-N 3.44Å; E271-A273 VanDerWaalsContact C-N 3.31Å; E271-A273 PolarHBondContact O-N 3.39Å; A273-Q275 PolarHBondContact O-N 3.31Å; A273-V276 PolarHBondContact O-N 2.96Å; A273-V276 VanDerWaalsContact O-N 3.14Å; A273-L277 HydrophobicContact CB-CD1 3.91Å; A273-L277 HydrophobicContact CB-CG 4.36Å; A273-L277 WeakPolarHBondContact O-CB 3.32Å; A273-L277 PolarHBondContact O-N 2.93Å; A273-P278 VanDerWaalsContact O-CD 3.31Å; A273-P278 WeakPolarHBondContact O-CD 3.42Å; A273-Y294 HydrophobicContact CB-CD1 4.03Å; A273-Y294 HydrophobicContact CB-CD2 3.46Å; A273-Y294 VanDerWaalsContact CB-CD2 3.46Å; A273-Y294 HydrophobicContact CB-CE1 4.31Å; A273-Y294 HydrophobicContact CB-CE2 3.78Å; A273-Y294 HydrophobicContact CB-CG 3.58Å
274	L	96.7	Very high	94.8	Very high	88 Å²	88	47.1 Å²	47.1	46%	0.461	27%	0.268	S	S	.	.	H	α-helix	trans	-65.5	-22	-177.9	-63.2	-180	0	0	0	113.9	G272 P278 L291 Y294 Y295	G272-L274 PolarHBondContact O-N 3.41Å; L274-P278 WeakPolarHBondContact O-CD 3.34Å; L274-P278 WeakPolarHBondContact O-CG 3.48Å; L274-L291 HydrophobicContact CD2-CD1 4.23Å; L274-Y294 HydrophobicContact CD1-CE1 4.16Å; L274-Y294 HydrophobicContact CD2-CD1 4.2Å; L274-Y294 HydrophobicContact CD2-CE1 3.73Å; L274-Y294 HydrophobicContact CG-CE1 3.68Å; L274-Y295 HydrophobicContact CD2-CE1 3.77Å
275	Q	96.5	Very high	94.4	Very high	159 Å²	159	51.3 Å²	51.3	74%	0.743	30%	0.296	S	S	*	.	H	α-helix	trans	-84.9	-22.4	177.5	-64.4	-179.9	5.8	0	0	112.7	G272 A273	G272-Q275 PolarHBondContact O-N 3.19Å; G272-Q275 VanDerWaalsContact O-N 3.09Å; A273-Q275 PolarHBondContact O-N 3.31Å
276	V	96.7	Very high	94.2	Very high	16 Å²	16	54.5 Å²	54.5	10%	0.097	31%	0.31	C	S	.	.	H	α-helix	trans	-116.6	-46.1	-167.9	174.7	0	0	0	0	112.4	R261 V265 G272 A273 P279 L280	R261-V276 HydrophobicContact CB-CG1 3.87Å; V265-V276 HydrophobicContact CG2-CB 3.71Å; V265-V276 HydrophobicContact CG2-CG1 3.85Å; V265-V276 HydrophobicContact CG2-CG2 3.96Å; G272-V276 PolarHBondContact O-N 3.39Å; A273-V276 PolarHBondContact O-N 2.96Å; A273-V276 VanDerWaalsContact O-N 3.14Å; V276-P279 WeakPolarHBondContact O-CD 3.41Å; V276-P279 WeakPolarHBondContact O-CG 3.49Å; V276-L280 HydrophobicContact CG1-CD1 3.83Å; V276-L280 VanDerWaalsContact O-CD1 3.25Å; V276-L280 WeakPolarHBondContact O-CD1 3.23Å; V276-L280 VanDerWaalsContact O-CG 3.23Å; V276-L280 WeakPolarHBondContact O-CG 3.5Å
277	L	97.3	Very high	94.2	Very high	2 Å²	2	53 Å²	53	1%	0.01	30%	0.301	C	S	.	.	S	Bend	trans	-74	-41.4	-171.6	-57.9	-177.7	0	0	0	114.3	H262 V265 A273 L280 V281 N290 L291	H262-L277 VanDerWaalsContact CD2-CD2 3.47Å; H262-L277 WeakPolarHBondContact CD2-CD2 3.32Å; V265-L277 HydrophobicContact CB-CD2 4.43Å; V265-L277 HydrophobicContact CG1-CD1 4.02Å; V265-L277 HydrophobicContact CG1-CD2 4.27Å; V265-L277 HydrophobicContact CG1-CG 4.1Å; A273-L277 HydrophobicContact CB-CD1 3.91Å; A273-L277 HydrophobicContact CB-CG 4.36Å; A273-L277 WeakPolarHBondContact O-CB 3.32Å; A273-L277 PolarHBondContact O-N 2.93Å; L277-L280 WeakPolarHBondContact O-CA 3.24Å; L277-L280 WeakPolarHBondContact O-CB 3.46Å; L277-L280 PolarHBondContact O-N 3.32Å; L277-V281 PolarHBondContact O-N 2.94Å; L277-N290 HydrophobicContact CD1-CB 4.03Å; L277-L291 HydrophobicContact CB-CB 4.11Å; L277-L291 HydrophobicContact CB-CD1 4.22Å; L277-L291 HydrophobicContact CB-CD2 4.49Å; L277-L291 HydrophobicContact CD1-CB 4.06Å; L277-L291 HydrophobicContact CD1-CD1 4.41Å
278	P	96.8	Very high	94.2	Very high	54 Å²	54	54.8 Å²	54.8	35%	0.351	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-53.4	-47.2	-178.6	-27.6	35.9	0	0	0	115.3	A273 L274 L280 V281 L291	A273-P278 VanDerWaalsContact O-CD 3.31Å; A273-P278 WeakPolarHBondContact O-CD 3.42Å; L274-P278 WeakPolarHBondContact O-CD 3.34Å; L274-P278 WeakPolarHBondContact O-CG 3.48Å; P278-L280 PolarHBondContact O-N 3.42Å; P278-V281 PolarHBondContact O-N 3.19Å; P278-L291 HydrophobicContact CG-CD2 4.11Å
279	P	95.2	Very high	94.3	Very high	84 Å²	84	51.2 Å²	51.2	55%	0.545	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-70.9	-10.6	177.5	29.2	-36.4	0	0	0	114.1	V276	V276-P279 WeakPolarHBondContact O-CD 3.41Å; V276-P279 WeakPolarHBondContact O-CG 3.49Å
280	L	94.6	Very high	94.5	Very high	1 Å²	1	51 Å²	51	1%	0.005	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-97.2	-7.5	-179.3	-62.5	178	0	0	0	113.4	E258 H262 V276 L277 P278 D282 V283 I284 A287	E258-L280 HydrophobicContact CB-CD2 3.82Å; E258-L280 HydrophobicContact CG-CD2 4.2Å; E258-L280 WeakPolarHBondContact OE2-CD2 3.46Å; H262-L280 HydrophobicContact CB-CD1 3.8Å; V276-L280 HydrophobicContact CG1-CD1 3.83Å; V276-L280 VanDerWaalsContact O-CD1 3.25Å; V276-L280 WeakPolarHBondContact O-CD1 3.23Å; V276-L280 VanDerWaalsContact O-CG 3.23Å; V276-L280 WeakPolarHBondContact O-CG 3.5Å; L277-L280 WeakPolarHBondContact O-CA 3.24Å; L277-L280 WeakPolarHBondContact O-CB 3.46Å; L277-L280 PolarHBondContact O-N 3.32Å; P278-L280 PolarHBondContact O-N 3.42Å; L280-D282 PolarHBondContact O-N 3.48Å; L280-V283 WeakPolarHBondContact O-CB 3.31Å; L280-V283 PolarHBondContact O-N 2.84Å; L280-I284 HydrophobicContact CD1-CD1 4.12Å; L280-I284 HydrophobicContact CD2-CD1 4.27Å; L280-I284 PolarHBondContact O-N 3.48Å; L280-A287 HydrophobicContact CB-CB 3.74Å; L280-A287 WeakPolarHBondContact O-CB 3.25Å
281	V	93.7	Very high	94.6	Very high	30 Å²	30	50.5 Å²	50.5	18%	0.182	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	132.5	172.3	177.3	0	0	0	0	109	L277 P278 V283 R288 L291	L277-V281 PolarHBondContact O-N 2.94Å; P278-V281 PolarHBondContact O-N 3.19Å; V281-V283 PolarHBondContact O-N 3.41Å; V281-R288 HydrophobicContact CG1-CB 4.32Å; V281-L291 HydrophobicContact CG2-CD2 4.15Å
282	D	86.6	Confident	94.7	Very high	108 Å²	108	44.1 Å²	44.1	58%	0.578	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	65	-0.1	-176	-50.2	-32.8	0	0	0	115.8	S4 L280 R288	S4-D282 PolarHBondContact OG-O 3.34Å; L280-D282 PolarHBondContact O-N 3.48Å; D282-R288 IonicContact OD1-CZ 3.02Å; D282-R288 IonicContact OD1-NE 3.54Å; D282-R288 IonicContact OD1-NH2 3.7Å; D282-R288 PolarHBondContact OD1-NH2 3.26Å; D282-R288 IonicContact OD2-NH2 3.53Å; D282-R288 PolarHBondContact OD2-NH2 2.95Å
283	V	88.4	Confident	94.8	Very high	50 Å²	50	45.3 Å²	45.3	30%	0.303	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-47.2	168.8	-177.3	0	0	0	0	110.1	L3 L280 V281	L3-V283 HydrophobicContact CD2-CG1 4.23Å; L280-V283 WeakPolarHBondContact O-CB 3.31Å; L280-V283 PolarHBondContact O-N 2.84Å; V281-V283 PolarHBondContact O-N 3.41Å
284	I	90.5	Very high	94.8	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.01	25%	0.254	C	S	.	.	S	Bend	trans	-113.6	120.5	173.4	-59.4	178.8	0	0	0	107.4	L3 H262 L280 E286 A287	L3-I284 HydrophobicContact CD2-CG1 4.29Å; H262-I284 HydrophobicContact CB-CD1 3.83Å; L280-I284 HydrophobicContact CD1-CD1 4.12Å; L280-I284 HydrophobicContact CD2-CD1 4.27Å; L280-I284 PolarHBondContact O-N 3.48Å; I284-E286 HydrophobicContact CG2-CB 4.32Å; I284-E286 PolarHBondContact O-N 3.27Å; I284-A287 HydrophobicContact CB-CB 4.08Å; I284-A287 WeakPolarHBondContact O-CB 3.47Å; I284-A287 PolarHBondContact O-N 3.27Å
285	P	86.5	Confident	94.9	Very high	103 Å²	103	45 Å²	45	67%	0.669	24%	0.239	S	C	*	.	H	α-helix	trans	-52.5	-42	-178.6	-27.5	35.1	0	0	0	113.2	A287	P285-A287 VanDerWaalsContact C-N 3.31Å; P285-A287 PolarHBondContact O-N 3.5Å
286	E	92.6	Very high	94.9	Very high	73 Å²	73	38.9 Å²	38.9	34%	0.341	21%	0.212	S	C	.	.	H	α-helix	trans	-71.3	-20	-178.2	-64.7	85.1	170.9	0	0	114	K197 I284 R288 L289 N290	K197-E286 IonicContact NZ-OE1 3.86Å; K197-E286 PolarHBondContact NZ-OE1 3Å; I284-E286 HydrophobicContact CG2-CB 4.32Å; I284-E286 PolarHBondContact O-N 3.27Å; E286-R288 VanDerWaalsContact C-N 3.34Å; E286-R288 PolarHBondContact O-N 3.02Å; E286-L289 PolarHBondContact O-N 3.39Å; E286-N290 WeakPolarHBondContact O-CB 3.34Å; E286-N290 PolarHBondContact O-N 3.21Å; E286-N290 PolarHBondContact O-ND2 2.98Å; E286-N290 VanDerWaalsContact O-ND2 3.13Å
287	A	96	Very high	94.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-39.9	-174.5	0	0	0	0	0	112.6	L280 I284 P285 L291	L280-A287 HydrophobicContact CB-CB 3.74Å; L280-A287 WeakPolarHBondContact O-CB 3.25Å; I284-A287 HydrophobicContact CB-CB 4.08Å; I284-A287 WeakPolarHBondContact O-CB 3.47Å; I284-A287 PolarHBondContact O-N 3.27Å; P285-A287 VanDerWaalsContact C-N 3.31Å; P285-A287 PolarHBondContact O-N 3.5Å; A287-L291 VanDerWaalsContact O-CB 3.32Å; A287-L291 WeakPolarHBondContact O-CB 3.42Å; A287-L291 PolarHBondContact O-N 3.46Å
288	R	97.1	Very high	94.7	Very high	53 Å²	53	50.9 Å²	50.9	20%	0.2	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-49.2	176.5	-176.5	-175	-70.8	-117.5	4.2	111	V281 D282 E286 L291 V292 L307	V281-R288 HydrophobicContact CG1-CB 4.32Å; D282-R288 IonicContact OD1-CZ 3.02Å; D282-R288 IonicContact OD1-NE 3.54Å; D282-R288 IonicContact OD1-NH2 3.7Å; D282-R288 PolarHBondContact OD1-NH2 3.26Å; D282-R288 IonicContact OD2-NH2 3.53Å; D282-R288 PolarHBondContact OD2-NH2 2.95Å; E286-R288 VanDerWaalsContact C-N 3.34Å; E286-R288 PolarHBondContact O-N 3.02Å; R288-L291 PolarHBondContact O-N 3.43Å; R288-V292 WeakPolarHBondContact O-CG2 3.41Å; R288-V292 PolarHBondContact O-N 2.96Å; R288-L307 PolarHBondContact NH1-O 3.24Å
289	L	96.8	Very high	94.6	Very high	26 Å²	26	53.5 Å²	53.5	14%	0.136	27%	0.271	C	S	.	.	H	α-helix	trans	-64.5	-43.1	-178.1	-55.1	-177.7	0	0	0	111.3	E286 L291 V292 I293 L311 E318 L321	E286-L289 PolarHBondContact O-N 3.39Å; L289-L291 VanDerWaalsContact C-N 3.31Å; L289-L291 PolarHBondContact O-N 3.27Å; L289-V292 WeakPolarHBondContact O-CB 3.33Å; L289-V292 PolarHBondContact O-N 2.96Å; L289-I293 WeakPolarHBondContact O-CG1 3.47Å; L289-I293 PolarHBondContact O-N 2.94Å; L289-L311 HydrophobicContact CD2-CD2 3.86Å; L289-E318 HydrophobicContact CD1-CG 3.9Å; L289-E318 HydrophobicContact CD2-CG 4.09Å; L289-L321 HydrophobicContact CB-CD2 4Å; L289-L321 HydrophobicContact CD2-CD2 3.95Å
290	N	97.5	Very high	94.7	Very high	37 Å²	37	52.5 Å²	52.5	20%	0.198	26%	0.261	C	S	.	.	H	α-helix	trans	-65.3	-34.5	177.1	-71.5	-37.9	0	0	0	112.6	H262 V266 L277 E286 I293 Y294	H262-N290 PolarHBondContact CE1-ND2 3.05Å; H262-N290 PolarHBondContact NE2-ND2 3.43Å; V266-N290 HydrophobicContact CG2-CB 4.25Å; V266-N290 VanDerWaalsContact CG2-ND2 3.34Å; V266-N290 WeakPolarHBondContact CG2-ND2 3.37Å; L277-N290 HydrophobicContact CD1-CB 4.03Å; E286-N290 WeakPolarHBondContact O-CB 3.34Å; E286-N290 PolarHBondContact O-N 3.21Å; E286-N290 PolarHBondContact O-ND2 2.98Å; E286-N290 VanDerWaalsContact O-ND2 3.13Å; N290-I293 PolarHBondContact O-N 2.9Å; N290-Y294 PolarHBondContact O-N 2.89Å
291	L	97.9	Very high	94.8	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-69	-39.1	174.9	-176.1	56.6	0	0	0	111.8	L274 L277 P278 V281 A287 R288 L289 Y294 Y295 L307	L274-L291 HydrophobicContact CD2-CD1 4.23Å; L277-L291 HydrophobicContact CB-CB 4.11Å; L277-L291 HydrophobicContact CB-CD1 4.22Å; L277-L291 HydrophobicContact CB-CD2 4.49Å; L277-L291 HydrophobicContact CD1-CB 4.06Å; L277-L291 HydrophobicContact CD1-CD1 4.41Å; P278-L291 HydrophobicContact CG-CD2 4.11Å; V281-L291 HydrophobicContact CG2-CD2 4.15Å; A287-L291 VanDerWaalsContact O-CB 3.32Å; A287-L291 WeakPolarHBondContact O-CB 3.42Å; A287-L291 PolarHBondContact O-N 3.46Å; R288-L291 PolarHBondContact O-N 3.43Å; L289-L291 VanDerWaalsContact C-N 3.31Å; L289-L291 PolarHBondContact O-N 3.27Å; L291-Y294 HydrophobicContact CD1-CD1 4.39Å; L291-Y294 WeakPolarHBondContact O-CB 3.44Å; L291-Y294 PolarHBondContact O-N 3.44Å; L291-Y295 HydrophobicContact CD1-CD2 4.31Å; L291-Y295 HydrophobicContact CD1-CE2 3.85Å; L291-Y295 HydrophobicContact CD2-CE2 4.28Å; L291-Y295 HydrophobicContact CG-CD2 4.15Å; L291-Y295 HydrophobicContact CG-CE2 3.75Å; L291-Y295 WeakPolarHBondContact O-CD2 3.44Å; L291-Y295 PolarHBondContact O-N 3.46Å; L291-L307 HydrophobicContact CB-CD1 4.12Å; L291-L307 HydrophobicContact CD2-CD1 3.61Å; L291-L307 HydrophobicContact CG-CD1 3.58Å
292	V	98.2	Very high	95	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.2	-45.7	172	172	0	0	0	0	111.1	R288 L289 Y294 Y295 L296 A304 L307 I308 L321 V325	R288-V292 WeakPolarHBondContact O-CG2 3.41Å; R288-V292 PolarHBondContact O-N 2.96Å; L289-V292 WeakPolarHBondContact O-CB 3.33Å; L289-V292 PolarHBondContact O-N 2.96Å; V292-Y294 VanDerWaalsContact C-N 3.28Å; V292-Y294 PolarHBondContact O-N 3.36Å; V292-Y295 PolarHBondContact O-N 3.09Å; V292-L296 HydrophobicContact CG1-CD1 4.27Å; V292-L296 WeakPolarHBondContact O-CG 3.44Å; V292-L296 PolarHBondContact O-N 2.91Å; V292-A304 HydrophobicContact CG1-CB 4.06Å; V292-L307 HydrophobicContact CG2-CB 3.59Å; V292-L307 HydrophobicContact CG2-CD1 4.03Å; V292-I308 HydrophobicContact CG1-CD1 4.42Å; V292-I308 HydrophobicContact CG2-CB 4.21Å; V292-L321 HydrophobicContact CB-CD2 3.84Å; V292-L321 HydrophobicContact CB-CG 4.43Å; V292-L321 HydrophobicContact CG1-CD1 3.92Å; V292-L321 HydrophobicContact CG1-CD2 3.65Å; V292-L321 HydrophobicContact CG1-CG 3.69Å; V292-V325 HydrophobicContact CG1-CG2 3.64Å
293	I	97.7	Very high	95.5	Very high	61 Å²	61	53.5 Å²	53.5	31%	0.313	26%	0.261	S	S	.	.	H	α-helix	trans	-59.8	-40.8	176	-67.9	165.5	0	0	0	110.9	L289 N290 L296 R297 L321	L289-I293 WeakPolarHBondContact O-CG1 3.47Å; L289-I293 PolarHBondContact O-N 2.94Å; N290-I293 PolarHBondContact O-N 2.9Å; I293-L296 PolarHBondContact O-N 3.47Å; I293-R297 WeakPolarHBondContact O-CG 3.23Å; I293-R297 PolarHBondContact O-N 3.5Å; I293-R297 VanDerWaalsContact O-N 3.09Å; I293-L321 HydrophobicContact CG1-CD1 3.78Å; I293-L321 HydrophobicContact CG1-CD2 4.22Å
294	Y	98	Very high	96	Very high	44 Å²	44	51.1 Å²	51.1	17%	0.173	25%	0.247	C	C	.	.	H	α-helix	trans	-59.7	-50.4	175.9	173.1	-96	0	0	0	111.4	A273 L274 N290 L291 V292 L296 R297 Q298	A273-Y294 HydrophobicContact CB-CD1 4.03Å; A273-Y294 HydrophobicContact CB-CD2 3.46Å; A273-Y294 VanDerWaalsContact CB-CD2 3.46Å; A273-Y294 HydrophobicContact CB-CE1 4.31Å; A273-Y294 HydrophobicContact CB-CE2 3.78Å; A273-Y294 HydrophobicContact CB-CG 3.58Å; L274-Y294 HydrophobicContact CD1-CE1 4.16Å; L274-Y294 HydrophobicContact CD2-CD1 4.2Å; L274-Y294 HydrophobicContact CD2-CE1 3.73Å; L274-Y294 HydrophobicContact CG-CE1 3.68Å; N290-Y294 PolarHBondContact O-N 2.89Å; L291-Y294 HydrophobicContact CD1-CD1 4.39Å; L291-Y294 WeakPolarHBondContact O-CB 3.44Å; L291-Y294 PolarHBondContact O-N 3.44Å; V292-Y294 VanDerWaalsContact C-N 3.28Å; V292-Y294 PolarHBondContact O-N 3.36Å; Y294-L296 PolarHBondContact O-N 3.45Å; Y294-R297 WeakPolarHBondContact O-CB 3.2Å; Y294-R297 PolarHBondContact O-N 3.08Å; Y294-R297 VanDerWaalsContact O-N 3.09Å; Y294-Q298 HydrophobicContact CD1-CG 4.37Å; Y294-Q298 HydrophobicContact CE1-CG 3.88Å; Y294-Q298 HydrophobicContact CE2-CG 4.09Å; Y294-Q298 WeakPolarHBondContact O-CG 3.4Å; Y294-Q298 PolarHBondContact O-N 3.25Å; Y294-Q298 VanDerWaalsContact O-N 3.13Å
295	Y	98.3	Very high	96.4	Very high	37 Å²	37	53.8 Å²	53.8	15%	0.145	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-42.8	179	-74.5	-47.7	0	0	0	112.9	L274 L291 V292 R297 Q298 D299 D300 E303 L307	L274-Y295 HydrophobicContact CD2-CE1 3.77Å; L291-Y295 HydrophobicContact CD1-CD2 4.31Å; L291-Y295 HydrophobicContact CD1-CE2 3.85Å; L291-Y295 HydrophobicContact CD2-CE2 4.28Å; L291-Y295 HydrophobicContact CG-CD2 4.15Å; L291-Y295 HydrophobicContact CG-CE2 3.75Å; L291-Y295 WeakPolarHBondContact O-CD2 3.44Å; L291-Y295 PolarHBondContact O-N 3.46Å; V292-Y295 PolarHBondContact O-N 3.09Å; Y295-R297 VanDerWaalsContact C-N 3.26Å; Y295-R297 PolarHBondContact O-N 2.67Å; Y295-Q298 CarbonylContact O-C 3.47Å; Y295-Q298 WeakPolarHBondContact O-CA 3.4Å; Y295-Q298 PolarHBondContact O-N 2.88Å; Y295-D299 PolarHBondContact O-N 3.3Å; Y295-D300 WeakPolarHBondContact CB-O 3.43Å; Y295-D300 HydrophobicContact CD1-CB 4.21Å; Y295-D300 PolarHBondContact O-N 3.24Å; Y295-E303 HydrophobicContact CD1-CB 4.14Å; Y295-E303 HydrophobicContact CD2-CB 3.85Å; Y295-E303 HydrophobicContact CE1-CB 4.2Å; Y295-E303 HydrophobicContact CE2-CB 3.86Å; Y295-E303 HydrophobicContact CG-CB 3.99Å; Y295-L307 HydrophobicContact CD2-CD1 3.82Å; Y295-L307 HydrophobicContact CE2-CD1 3.61Å
296	L	97.3	Very high	96.9	Very high	32 Å²	32	51.6 Å²	51.6	17%	0.168	24%	0.24	C	C	.	.	H	α-helix	trans	-57.8	-37.8	173.8	-72.7	172.5	0	0	0	112.7	V292 I293 Y294 Q298 D299 A304 L321 V324 V325 A328	V292-L296 HydrophobicContact CG1-CD1 4.27Å; V292-L296 WeakPolarHBondContact O-CG 3.44Å; V292-L296 PolarHBondContact O-N 2.91Å; I293-L296 PolarHBondContact O-N 3.47Å; Y294-L296 PolarHBondContact O-N 3.45Å; L296-Q298 VanDerWaalsContact C-N 3.28Å; L296-Q298 PolarHBondContact O-N 3.47Å; L296-D299 PolarHBondContact O-N 2.93Å; L296-A304 HydrophobicContact CD2-CB 3.98Å; L296-A304 HydrophobicContact CG-CB 3.94Å; L296-L321 HydrophobicContact CD1-CD1 3.74Å; L296-V324 HydrophobicContact CD1-CG1 3.81Å; L296-V325 HydrophobicContact CD1-CG2 3.85Å; L296-V325 HydrophobicContact CD2-CG2 4.08Å; L296-V325 HydrophobicContact CG-CG2 4.24Å; L296-A328 HydrophobicContact CD2-CB 4.4Å
297	R	94.6	Very high	97.1	Very high	157 Å²	157	49.8 Å²	49.8	59%	0.592	23%	0.232	S	C	*	.	H	α-helix	trans	-72.1	-21.5	176.5	-72.7	177.1	177.9	-173.8	-0.8	113.6	G269 I293 Y294 Y295 D299	G269-R297 PolarHBondContact O-NH1 3.38Å; G269-R297 VanDerWaalsContact O-NH1 3.12Å; I293-R297 WeakPolarHBondContact O-CG 3.23Å; I293-R297 PolarHBondContact O-N 3.5Å; I293-R297 VanDerWaalsContact O-N 3.09Å; Y294-R297 WeakPolarHBondContact O-CB 3.2Å; Y294-R297 PolarHBondContact O-N 3.08Å; Y294-R297 VanDerWaalsContact O-N 3.09Å; Y295-R297 VanDerWaalsContact C-N 3.26Å; Y295-R297 PolarHBondContact O-N 2.67Å; R297-D299 VanDerWaalsContact C-N 3.3Å
298	Q	95.1	Very high	97.1	Very high	112 Å²	112	49.8 Å²	49.8	52%	0.523	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	9	174.3	-58.6	-50.5	-57.1	0	0	112.3	Y294 Y295 L296 D300	Y294-Q298 HydrophobicContact CD1-CG 4.37Å; Y294-Q298 HydrophobicContact CE1-CG 3.88Å; Y294-Q298 HydrophobicContact CE2-CG 4.09Å; Y294-Q298 WeakPolarHBondContact O-CG 3.4Å; Y294-Q298 PolarHBondContact O-N 3.25Å; Y294-Q298 VanDerWaalsContact O-N 3.13Å; Y295-Q298 CarbonylContact O-C 3.47Å; Y295-Q298 WeakPolarHBondContact O-CA 3.4Å; Y295-Q298 PolarHBondContact O-N 2.88Å; L296-Q298 VanDerWaalsContact C-N 3.28Å; L296-Q298 PolarHBondContact O-N 3.47Å; Q298-D300 PolarHBondContact O-N 3.13Å
299	D	94.2	Very high	97.1	Very high	110 Å²	110	51.3 Å²	51.3	59%	0.588	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.5	20.2	-174.5	-59.5	-47.1	0	0	0	113.1	Y295 L296 R297 V301 K423	Y295-D299 PolarHBondContact O-N 3.3Å; L296-D299 PolarHBondContact O-N 2.93Å; R297-D299 VanDerWaalsContact C-N 3.3Å; D299-V301 PolarHBondContact O-N 3.04Å; D299-K423 IonicContact OD2-NZ 3.2Å; D299-K423 PolarHBondContact OD2-NZ 3.08Å
300	D	96.9	Very high	97	Very high	62 Å²	62	56.3 Å²	56.3	33%	0.332	27%	0.267	S	S	.	.			trans	-93.8	76.1	175.9	-168.1	-17.7	0	0	0	110.7	Y295 Q298 Q302 E303 A304	Y295-D300 WeakPolarHBondContact CB-O 3.43Å; Y295-D300 HydrophobicContact CD1-CB 4.21Å; Y295-D300 PolarHBondContact O-N 3.24Å; Q298-D300 PolarHBondContact O-N 3.13Å; D300-Q302 VanDerWaalsContact C-N 3.34Å; D300-Q302 PolarHBondContact O-N 3.28Å; D300-E303 WeakPolarHBondContact OD1-CB 3.34Å; D300-E303 PolarHBondContact OD1-N 2.9Å; D300-A304 PolarHBondContact O-N 3.43Å
301	V	97.7	Very high	96.8	Very high	16 Å²	16	56 Å²	56	10%	0.097	27%	0.266	C	S	.	.	H	α-helix	trans	-71.2	-31.7	-173.2	-174.3	0	0	0	0	112	D299 A304 Y305 A328 L329 E332	D299-V301 PolarHBondContact O-N 3.04Å; V301-A304 WeakPolarHBondContact O-CB 3.25Å; V301-A304 PolarHBondContact O-N 2.98Å; V301-Y305 WeakPolarHBondContact O-CB 3.48Å; V301-Y305 PolarHBondContact O-N 2.99Å; V301-A328 HydrophobicContact CG1-CB 3.65Å; V301-A328 HydrophobicContact CG2-CB 3.98Å; V301-L329 HydrophobicContact CG1-CB 3.79Å; V301-L329 HydrophobicContact CG1-CD1 4.04Å; V301-E332 WeakPolarHBondContact CB-OE2 3.44Å
302	Q	97.7	Very high	96.5	Very high	71 Å²	71	63.8 Å²	63.8	33%	0.332	30%	0.302	S	S	.	.	H	α-helix	trans	-67.2	-43.9	-177.7	-173.5	58.5	61.5	0	0	111.6	D300 Y305 N306 M333	D300-Q302 VanDerWaalsContact C-N 3.34Å; D300-Q302 PolarHBondContact O-N 3.28Å; Q302-Y305 PolarHBondContact O-N 2.81Å; Q302-N306 PolarHBondContact NE2-OD1 3.2Å; Q302-N306 VanDerWaalsContact O-CG 3.27Å; Q302-N306 PolarHBondContact O-N 3.23Å; Q302-N306 PolarHBondContact O-ND2 2.9Å; Q302-M333 VanDerWaalsContact OE1-CE 3.23Å
303	E	97.5	Very high	96.3	Very high	73 Å²	73	64.8 Å²	64.8	34%	0.341	31%	0.308	S	S	.	.	H	α-helix	trans	-69.9	-36.8	176.2	-72.4	-57.2	107.6	0	0	112.2	Y295 D300 Y305 N306 L307	Y295-E303 HydrophobicContact CD1-CB 4.14Å; Y295-E303 HydrophobicContact CD2-CB 3.85Å; Y295-E303 HydrophobicContact CE1-CB 4.2Å; Y295-E303 HydrophobicContact CE2-CB 3.86Å; Y295-E303 HydrophobicContact CG-CB 3.99Å; D300-E303 WeakPolarHBondContact OD1-CB 3.34Å; D300-E303 PolarHBondContact OD1-N 2.9Å; E303-Y305 VanDerWaalsContact C-N 3.3Å; E303-Y305 PolarHBondContact O-N 2.83Å; E303-N306 PolarHBondContact O-N 3.44Å; E303-N306 PolarHBondContact OE1-ND2 2.94Å; E303-L307 PolarHBondContact O-N 3.46Å
304	A	98.1	Very high	95.8	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-56.9	-43.7	171.1	0	0	0	0	0	111.8	V292 L296 D300 V301 I308 V325	V292-A304 HydrophobicContact CG1-CB 4.06Å; L296-A304 HydrophobicContact CD2-CB 3.98Å; L296-A304 HydrophobicContact CG-CB 3.94Å; D300-A304 PolarHBondContact O-N 3.43Å; V301-A304 WeakPolarHBondContact O-CB 3.25Å; V301-A304 PolarHBondContact O-N 2.98Å; A304-I308 WeakPolarHBondContact O-CG2 3.4Å; A304-I308 PolarHBondContact O-N 3.39Å; A304-V325 HydrophobicContact CB-CG1 4.46Å; A304-V325 HydrophobicContact CB-CG2 4.19Å
305	Y	98.3	Very high	95.4	Very high	58 Å²	58	66.8 Å²	66.8	23%	0.227	33%	0.328	C	S	.	.	H	α-helix	trans	-66.7	-44.9	176.3	-179.3	-104.7	0	0	0	113	V301 Q302 E303 L307 I308 K309 V325 L329 H338	V301-Y305 WeakPolarHBondContact O-CB 3.48Å; V301-Y305 PolarHBondContact O-N 2.99Å; Q302-Y305 PolarHBondContact O-N 2.81Å; E303-Y305 VanDerWaalsContact C-N 3.3Å; E303-Y305 PolarHBondContact O-N 2.83Å; Y305-L307 PolarHBondContact O-N 3.4Å; Y305-I308 PolarHBondContact O-N 2.74Å; Y305-I308 VanDerWaalsContact O-N 3.11Å; Y305-K309 HydrophobicContact CD1-CB 4.43Å; Y305-K309 HydrophobicContact CD1-CD 4.43Å; Y305-K309 HydrophobicContact CD2-CB 4.44Å; Y305-K309 HydrophobicContact CE1-CB 4.02Å; Y305-K309 HydrophobicContact CE1-CD 4.05Å; Y305-K309 HydrophobicContact CE2-CB 4.03Å; Y305-K309 WeakPolarHBondContact O-CB 3.44Å; Y305-K309 PolarHBondContact O-N 3.42Å; Y305-V325 HydrophobicContact CD2-CG1 4.02Å; Y305-V325 HydrophobicContact CG-CG1 4.4Å; Y305-L329 HydrophobicContact CD1-CD2 3.85Å; Y305-L329 HydrophobicContact CD2-CD2 3.59Å; Y305-L329 HydrophobicContact CE1-CD2 4.21Å; Y305-L329 HydrophobicContact CE2-CD2 3.97Å; Y305-L329 HydrophobicContact CG-CD2 3.52Å; Y305-H338 AromaticContact CE2-CE1 3.81Å; Y305-H338 AromaticContact CZ-CE1 3.84Å
306	N	97.7	Very high	95.1	Very high	57 Å²	57	66.9 Å²	66.9	31%	0.305	33%	0.333	S	S	.	.	H	α-helix	trans	-56.6	-35.2	179.7	-76.4	-27	0	0	0	112.6	Q302 E303	Q302-N306 PolarHBondContact NE2-OD1 3.2Å; Q302-N306 VanDerWaalsContact O-CG 3.27Å; Q302-N306 PolarHBondContact O-N 3.23Å; Q302-N306 PolarHBondContact O-ND2 2.9Å; E303-N306 PolarHBondContact O-N 3.44Å; E303-N306 PolarHBondContact OE1-ND2 2.94Å
307	L	96.4	Very high	94.9	Very high	35 Å²	35	70 Å²	70	18%	0.183	35%	0.347	C	S	.	.	H	α-helix	trans	-76.8	-26.5	179	-77.3	179.3	0	0	0	115	R288 L291 V292 Y295 E303 Y305	R288-L307 PolarHBondContact NH1-O 3.24Å; L291-L307 HydrophobicContact CB-CD1 4.12Å; L291-L307 HydrophobicContact CD2-CD1 3.61Å; L291-L307 HydrophobicContact CG-CD1 3.58Å; V292-L307 HydrophobicContact CG2-CB 3.59Å; V292-L307 HydrophobicContact CG2-CD1 4.03Å; Y295-L307 HydrophobicContact CD2-CD1 3.82Å; Y295-L307 HydrophobicContact CE2-CD1 3.61Å; E303-L307 PolarHBondContact O-N 3.46Å; Y305-L307 PolarHBondContact O-N 3.4Å
308	I	96.6	Very high	94.9	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-113.8	-12.7	-169.5	-151	173.5	0	0	0	114.5	V292 A304 Y305 D310 L311 L321 K322 V325	V292-I308 HydrophobicContact CG1-CD1 4.42Å; V292-I308 HydrophobicContact CG2-CB 4.21Å; A304-I308 WeakPolarHBondContact O-CG2 3.4Å; A304-I308 PolarHBondContact O-N 3.39Å; Y305-I308 PolarHBondContact O-N 2.74Å; Y305-I308 VanDerWaalsContact O-N 3.11Å; I308-D310 VanDerWaalsContact C-N 3.29Å; I308-D310 PolarHBondContact O-N 3.43Å; I308-L311 HydrophobicContact CD1-CD2 4.32Å; I308-L311 HydrophobicContact CG1-CB 4.11Å; I308-L311 HydrophobicContact CG1-CD2 3.79Å; I308-L311 WeakPolarHBondContact O-CB 3.42Å; I308-L311 PolarHBondContact O-N 3.09Å; I308-L311 VanDerWaalsContact O-N 3.12Å; I308-L321 HydrophobicContact CD1-CB 3.85Å; I308-L321 HydrophobicContact CD1-CD2 3.86Å; I308-L321 HydrophobicContact CD1-CG 3.71Å; I308-K322 HydrophobicContact CD1-CG 3.67Å; I308-K322 HydrophobicContact CG1-CG 3.81Å; I308-V325 HydrophobicContact CG2-CB 4.21Å; I308-V325 HydrophobicContact CG2-CG1 3.99Å; I308-V325 HydrophobicContact CG2-CG2 4.17Å
309	K	96	Very high	95	Very high	86 Å²	86	62 Å²	62	37%	0.374	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-44.3	-176.6	64.4	-173.8	-179.3	-173.9	0	112.9	Y305 K322	Y305-K309 HydrophobicContact CD1-CB 4.43Å; Y305-K309 HydrophobicContact CD1-CD 4.43Å; Y305-K309 HydrophobicContact CD2-CB 4.44Å; Y305-K309 HydrophobicContact CE1-CB 4.02Å; Y305-K309 HydrophobicContact CE1-CD 4.05Å; Y305-K309 HydrophobicContact CE2-CB 4.03Å; Y305-K309 WeakPolarHBondContact O-CB 3.44Å; Y305-K309 PolarHBondContact O-N 3.42Å; K309-K322 PolarHBondContact O-NZ 3.18Å
310	D	94.4	Very high	95.2	Very high	130 Å²	130	58.8 Å²	58.8	70%	0.695	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-1.5	-176.4	-55.5	-47.4	0	0	0	113.4	I308 E312	I308-D310 VanDerWaalsContact C-N 3.29Å; I308-D310 PolarHBondContact O-N 3.43Å; D310-E312 PolarHBondContact O-N 3.39Å
311	L	93.5	Very high	95.2	Very high	32 Å²	32	56.6 Å²	56.6	17%	0.168	28%	0.284	C	S	.	.			trans	-75.1	121.4	176.4	-179.7	69.8	0	0	0	109.7	L289 I308 P313 E318 K322	L289-L311 HydrophobicContact CD2-CD2 3.86Å; I308-L311 HydrophobicContact CD1-CD2 4.32Å; I308-L311 HydrophobicContact CG1-CB 4.11Å; I308-L311 HydrophobicContact CG1-CD2 3.79Å; I308-L311 WeakPolarHBondContact O-CB 3.42Å; I308-L311 PolarHBondContact O-N 3.09Å; I308-L311 VanDerWaalsContact O-N 3.12Å; L311-P313 WeakPolarHBondContact O-CD 3.49Å; L311-E318 HydrophobicContact CD2-CB 4.17Å; L311-E318 HydrophobicContact CD2-CG 3.98Å; L311-K322 PolarHBondContact O-NZ 3.17Å
312	E	92.8	Very high	95.2	Very high	167 Å²	167	57 Å²	57	78%	0.78	28%	0.284	S	S	*	.			trans	-81.7	111	166.9	-67.6	-174.7	170.2	0	0	109.2	D310	D310-E312 PolarHBondContact O-N 3.39Å
313	P	92.9	Very high	95.2	Very high	21 Å²	21	53.6 Å²	53.6	14%	0.136	27%	0.269	C	S	.	.			trans	-71.4	133.8	-174.8	30.4	-35.8	0	0	0	111.4	L311 E318 Y319 K322 F345	L311-P313 WeakPolarHBondContact O-CD 3.49Å; P313-E318 HydrophobicContact CB-CB 3.76Å; P313-Y319 HydrophobicContact CB-CD1 3.78Å; P313-Y319 HydrophobicContact CB-CD2 3.88Å; P313-Y319 HydrophobicContact CB-CE1 3.84Å; P313-Y319 HydrophobicContact CB-CE2 3.87Å; P313-Y319 HydrophobicContact CB-CG 3.8Å; P313-Y319 HydrophobicContact CG-CD1 3.59Å; P313-Y319 HydrophobicContact CG-CD2 4.47Å; P313-Y319 HydrophobicContact CG-CE1 3.35Å; P313-Y319 HydrophobicContact CG-CE2 4.23Å; P313-Y319 HydrophobicContact CG-CG 4.16Å; P313-Y319 WeakPolarHBondContact O-CE2 3.46Å; P313-Y319 VanDerWaalsContact O-CZ 3.25Å; P313-Y319 PolarHBondContact O-OH 3.2Å; P313-K322 HydrophobicContact CB-CD 4.3Å; P313-K322 HydrophobicContact CG-CD 4.02Å; P313-F345 HydrophobicContact CG-CE1 4.25Å
314	T	88.6	Confident	95.3	Very high	113 Å²	113	52.9 Å²	52.9	69%	0.693	27%	0.269	S	S	*	.			trans	-123.5	-22	178.4	60.1	0	0	0	0	112.6	E318	T314-E318 PolarHBondContact N-OE2 3.47Å; T314-E318 PolarHBondContact OG1-OE2 3.35Å
315	T	88.5	Confident	95.3	Very high	33 Å²	33	52.9 Å²	52.9	20%	0.202	27%	0.269	C	S	.	.	S	Bend	trans	-114.3	151.1	178.8	61.9	0	0	0	0	111.4	Q317 E318 Y319	T315-Q317 PolarHBondContact O-N 3.27Å; T315-Q317 VanDerWaalsContact O-N 3.15Å; T315-E318 PolarHBondContact N-OE2 3.02Å; T315-E318 WeakPolarHBondContact O-CB 3.38Å; T315-E318 PolarHBondContact O-N 2.93Å; T315-E318 VanDerWaalsContact OG1-CD 3.24Å; T315-E318 VanDerWaalsContact OG1-CG 3.24Å; T315-E318 WeakPolarHBondContact OG1-CG 3.13Å; T315-E318 PolarHBondContact OG1-OE2 3.4Å; T315-E318 VanDerWaalsContact OG1-OE2 3.11Å; T315-Y319 WeakPolarHBondContact O-CD2 3.43Å; T315-Y319 PolarHBondContact O-N 2.95Å
316	P	91.7	Very high	95.3	Very high	39 Å²	39	50.4 Å²	50.4	25%	0.253	26%	0.26	S	S	.	.	H	α-helix	trans	-51.1	-39.7	177.9	-28.4	35.5	0	0	0	113.2	E318 Y319 I320 E355	P316-E318 VanDerWaalsContact C-N 3.33Å; P316-E318 PolarHBondContact O-N 3.48Å; P316-Y319 PolarHBondContact O-N 3.34Å; P316-I320 WeakPolarHBondContact O-CG1 3.49Å; P316-I320 PolarHBondContact O-N 2.89Å; P316-E355 HydrophobicContact CB-CG 4.08Å; P316-E355 HydrophobicContact CG-CG 4.05Å; P316-E355 WeakPolarHBondContact CG-OE1 3.37Å
317	Q	92.7	Very high	95.3	Very high	98 Å²	98	48.6 Å²	48.6	46%	0.458	25%	0.253	S	S	.	.	H	α-helix	trans	-62.3	-38	179.8	-61.5	82	0.5	0	0	112.5	T315 L321	T315-Q317 PolarHBondContact O-N 3.27Å; T315-Q317 VanDerWaalsContact O-N 3.15Å; Q317-L321 WeakPolarHBondContact O-CB 3.18Å; Q317-L321 PolarHBondContact O-N 3.19Å
318	E	95.5	Very high	95.4	Very high	29 Å²	29	48.4 Å²	48.4	14%	0.136	26%	0.256	C	S	.	.	H	α-helix	trans	-68.8	-42.6	176.2	-66.7	167.6	153.5	0	0	111.3	L289 L311 P313 T314 T315 P316 L321 K322	L289-E318 HydrophobicContact CD1-CG 3.9Å; L289-E318 HydrophobicContact CD2-CG 4.09Å; L311-E318 HydrophobicContact CD2-CB 4.17Å; L311-E318 HydrophobicContact CD2-CG 3.98Å; P313-E318 HydrophobicContact CB-CB 3.76Å; T314-E318 PolarHBondContact N-OE2 3.47Å; T314-E318 PolarHBondContact OG1-OE2 3.35Å; T315-E318 PolarHBondContact N-OE2 3.02Å; T315-E318 WeakPolarHBondContact O-CB 3.38Å; T315-E318 PolarHBondContact O-N 2.93Å; T315-E318 VanDerWaalsContact OG1-CD 3.24Å; T315-E318 VanDerWaalsContact OG1-CG 3.24Å; T315-E318 WeakPolarHBondContact OG1-CG 3.13Å; T315-E318 PolarHBondContact OG1-OE2 3.4Å; T315-E318 VanDerWaalsContact OG1-OE2 3.11Å; P316-E318 VanDerWaalsContact C-N 3.33Å; P316-E318 PolarHBondContact O-N 3.48Å; E318-L321 PolarHBondContact O-N 2.91Å; E318-K322 WeakPolarHBondContact O-CG 3.31Å; E318-K322 PolarHBondContact O-N 2.87Å
319	Y	96.9	Very high	95.5	Very high	73 Å²	73	48.5 Å²	48.5	29%	0.286	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-47.5	174.4	-76.8	-77.2	0	0	0	111.8	P313 T315 P316 L321 K322 G323 F345 L348 V349	P313-Y319 HydrophobicContact CB-CD1 3.78Å; P313-Y319 HydrophobicContact CB-CD2 3.88Å; P313-Y319 HydrophobicContact CB-CE1 3.84Å; P313-Y319 HydrophobicContact CB-CE2 3.87Å; P313-Y319 HydrophobicContact CB-CG 3.8Å; P313-Y319 HydrophobicContact CG-CD1 3.59Å; P313-Y319 HydrophobicContact CG-CD2 4.47Å; P313-Y319 HydrophobicContact CG-CE1 3.35Å; P313-Y319 HydrophobicContact CG-CE2 4.23Å; P313-Y319 HydrophobicContact CG-CG 4.16Å; P313-Y319 WeakPolarHBondContact O-CE2 3.46Å; P313-Y319 VanDerWaalsContact O-CZ 3.25Å; P313-Y319 PolarHBondContact O-OH 3.2Å; T315-Y319 WeakPolarHBondContact O-CD2 3.43Å; T315-Y319 PolarHBondContact O-N 2.95Å; P316-Y319 PolarHBondContact O-N 3.34Å; Y319-L321 VanDerWaalsContact C-N 3.34Å; Y319-L321 PolarHBondContact O-N 2.92Å; Y319-K322 PolarHBondContact O-N 2.95Å; Y319-G323 PolarHBondContact O-N 3.47Å; Y319-F345 AromaticContact CD1-CD1 3.67Å; Y319-F345 HydrophobicContact CD1-CD1 3.67Å; Y319-F345 AromaticContact CD1-CE1 3.94Å; Y319-F345 HydrophobicContact CD1-CE1 3.94Å; Y319-F345 HydrophobicContact CE1-CD1 4.28Å; Y319-F345 HydrophobicContact CE1-CE1 4.21Å; Y319-L348 HydrophobicContact CE1-CD1 4.42Å; Y319-V349 VanDerWaalsContact CB-CG2 3.41Å; Y319-V349 HydrophobicContact CG-CG2 4.32Å
320	I	97.9	Very high	95.5	Very high	41 Å²	41	44.4 Å²	44.4	21%	0.21	24%	0.239	C	C	.	.	H	α-helix	trans	-56.5	-50.8	177.2	-67.4	167.2	0	0	0	109.9	P316 K322 G323 V324 V349 P360	P316-I320 WeakPolarHBondContact O-CG1 3.49Å; P316-I320 PolarHBondContact O-N 2.89Å; I320-K322 PolarHBondContact O-N 3.5Å; I320-G323 WeakPolarHBondContact O-CA 3.47Å; I320-G323 PolarHBondContact O-N 3.45Å; I320-G323 VanDerWaalsContact O-N 3.08Å; I320-V324 HydrophobicContact CG2-CG2 4.35Å; I320-V324 WeakPolarHBondContact O-CG2 3.47Å; I320-V324 PolarHBondContact O-N 3.46Å; I320-V349 HydrophobicContact CD1-CG1 4.13Å; I320-V349 HydrophobicContact CG1-CB 4.45Å; I320-V349 HydrophobicContact CG1-CG1 3.91Å; I320-V349 HydrophobicContact CG1-CG2 4.06Å; I320-P360 HydrophobicContact CD1-CB 3.87Å
321	L	97.8	Very high	95.6	Very high	16 Å²	16	45 Å²	45	8%	0.084	24%	0.237	C	C	.	.	H	α-helix	trans	-66	-39.3	-175.6	-164.6	59.8	0	0	0	111.8	L289 V292 I293 L296 I308 Q317 E318 Y319 G323 V324 V325	L289-L321 HydrophobicContact CB-CD2 4Å; L289-L321 HydrophobicContact CD2-CD2 3.95Å; V292-L321 HydrophobicContact CB-CD2 3.84Å; V292-L321 HydrophobicContact CB-CG 4.43Å; V292-L321 HydrophobicContact CG1-CD1 3.92Å; V292-L321 HydrophobicContact CG1-CD2 3.65Å; V292-L321 HydrophobicContact CG1-CG 3.69Å; I293-L321 HydrophobicContact CG1-CD1 3.78Å; I293-L321 HydrophobicContact CG1-CD2 4.22Å; L296-L321 HydrophobicContact CD1-CD1 3.74Å; I308-L321 HydrophobicContact CD1-CB 3.85Å; I308-L321 HydrophobicContact CD1-CD2 3.86Å; I308-L321 HydrophobicContact CD1-CG 3.71Å; Q317-L321 WeakPolarHBondContact O-CB 3.18Å; Q317-L321 PolarHBondContact O-N 3.19Å; E318-L321 PolarHBondContact O-N 2.91Å; Y319-L321 VanDerWaalsContact C-N 3.34Å; Y319-L321 PolarHBondContact O-N 2.92Å; L321-G323 VanDerWaalsContact C-N 3.31Å; L321-G323 PolarHBondContact O-N 2.52Å; L321-V324 PolarHBondContact O-N 3.39Å; L321-V325 WeakPolarHBondContact O-CB 3.47Å; L321-V325 VanDerWaalsContact O-CG2 3.24Å; L321-V325 WeakPolarHBondContact O-CG2 3.39Å; L321-V325 PolarHBondContact O-N 2.98Å
322	K	98.1	Very high	95.7	Very high	25 Å²	25	49.4 Å²	49.4	11%	0.109	26%	0.257	C	S	.	.	H	α-helix	trans	-61	-40.7	171.1	-72.1	-164.9	83.4	158.7	0	111.6	I308 K309 L311 P313 E318 Y319 I320 N326 F345	I308-K322 HydrophobicContact CD1-CG 3.67Å; I308-K322 HydrophobicContact CG1-CG 3.81Å; K309-K322 PolarHBondContact O-NZ 3.18Å; L311-K322 PolarHBondContact O-NZ 3.17Å; P313-K322 HydrophobicContact CB-CD 4.3Å; P313-K322 HydrophobicContact CG-CD 4.02Å; E318-K322 WeakPolarHBondContact O-CG 3.31Å; E318-K322 PolarHBondContact O-N 2.87Å; Y319-K322 PolarHBondContact O-N 2.95Å; I320-K322 PolarHBondContact O-N 3.5Å; K322-N326 WeakPolarHBondContact O-CB 3.31Å; K322-N326 PolarHBondContact O-N 3.15Å; K322-N326 PolarHBondContact O-ND2 2.94Å; K322-F345 HydrophobicContact CB-CD2 3.85Å; K322-F345 HydrophobicContact CB-CE2 3.7Å; K322-F345 HydrophobicContact CB-CG 4.46Å; K322-F345 HydrophobicContact CB-CZ 4.19Å; K322-F345 HydrophobicContact CD-CE2 4.36Å; K322-F345 HydrophobicContact CD-CZ 4.13Å
323	G	98.2	Very high	95.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59	-50.9	174.8	0	0	0	0	0	112.3	Y319 I320 L321 N326 A327 A342 F346	Y319-G323 PolarHBondContact O-N 3.47Å; I320-G323 WeakPolarHBondContact O-CA 3.47Å; I320-G323 PolarHBondContact O-N 3.45Å; I320-G323 VanDerWaalsContact O-N 3.08Å; L321-G323 VanDerWaalsContact C-N 3.31Å; L321-G323 PolarHBondContact O-N 2.52Å; G323-N326 PolarHBondContact O-N 3.35Å; G323-A327 WeakPolarHBondContact O-CB 3.44Å; G323-A327 PolarHBondContact O-N 3.19Å; G323-A342 WeakPolarHBondContact O-CB 3.09Å; G323-F346 VanDerWaalsContact C-CZ 3.46Å
324	V	98.3	Very high	95.9	Very high	58 Å²	58	48.5 Å²	48.5	35%	0.352	27%	0.269	S	S	.	.	H	α-helix	trans	-61	-48.3	179.3	173.9	0	0	0	0	111.7	L296 I320 L321 N326 A327 A328 F346	L296-V324 HydrophobicContact CD1-CG1 3.81Å; I320-V324 HydrophobicContact CG2-CG2 4.35Å; I320-V324 WeakPolarHBondContact O-CG2 3.47Å; I320-V324 PolarHBondContact O-N 3.46Å; L321-V324 PolarHBondContact O-N 3.39Å; V324-N326 PolarHBondContact O-N 2.92Å; V324-A327 PolarHBondContact O-N 3.43Å; V324-A328 WeakPolarHBondContact O-CB 3.3Å; V324-A328 PolarHBondContact O-N 3.11Å; V324-F346 HydrophobicContact CG2-CE1 4.06Å; V324-F346 HydrophobicContact CG2-CZ 4.15Å
325	V	98.5	Very high	96.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.4	-43.2	-179.8	173.5	0	0	0	0	111.2	V292 L296 A304 Y305 I308 L321 A328 L329	V292-V325 HydrophobicContact CG1-CG2 3.64Å; L296-V325 HydrophobicContact CD1-CG2 3.85Å; L296-V325 HydrophobicContact CD2-CG2 4.08Å; L296-V325 HydrophobicContact CG-CG2 4.24Å; A304-V325 HydrophobicContact CB-CG1 4.46Å; A304-V325 HydrophobicContact CB-CG2 4.19Å; Y305-V325 HydrophobicContact CD2-CG1 4.02Å; Y305-V325 HydrophobicContact CG-CG1 4.4Å; I308-V325 HydrophobicContact CG2-CB 4.21Å; I308-V325 HydrophobicContact CG2-CG1 3.99Å; I308-V325 HydrophobicContact CG2-CG2 4.17Å; L321-V325 WeakPolarHBondContact O-CB 3.47Å; L321-V325 VanDerWaalsContact O-CG2 3.24Å; L321-V325 WeakPolarHBondContact O-CG2 3.39Å; L321-V325 PolarHBondContact O-N 2.98Å; V325-A328 PolarHBondContact O-N 2.82Å; V325-L329 VanDerWaalsContact O-CB 3.27Å; V325-L329 WeakPolarHBondContact O-CB 3.28Å; V325-L329 PolarHBondContact O-N 3.19Å
326	N	98.4	Very high	96.7	Very high	5 Å²	5	52.8 Å²	52.8	3%	0.027	27%	0.274	C	S	.	.	H	α-helix	trans	-67.6	-35.2	176.6	-81	-88	0	0	0	112.2	K322 G323 V324 G330 H338 I341 A342	K322-N326 WeakPolarHBondContact O-CB 3.31Å; K322-N326 PolarHBondContact O-N 3.15Å; K322-N326 PolarHBondContact O-ND2 2.94Å; G323-N326 PolarHBondContact O-N 3.35Å; V324-N326 PolarHBondContact O-N 2.92Å; N326-G330 WeakPolarHBondContact O-CA 3.42Å; N326-G330 PolarHBondContact O-N 3.07Å; N326-H338 WeakPolarHBondContact O-CB 3.33Å; N326-H338 PolarHBondContact OD1-ND1 3.2Å; N326-I341 HydrophobicContact CB-CB 4.49Å; N326-I341 HydrophobicContact CB-CG2 4.18Å; N326-A342 HydrophobicContact CB-CB 4.02Å
327	A	98.2	Very high	97	Very high	19 Å²	19	56.1 Å²	56.1	16%	0.157	29%	0.289	C	S	.	.	H	α-helix	trans	-64.5	-47.9	175.7	0	0	0	0	0	111.1	G323 V324 G330 Q331 A342 F346	G323-A327 WeakPolarHBondContact O-CB 3.44Å; G323-A327 PolarHBondContact O-N 3.19Å; V324-A327 PolarHBondContact O-N 3.43Å; A327-G330 PolarHBondContact O-N 3.38Å; A327-Q331 WeakPolarHBondContact O-CB 3.46Å; A327-Q331 PolarHBondContact O-N 3.22Å; A327-A342 HydrophobicContact CB-CB 3.8Å; A327-F346 HydrophobicContact CB-CE2 4.24Å; A327-F346 HydrophobicContact CB-CZ 4.42Å
328	A	97.7	Very high	97.2	Very high	31 Å²	31	52.9 Å²	52.9	26%	0.256	27%	0.274	S	S	.	.	H	α-helix	trans	-61.1	-49	177.8	0	0	0	0	0	111.3	L296 V301 V324 V325 G330 Q331 E332	L296-A328 HydrophobicContact CD2-CB 4.4Å; V301-A328 HydrophobicContact CG1-CB 3.65Å; V301-A328 HydrophobicContact CG2-CB 3.98Å; V324-A328 WeakPolarHBondContact O-CB 3.3Å; V324-A328 PolarHBondContact O-N 3.11Å; V325-A328 PolarHBondContact O-N 2.82Å; A328-G330 PolarHBondContact O-N 2.98Å; A328-Q331 WeakPolarHBondContact O-CB 3.24Å; A328-Q331 PolarHBondContact O-N 2.89Å; A328-E332 PolarHBondContact O-N 2.8Å
329	L	97.9	Very high	97.3	Very high	2 Å²	2	53 Å²	53	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-66.4	-40.5	-178.9	-170.6	69.2	0	0	0	111.7	V301 Y305 V325 Q331 E332 M333	V301-L329 HydrophobicContact CG1-CB 3.79Å; V301-L329 HydrophobicContact CG1-CD1 4.04Å; Y305-L329 HydrophobicContact CD1-CD2 3.85Å; Y305-L329 HydrophobicContact CD2-CD2 3.59Å; Y305-L329 HydrophobicContact CE1-CD2 4.21Å; Y305-L329 HydrophobicContact CE2-CD2 3.97Å; Y305-L329 HydrophobicContact CG-CD2 3.52Å; V325-L329 VanDerWaalsContact O-CB 3.27Å; V325-L329 WeakPolarHBondContact O-CB 3.28Å; V325-L329 PolarHBondContact O-N 3.19Å; L329-Q331 VanDerWaalsContact C-N 3.27Å; L329-Q331 PolarHBondContact O-N 3.12Å; L329-E332 PolarHBondContact O-N 3.48Å; L329-M333 HydrophobicContact CD1-CE 3.62Å; L329-M333 HydrophobicContact CD1-CG 4.25Å; L329-M333 HydrophobicContact CD1-SD 3.84Å; L329-M333 HydrophobicContact CD2-SD 4.4Å; L329-M333 HydrophobicContact CG-CE 4.31Å; L329-M333 HydrophobicContact CG-CG 4.43Å; L329-M333 HydrophobicContact CG-SD 3.89Å; L329-M333 WeakPolarHBondContact O-CB 3.43Å; L329-M333 WeakPolarHBondContact O-CG 3.47Å; L329-M333 PolarHBondContact O-N 2.92Å
330	G	97.6	Very high	97.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.9	-37.1	175	0	0	0	0	0	112.4	N326 A327 A328 G334 S335 M339	N326-G330 WeakPolarHBondContact O-CA 3.42Å; N326-G330 PolarHBondContact O-N 3.07Å; A327-G330 PolarHBondContact O-N 3.38Å; A328-G330 PolarHBondContact O-N 2.98Å; G330-G334 CarbonylContact O-C 3.49Å; G330-G334 VanDerWaalsContact O-CA 3.27Å; G330-G334 WeakPolarHBondContact O-CA 3.47Å; G330-G334 PolarHBondContact O-N 3.3Å; G330-S335 PolarHBondContact O-N 2.99Å; G330-M339 VanDerWaalsContact C-CE 3.41Å
331	Q	95.2	Very high	97.3	Very high	142 Å²	142	56.1 Å²	56.1	66%	0.664	29%	0.291	S	S	*	.	H	α-helix	trans	-69.6	-45.4	177.4	-174.2	58	46.4	0	0	111.4	A327 A328 L329 M339	A327-Q331 WeakPolarHBondContact O-CB 3.46Å; A327-Q331 PolarHBondContact O-N 3.22Å; A328-Q331 WeakPolarHBondContact O-CB 3.24Å; A328-Q331 PolarHBondContact O-N 2.89Å; L329-Q331 VanDerWaalsContact C-N 3.27Å; L329-Q331 PolarHBondContact O-N 3.12Å; Q331-M339 HydrophobicContact CB-CE 3.73Å
332	E	95.3	Very high	97.4	Very high	126 Å²	126	55.3 Å²	55.3	59%	0.589	29%	0.287	S	S	*	.	H	α-helix	trans	-66.1	-43.7	-179.5	-170.1	-179.9	163	0	0	112	V301 A328 L329	V301-E332 WeakPolarHBondContact CB-OE2 3.44Å; A328-E332 PolarHBondContact O-N 2.8Å; L329-E332 PolarHBondContact O-N 3.48Å
333	M	95.8	Very high	97.3	Very high	106 Å²	106	56.3 Å²	56.3	52%	0.522	29%	0.292	S	S	.	.	H	α-helix	trans	-88	-6.4	-178.2	-63.7	-174.9	165.7	0	0	114.1	Q302 L329 S335	Q302-M333 VanDerWaalsContact OE1-CE 3.23Å; L329-M333 HydrophobicContact CD1-CE 3.62Å; L329-M333 HydrophobicContact CD1-CG 4.25Å; L329-M333 HydrophobicContact CD1-SD 3.84Å; L329-M333 HydrophobicContact CD2-SD 4.4Å; L329-M333 HydrophobicContact CG-CE 4.31Å; L329-M333 HydrophobicContact CG-CG 4.43Å; L329-M333 HydrophobicContact CG-SD 3.89Å; L329-M333 WeakPolarHBondContact O-CB 3.43Å; L329-M333 WeakPolarHBondContact O-CG 3.47Å; L329-M333 PolarHBondContact O-N 2.92Å; M333-S335 PolarHBondContact O-N 3.04Å
334	G	95.6	Very high	97.3	Very high	63 Å²	63	61.9 Å²	61.9	65%	0.649	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	23.9	-168.9	0	0	0	0	0	113.7	G330 R336	G330-G334 CarbonylContact O-C 3.49Å; G330-G334 VanDerWaalsContact O-CA 3.27Å; G330-G334 WeakPolarHBondContact O-CA 3.47Å; G330-G334 PolarHBondContact O-N 3.3Å; G334-R336 PolarHBondContact O-N 3.28Å
335	S	97.3	Very high	97.3	Very high	29 Å²	29	60.6 Å²	60.6	20%	0.203	31%	0.307	C	S	.	.			trans	-82.3	111.7	-174.5	175.9	0	0	0	0	112	G330 M333 D337 H338 M339	G330-S335 PolarHBondContact O-N 2.99Å; M333-S335 PolarHBondContact O-N 3.04Å; S335-D337 PolarHBondContact O-N 3.32Å; S335-H338 PolarHBondContact O-N 3.43Å; S335-H338 PolarHBondContact OG-CD2 3.02Å; S335-H338 PolarHBondContact OG-N 2.95Å; S335-M339 WeakPolarHBondContact O-CG 3.39Å; S335-M339 PolarHBondContact O-N 3.26Å
336	R	96.3	Very high	97.3	Very high	207 Å²	207	61 Å²	61	78%	0.781	31%	0.309	S	S	*	.	H	α-helix	trans	-64.6	-28.1	175.5	-68.2	-175.4	177.7	-176.5	-0.2	113.1	G334 K340	G334-R336 PolarHBondContact O-N 3.28Å; R336-K340 WeakPolarHBondContact O-CG 3.41Å; R336-K340 PolarHBondContact O-N 3.37Å
337	D	97.1	Very high	97.2	Very high	108 Å²	108	66.4 Å²	66.4	58%	0.578	33%	0.334	S	S	*	.	H	α-helix	trans	-72.8	-44.8	-178.8	-66.3	-25.6	0	0	0	110.7	S335 M339 K340 I341	S335-D337 PolarHBondContact O-N 3.32Å; D337-M339 VanDerWaalsContact C-N 3.31Å; D337-M339 PolarHBondContact O-N 2.93Å; D337-K340 PolarHBondContact O-N 3.04Å; D337-I341 WeakPolarHBondContact O-CG1 3.35Å; D337-I341 PolarHBondContact O-N 3.37Å
338	H	98	Very high	97.2	Very high	30 Å²	30	70.5 Å²	70.5	14%	0.139	35%	0.353	C	S	.	.	H	α-helix	trans	-61.6	-39.2	172.9	-75.9	-59.4	0	0	0	112	Y305 N326 S335 K340 I341 A342	Y305-H338 AromaticContact CE2-CE1 3.81Å; Y305-H338 AromaticContact CZ-CE1 3.84Å; N326-H338 WeakPolarHBondContact O-CB 3.33Å; N326-H338 PolarHBondContact OD1-ND1 3.2Å; S335-H338 PolarHBondContact O-N 3.43Å; S335-H338 PolarHBondContact OG-CD2 3.02Å; S335-H338 PolarHBondContact OG-N 2.95Å; H338-K340 VanDerWaalsContact C-N 3.35Å; H338-K340 PolarHBondContact O-N 3.45Å; H338-I341 PolarHBondContact O-N 3.38Å; H338-A342 WeakPolarHBondContact O-CB 3.42Å; H338-A342 PolarHBondContact O-N 3.29Å
339	M	97.6	Very high	97.1	Very high	33 Å²	33	69.3 Å²	69.3	16%	0.163	34%	0.342	C	S	.	.	H	α-helix	trans	-60.7	-41.7	174.2	-67.9	-57.6	-163.1	0	0	112.9	G330 Q331 S335 D337 A342 Q343 L371	G330-M339 VanDerWaalsContact C-CE 3.41Å; Q331-M339 HydrophobicContact CB-CE 3.73Å; S335-M339 WeakPolarHBondContact O-CG 3.39Å; S335-M339 PolarHBondContact O-N 3.26Å; D337-M339 VanDerWaalsContact C-N 3.31Å; D337-M339 PolarHBondContact O-N 2.93Å; M339-A342 PolarHBondContact O-N 3.38Å; M339-Q343 VanDerWaalsContact O-CG 3.31Å; M339-Q343 WeakPolarHBondContact O-CG 3.38Å; M339-Q343 PolarHBondContact O-N 2.95Å; M339-L371 HydrophobicContact SD-CD2 4.03Å
340	K	97.8	Very high	97	Very high	119 Å²	119	69.5 Å²	69.5	52%	0.517	35%	0.345	S	S	.	.	H	α-helix	trans	-66	-41.7	176.2	-74.6	174.1	-179	175.2	0	112	R336 D337 H338 A342 Q343 Q344	R336-K340 WeakPolarHBondContact O-CG 3.41Å; R336-K340 PolarHBondContact O-N 3.37Å; D337-K340 PolarHBondContact O-N 3.04Å; H338-K340 VanDerWaalsContact C-N 3.35Å; H338-K340 PolarHBondContact O-N 3.45Å; K340-A342 VanDerWaalsContact C-N 3.32Å; K340-A342 PolarHBondContact O-N 3.41Å; K340-Q343 PolarHBondContact O-N 3.38Å; K340-Q344 WeakPolarHBondContact O-CG 3.39Å; K340-Q344 PolarHBondContact O-N 3.02Å
341	I	97.4	Very high	96.8	Very high	59 Å²	59	72.2 Å²	72.2	30%	0.303	37%	0.373	S	S	.	.	H	α-helix	trans	-61	-44	176.7	-68.6	166.8	0	0	0	110.2	N326 D337 H338 Q344 F345	N326-I341 HydrophobicContact CB-CB 4.49Å; N326-I341 HydrophobicContact CB-CG2 4.18Å; D337-I341 WeakPolarHBondContact O-CG1 3.35Å; D337-I341 PolarHBondContact O-N 3.37Å; H338-I341 PolarHBondContact O-N 3.38Å; I341-Q344 PolarHBondContact O-N 2.97Å; I341-F345 HydrophobicContact CG2-CD2 3.67Å; I341-F345 HydrophobicContact CG2-CE2 3.33Å; I341-F345 HydrophobicContact CG2-CZ 4.29Å; I341-F345 WeakPolarHBondContact O-CD2 3.35Å; I341-F345 PolarHBondContact O-N 3.5Å
342	A	98.3	Very high	96.8	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-60	-47.1	176.3	0	0	0	0	0	112.3	G323 N326 A327 H338 M339 K340 Q344 F345 F346 L371	G323-A342 WeakPolarHBondContact O-CB 3.09Å; N326-A342 HydrophobicContact CB-CB 4.02Å; A327-A342 HydrophobicContact CB-CB 3.8Å; H338-A342 WeakPolarHBondContact O-CB 3.42Å; H338-A342 PolarHBondContact O-N 3.29Å; M339-A342 PolarHBondContact O-N 3.38Å; K340-A342 VanDerWaalsContact C-N 3.32Å; K340-A342 PolarHBondContact O-N 3.41Å; A342-Q344 VanDerWaalsContact C-N 3.33Å; A342-Q344 PolarHBondContact O-N 3.25Å; A342-F345 PolarHBondContact O-N 3.32Å; A342-F346 HydrophobicContact CB-CE2 4.23Å; A342-F346 WeakPolarHBondContact O-CD2 3.17Å; A342-F346 WeakPolarHBondContact O-CG 3.34Å; A342-F346 PolarHBondContact O-N 2.88Å; A342-L371 HydrophobicContact CB-CD1 3.96Å
343	Q	97.6	Very high	96.5	Very high	46 Å²	46	66 Å²	66	22%	0.215	37%	0.365	C	S	.	.	H	α-helix	trans	-56.5	-45.8	175.5	-71.9	170.1	21.2	0	0	111.9	M339 K340 F345 F346 Q347 L371	M339-Q343 VanDerWaalsContact O-CG 3.31Å; M339-Q343 WeakPolarHBondContact O-CG 3.38Å; M339-Q343 PolarHBondContact O-N 2.95Å; K340-Q343 PolarHBondContact O-N 3.38Å; Q343-F345 PolarHBondContact O-N 3.43Å; Q343-F346 PolarHBondContact O-N 3.23Å; Q343-Q347 WeakPolarHBondContact O-CB 3.49Å; Q343-Q347 PolarHBondContact O-N 2.89Å; Q343-L371 HydrophobicContact CG-CB 3.72Å; Q343-L371 HydrophobicContact CG-CD1 3.69Å; Q343-L371 HydrophobicContact CG-CG 4.37Å
344	Q	97.5	Very high	96	Very high	116 Å²	116	64.8 Å²	64.8	54%	0.542	37%	0.367	S	S	.	.	H	α-helix	trans	-60.6	-46.8	178.6	-72.9	173.1	-3.3	0	0	111.7	K340 I341 A342 Q347 L348	K340-Q344 WeakPolarHBondContact O-CG 3.39Å; K340-Q344 PolarHBondContact O-N 3.02Å; I341-Q344 PolarHBondContact O-N 2.97Å; A342-Q344 VanDerWaalsContact C-N 3.33Å; A342-Q344 PolarHBondContact O-N 3.25Å; Q344-Q347 PolarHBondContact O-N 3.36Å; Q344-L348 WeakPolarHBondContact O-CB 3.37Å; Q344-L348 VanDerWaalsContact O-CG 3.28Å; Q344-L348 WeakPolarHBondContact O-CG 3.42Å; Q344-L348 PolarHBondContact O-N 3.33Å
345	F	98.2	Very high	95.7	Very high	31 Å²	31	63.3 Å²	63.3	14%	0.136	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-42.5	178.4	-73.9	-46.2	0	0	0	112.8	P313 Y319 K322 I341 A342 Q343 Q347 L348 V349	P313-F345 HydrophobicContact CG-CE1 4.25Å; Y319-F345 AromaticContact CD1-CD1 3.67Å; Y319-F345 HydrophobicContact CD1-CD1 3.67Å; Y319-F345 AromaticContact CD1-CE1 3.94Å; Y319-F345 HydrophobicContact CD1-CE1 3.94Å; Y319-F345 HydrophobicContact CE1-CD1 4.28Å; Y319-F345 HydrophobicContact CE1-CE1 4.21Å; K322-F345 HydrophobicContact CB-CD2 3.85Å; K322-F345 HydrophobicContact CB-CE2 3.7Å; K322-F345 HydrophobicContact CB-CG 4.46Å; K322-F345 HydrophobicContact CB-CZ 4.19Å; K322-F345 HydrophobicContact CD-CE2 4.36Å; K322-F345 HydrophobicContact CD-CZ 4.13Å; I341-F345 HydrophobicContact CG2-CD2 3.67Å; I341-F345 HydrophobicContact CG2-CE2 3.33Å; I341-F345 HydrophobicContact CG2-CZ 4.29Å; I341-F345 WeakPolarHBondContact O-CD2 3.35Å; I341-F345 PolarHBondContact O-N 3.5Å; A342-F345 PolarHBondContact O-N 3.32Å; Q343-F345 PolarHBondContact O-N 3.43Å; F345-Q347 VanDerWaalsContact C-N 3.34Å; F345-Q347 PolarHBondContact O-N 3Å; F345-L348 HydrophobicContact CD1-CD1 4.3Å; F345-L348 PolarHBondContact O-N 3.02Å; F345-V349 WeakPolarHBondContact O-CG2 3.19Å; F345-V349 PolarHBondContact O-N 3.37Å; F345-V349 VanDerWaalsContact O-N 3.13Å
346	F	98.4	Very high	95.3	Very high	8 Å²	8	64 Å²	64	4%	0.035	35%	0.348	C	S	.	.	H	α-helix	trans	-63.4	-40.7	175.7	-67.6	-35	0	0	0	112.6	G323 V324 A327 A342 Q343 G350 C364 C368 L371	G323-F346 VanDerWaalsContact C-CZ 3.46Å; V324-F346 HydrophobicContact CG2-CE1 4.06Å; V324-F346 HydrophobicContact CG2-CZ 4.15Å; A327-F346 HydrophobicContact CB-CE2 4.24Å; A327-F346 HydrophobicContact CB-CZ 4.42Å; A342-F346 HydrophobicContact CB-CE2 4.23Å; A342-F346 WeakPolarHBondContact O-CD2 3.17Å; A342-F346 WeakPolarHBondContact O-CG 3.34Å; A342-F346 PolarHBondContact O-N 2.88Å; Q343-F346 PolarHBondContact O-N 3.23Å; F346-G350 PolarHBondContact O-N 3.19Å; F346-C364 HydrophobicContact CB-CB 4.14Å; F346-C364 WeakPolarHBondContact CB-O 3.46Å; F346-C364 HydrophobicContact CD1-CB 4.17Å; F346-C364 WeakPolarHBondContact O-CB 3.32Å; F346-C368 HydrophobicContact CB-CB 3.9Å; F346-L371 HydrophobicContact CD2-CD1 4.09Å; F346-L371 HydrophobicContact CE2-CD1 3.98Å
347	Q	97.3	Very high	95	Very high	120 Å²	120	60.3 Å²	60.3	56%	0.561	34%	0.344	S	S	*	.	H	α-helix	trans	-66.1	-39.9	176.2	-172.7	177.1	14.5	0	0	112.2	Q343 Q344 F345 G351	Q343-Q347 WeakPolarHBondContact O-CB 3.49Å; Q343-Q347 PolarHBondContact O-N 2.89Å; Q344-Q347 PolarHBondContact O-N 3.36Å; F345-Q347 VanDerWaalsContact C-N 3.34Å; F345-Q347 PolarHBondContact O-N 3Å; Q347-G351 WeakPolarHBondContact O-CA 3.45Å; Q347-G351 PolarHBondContact O-N 3.15Å
348	L	96.6	Very high	94.7	Very high	105 Å²	105	57.2 Å²	57.2	55%	0.55	33%	0.329	S	S	.	.	H	α-helix	trans	-61	-44.4	177.4	-77.2	170.7	0	0	0	111.9	Y319 Q344 F345 S352	Y319-L348 HydrophobicContact CE1-CD1 4.42Å; Q344-L348 WeakPolarHBondContact O-CB 3.37Å; Q344-L348 VanDerWaalsContact O-CG 3.28Å; Q344-L348 WeakPolarHBondContact O-CG 3.42Å; Q344-L348 PolarHBondContact O-N 3.33Å; F345-L348 HydrophobicContact CD1-CD1 4.3Å; F345-L348 PolarHBondContact O-N 3.02Å; L348-S352 WeakPolarHBondContact O-CB 3.04Å; L348-S352 PolarHBondContact O-N 3.13Å
349	V	96.8	Very high	94.5	Very high	5 Å²	5	58.5 Å²	58.5	3%	0.03	34%	0.336	C	S	.	.	H	α-helix	trans	-70.8	-55.1	177.7	178.4	0	0	0	0	110.2	Y319 I320 F345 G351 S352 E355 C364	Y319-V349 VanDerWaalsContact CB-CG2 3.41Å; Y319-V349 HydrophobicContact CG-CG2 4.32Å; I320-V349 HydrophobicContact CD1-CG1 4.13Å; I320-V349 HydrophobicContact CG1-CB 4.45Å; I320-V349 HydrophobicContact CG1-CG1 3.91Å; I320-V349 HydrophobicContact CG1-CG2 4.06Å; F345-V349 WeakPolarHBondContact O-CG2 3.19Å; F345-V349 PolarHBondContact O-N 3.37Å; F345-V349 VanDerWaalsContact O-N 3.13Å; V349-G351 VanDerWaalsContact C-N 3.26Å; V349-G351 PolarHBondContact O-N 3.34Å; V349-S352 WeakPolarHBondContact O-CB 3.49Å; V349-S352 PolarHBondContact O-N 3.48Å; V349-S352 VanDerWaalsContact O-N 3.08Å; V349-E355 HydrophobicContact CG1-CB 4.22Å; V349-E355 HydrophobicContact CG1-CG 4.26Å; V349-E355 WeakPolarHBondContact O-CB 3.47Å; V349-C364 HydrophobicContact CB-CB 4.3Å; V349-C364 HydrophobicContact CG1-CB 4.39Å
350	G	95.7	Very high	94.3	Very high	6 Å²	6	59.4 Å²	59.4	6%	0.062	34%	0.344	C	S	.	.	H	α-helix	trans	-66.6	-24.8	-174.4	0	0	0	0	0	114.8	F346 G361	F346-G350 PolarHBondContact O-N 3.19Å; G350-G361 VanDerWaalsContact CA-O 3.31Å; G350-G361 WeakPolarHBondContact CA-O 3.3Å
351	G	94	Very high	94.2	Very high	58 Å²	58	53.7 Å²	53.7	60%	0.598	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-4.9	174.4	0	0	0	0	0	114.7	Q347 V349	Q347-G351 WeakPolarHBondContact O-CA 3.45Å; Q347-G351 PolarHBondContact O-N 3.15Å; V349-G351 VanDerWaalsContact C-N 3.26Å; V349-G351 PolarHBondContact O-N 3.34Å
352	S	93.9	Very high	94.2	Very high	41 Å²	41	54.2 Å²	54.2	29%	0.287	32%	0.317	S	S	.	.	S	Bend	trans	-69	136.6	177.1	178.5	0	0	0	0	110.7	L348 V349 S354 E355 C356	L348-S352 WeakPolarHBondContact O-CB 3.04Å; L348-S352 PolarHBondContact O-N 3.13Å; V349-S352 WeakPolarHBondContact O-CB 3.49Å; V349-S352 PolarHBondContact O-N 3.48Å; V349-S352 VanDerWaalsContact O-N 3.08Å; S352-S354 PolarHBondContact O-N 2.99Å; S352-S354 VanDerWaalsContact O-N 3.13Å; S352-S354 PolarHBondContact OG-N 2.88Å; S352-S354 PolarHBondContact OG-OG 2.96Å; S352-E355 PolarHBondContact O-N 3.2Å; S352-C356 VanDerWaalsContact O-CB 3.32Å; S352-C356 WeakPolarHBondContact O-CB 3.36Å; S352-C356 PolarHBondContact O-N 2.98Å
353	A	89.2	Confident	94.2	Very high	97 Å²	97	57.7 Å²	57.7	80%	0.802	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.4	175.5	0	0	0	0	0	113.3
354	S	85.9	Confident	94.2	Very high	80 Å²	80	55.7 Å²	55.7	56%	0.559	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-22.4	177.5	63.8	0	0	0	0	113.7	S352	S352-S354 PolarHBondContact O-N 2.99Å; S352-S354 VanDerWaalsContact O-N 3.13Å; S352-S354 PolarHBondContact OG-N 2.88Å; S352-S354 PolarHBondContact OG-OG 2.96Å
355	E	89.4	Confident	94.2	Very high	31 Å²	31	51 Å²	51	15%	0.145	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	-15	-170.2	-66.3	-58.9	147.4	0	0	113.7	P316 V349 S352 D357 T358 G361	P316-E355 HydrophobicContact CB-CG 4.08Å; P316-E355 HydrophobicContact CG-CG 4.05Å; P316-E355 WeakPolarHBondContact CG-OE1 3.37Å; V349-E355 HydrophobicContact CG1-CB 4.22Å; V349-E355 HydrophobicContact CG1-CG 4.26Å; V349-E355 WeakPolarHBondContact O-CB 3.47Å; S352-E355 PolarHBondContact O-N 3.2Å; E355-D357 PolarHBondContact O-N 3.19Å; E355-D357 VanDerWaalsContact O-N 3.1Å; E355-T358 PolarHBondContact O-N 3.39Å; E355-T358 PolarHBondContact O-OG1 2.75Å; E355-T358 PolarHBondContact OE2-OG1 3.2Å; E355-G361 WeakPolarHBondContact O-CA 3.17Å
356	C	89.2	Confident	94.2	Very high	45 Å²	45	49.7 Å²	49.7	30%	0.304	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.6	-174.5	59.8	0	0	0	0	113.7	S352	S352-C356 VanDerWaalsContact O-CB 3.32Å; S352-C356 WeakPolarHBondContact O-CB 3.36Å; S352-C356 PolarHBondContact O-N 2.98Å
357	D	88.6	Confident	94.2	Very high	129 Å²	129	51.4 Å²	51.4	69%	0.69	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	9.1	176.7	-72.4	-47.2	0	0	0	114.2	E355 R362	E355-D357 PolarHBondContact O-N 3.19Å; E355-D357 VanDerWaalsContact O-N 3.1Å; D357-R362 IonicContact OD1-NH2 3.9Å; D357-R362 PolarHBondContact OD1-NH2 3.35Å
358	T	91.9	Very high	94.3	Very high	43 Å²	43	46 Å²	46	26%	0.264	29%	0.286	S	S	.	.	S	Bend	trans	-97	157.3	175.9	77.5	0	0	0	0	111.2	E355 G361 R362	E355-T358 PolarHBondContact O-N 3.39Å; E355-T358 PolarHBondContact O-OG1 2.75Å; E355-T358 PolarHBondContact OE2-OG1 3.2Å; T358-G361 PolarHBondContact O-N 3.08Å; T358-G361 PolarHBondContact OG1-N 3.25Å; T358-R362 VanDerWaalsContact O-CG 3.3Å; T358-R362 WeakPolarHBondContact O-CG 3.38Å; T358-R362 PolarHBondContact O-N 2.73Å; T358-R362 VanDerWaalsContact O-N 3.09Å
359	I	92.5	Very high	94.3	Very high	57 Å²	57	42.6 Å²	42.6	29%	0.292	27%	0.267	S	S	.	.	H	α-helix	trans	-58.4	-49	173.7	-68.5	172	0	0	0	110.9	G361 R362 Q363 F385 Y388 F389	I359-G361 PolarHBondContact O-N 3.25Å; I359-R362 PolarHBondContact O-N 3.36Å; I359-Q363 HydrophobicContact CG2-CG 4.28Å; I359-Q363 WeakPolarHBondContact O-CG 3.46Å; I359-Q363 PolarHBondContact O-N 3.11Å; I359-F385 HydrophobicContact CG1-CB 4.39Å; I359-Y388 HydrophobicContact CD1-CD2 4.03Å; I359-Y388 HydrophobicContact CD1-CE2 4.4Å; I359-Y388 HydrophobicContact CD1-CG 4.11Å; I359-F389 HydrophobicContact CD1-CE2 4.36Å; I359-F389 HydrophobicContact CG2-CE2 3.67Å; I359-F389 HydrophobicContact CG2-CZ 3.92Å
360	P	94.6	Very high	94.4	Very high	51 Å²	51	44.5 Å²	44.5	33%	0.331	28%	0.275	S	S	.	.	H	α-helix	trans	-56.8	-45	176.6	-27.4	36.2	0	0	0	113.8	I320 R362 Q363 C364	I320-P360 HydrophobicContact CD1-CB 3.87Å; P360-R362 VanDerWaalsContact C-N 3.32Å; P360-R362 PolarHBondContact O-N 3.37Å; P360-Q363 WeakPolarHBondContact O-CB 3.5Å; P360-Q363 PolarHBondContact O-N 3.08Å; P360-C364 PolarHBondContact O-N 3.18Å; P360-C364 PolarHBondContact O-SG 3.11Å
361	G	96	Very high	94.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.3	-39.8	178.2	0	0	0	0	0	112.8	G350 E355 T358 I359 C364 M365	G350-G361 VanDerWaalsContact CA-O 3.31Å; G350-G361 WeakPolarHBondContact CA-O 3.3Å; E355-G361 WeakPolarHBondContact O-CA 3.17Å; T358-G361 PolarHBondContact O-N 3.08Å; T358-G361 PolarHBondContact OG1-N 3.25Å; I359-G361 PolarHBondContact O-N 3.25Å; G361-C364 WeakPolarHBondContact O-CB 3.49Å; G361-C364 PolarHBondContact O-N 3.44Å; G361-M365 PolarHBondContact O-N 2.9Å
362	R	97.3	Very high	94.5	Very high	70 Å²	70	47.5 Å²	47.5	26%	0.264	28%	0.275	S	S	.	.	H	α-helix	trans	-67.9	-37.5	175.2	-68	174.1	176	-147.9	5.5	112.7	D357 T358 I359 P360 C364 M365 A366 Y381 S384 F385	D357-R362 IonicContact OD1-NH2 3.9Å; D357-R362 PolarHBondContact OD1-NH2 3.35Å; T358-R362 VanDerWaalsContact O-CG 3.3Å; T358-R362 WeakPolarHBondContact O-CG 3.38Å; T358-R362 PolarHBondContact O-N 2.73Å; T358-R362 VanDerWaalsContact O-N 3.09Å; I359-R362 PolarHBondContact O-N 3.36Å; P360-R362 VanDerWaalsContact C-N 3.32Å; P360-R362 PolarHBondContact O-N 3.37Å; R362-C364 VanDerWaalsContact C-N 3.33Å; R362-M365 PolarHBondContact O-N 2.92Å; R362-A366 WeakPolarHBondContact O-CB 3.41Å; R362-A366 PolarHBondContact O-N 3.1Å; R362-Y381 HydrophobicContact CB-CD1 4.13Å; R362-Y381 HydrophobicContact CG-CD1 4.19Å; R362-S384 WeakPolarHBondContact CD-OG 3.33Å; R362-S384 PolarHBondContact NH1-OG 3.08Å; R362-F385 HydrophobicContact CB-CD1 3.85Å; R362-F385 HydrophobicContact CB-CE1 3.95Å
363	Q	97.5	Very high	94.7	Very high	72 Å²	72	53.3 Å²	53.3	34%	0.336	30%	0.295	S	S	.	.	H	α-helix	trans	-63.6	-39	172.2	-74.4	176.3	-29.3	0	0	111.7	I359 P360 A366 S367 F385	I359-Q363 HydrophobicContact CG2-CG 4.28Å; I359-Q363 WeakPolarHBondContact O-CG 3.46Å; I359-Q363 PolarHBondContact O-N 3.11Å; P360-Q363 WeakPolarHBondContact O-CB 3.5Å; P360-Q363 PolarHBondContact O-N 3.08Å; Q363-A366 PolarHBondContact O-N 3.43Å; Q363-S367 WeakPolarHBondContact O-CB 3.4Å; Q363-S367 PolarHBondContact O-N 3.25Å; Q363-S367 PolarHBondContact O-OG 3.11Å; Q363-F385 HydrophobicContact CG-CE1 4.09Å; Q363-F385 HydrophobicContact CG-CE2 3.93Å; Q363-F385 HydrophobicContact CG-CZ 3.57Å
364	C	98.3	Very high	95.1	Very high	4 Å²	4	52.9 Å²	52.9	3%	0.027	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-48.3	173.2	-74.3	0	0	0	0	111.8	F346 V349 P360 G361 R362 A366 S367 C368	F346-C364 HydrophobicContact CB-CB 4.14Å; F346-C364 WeakPolarHBondContact CB-O 3.46Å; F346-C364 HydrophobicContact CD1-CB 4.17Å; F346-C364 WeakPolarHBondContact O-CB 3.32Å; V349-C364 HydrophobicContact CB-CB 4.3Å; V349-C364 HydrophobicContact CG1-CB 4.39Å; P360-C364 PolarHBondContact O-N 3.18Å; P360-C364 PolarHBondContact O-SG 3.11Å; G361-C364 WeakPolarHBondContact O-CB 3.49Å; G361-C364 PolarHBondContact O-N 3.44Å; R362-C364 VanDerWaalsContact C-N 3.33Å; C364-A366 PolarHBondContact O-N 3.31Å; C364-S367 WeakPolarHBondContact O-CB 3.43Å; C364-S367 PolarHBondContact O-N 3.01Å; C364-S367 VanDerWaalsContact O-N 3.14Å; C364-C368 WeakPolarHBondContact O-CB 3.18Å; C364-C368 PolarHBondContact O-N 2.86Å
365	M	98	Very high	95.7	Very high	18 Å²	18	51.4 Å²	51.4	9%	0.089	26%	0.26	C	S	.	.	H	α-helix	trans	-60.9	-44.2	176.8	-69.6	-50.4	-60.9	0	0	112.1	G361 R362 S367 C368 F369 Y381	G361-M365 PolarHBondContact O-N 2.9Å; R362-M365 PolarHBondContact O-N 2.92Å; M365-S367 VanDerWaalsContact C-N 3.29Å; M365-S367 PolarHBondContact O-N 2.69Å; M365-C368 WeakPolarHBondContact O-CB 3.12Å; M365-C368 PolarHBondContact O-N 3.33Å; M365-F369 HydrophobicContact CB-CE2 4.49Å; M365-F369 HydrophobicContact CE-CD2 4.3Å; M365-F369 HydrophobicContact CE-CE2 3.46Å; M365-F369 VanDerWaalsContact CE-CE2 3.46Å; M365-F369 HydrophobicContact CE-CZ 3.95Å; M365-F369 WeakPolarHBondContact O-CD2 3.43Å; M365-F369 PolarHBondContact O-N 2.85Å; M365-Y381 HydrophobicContact CB-CD1 3.54Å; M365-Y381 HydrophobicContact CB-CD2 3.92Å; M365-Y381 HydrophobicContact CB-CE1 3.31Å; M365-Y381 HydrophobicContact CB-CE2 3.76Å; M365-Y381 HydrophobicContact CB-CG 3.83Å; M365-Y381 VanDerWaalsContact CB-CZ 3.41Å; M365-Y381 HydrophobicContact CG-CD1 4.26Å; M365-Y381 HydrophobicContact CG-CE1 3.61Å
366	A	98.2	Very high	96.1	Very high	4 Å²	4	55.3 Å²	55.3	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-56.3	-44	173.8	0	0	0	0	0	111.8	R362 Q363 C364 F369 F370 L382	R362-A366 WeakPolarHBondContact O-CB 3.41Å; R362-A366 PolarHBondContact O-N 3.1Å; Q363-A366 PolarHBondContact O-N 3.43Å; C364-A366 PolarHBondContact O-N 3.31Å; A366-F369 PolarHBondContact O-N 2.88Å; A366-F370 WeakPolarHBondContact O-CB 3.46Å; A366-F370 PolarHBondContact O-N 2.88Å; A366-L382 HydrophobicContact CB-CD2 3.81Å; A366-L382 HydrophobicContact CB-CG 4.27Å
367	S	98.2	Very high	96.5	Very high	44 Å²	44	55.9 Å²	55.9	31%	0.308	28%	0.282	S	S	.	.	H	α-helix	trans	-65.1	-41	177.9	-57.1	0	0	0	0	112.1	Q363 C364 M365 F370 L371	Q363-S367 WeakPolarHBondContact O-CB 3.4Å; Q363-S367 PolarHBondContact O-N 3.25Å; Q363-S367 PolarHBondContact O-OG 3.11Å; C364-S367 WeakPolarHBondContact O-CB 3.43Å; C364-S367 PolarHBondContact O-N 3.01Å; C364-S367 VanDerWaalsContact O-N 3.14Å; M365-S367 VanDerWaalsContact C-N 3.29Å; M365-S367 PolarHBondContact O-N 2.69Å; S367-F370 WeakPolarHBondContact O-CB 3.33Å; S367-F370 PolarHBondContact O-N 2.92Å; S367-L371 WeakPolarHBondContact O-CG 3.29Å; S367-L371 PolarHBondContact O-N 2.92Å; S367-L371 VanDerWaalsContact O-N 3.1Å
368	C	98	Very high	97	Very high	5 Å²	5	49.7 Å²	49.7	3%	0.034	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-50.7	175.6	-171.5	0	0	0	0	111.3	F346 C364 M365 F370 L371 L372	F346-C368 HydrophobicContact CB-CB 3.9Å; C364-C368 WeakPolarHBondContact O-CB 3.18Å; C364-C368 PolarHBondContact O-N 2.86Å; M365-C368 WeakPolarHBondContact O-CB 3.12Å; M365-C368 PolarHBondContact O-N 3.33Å; C368-F370 VanDerWaalsContact C-N 3.3Å; C368-F370 PolarHBondContact O-N 3.23Å; C368-L371 PolarHBondContact O-N 3.37Å; C368-L371 VanDerWaalsContact O-N 3.15Å; C368-L372 WeakPolarHBondContact O-CG 3.49Å; C368-L372 PolarHBondContact O-N 3.3Å; C368-L372 VanDerWaalsContact O-N 3.09Å
369	F	98.2	Very high	97.3	Very high	34 Å²	34	48.2 Å²	48.2	15%	0.149	24%	0.24	C	C	.	.	H	α-helix	trans	-66.4	-30.8	178.8	-72.8	-61.7	0	0	0	113.1	M365 A366 L372 K373 Q374 D377 V378 Y381	M365-F369 HydrophobicContact CB-CE2 4.49Å; M365-F369 HydrophobicContact CE-CD2 4.3Å; M365-F369 HydrophobicContact CE-CE2 3.46Å; M365-F369 VanDerWaalsContact CE-CE2 3.46Å; M365-F369 HydrophobicContact CE-CZ 3.95Å; M365-F369 WeakPolarHBondContact O-CD2 3.43Å; M365-F369 PolarHBondContact O-N 2.85Å; A366-F369 PolarHBondContact O-N 2.88Å; F369-L372 HydrophobicContact CD1-CD1 4.17Å; F369-L372 HydrophobicContact CE1-CD1 4.49Å; F369-L372 CarbonylContact O-C 3.52Å; F369-L372 PolarHBondContact O-N 3.42Å; F369-K373 PolarHBondContact O-N 3.04Å; F369-Q374 HydrophobicContact CB-CB 4.45Å; F369-Q374 HydrophobicContact CD1-CB 4.04Å; F369-Q374 PolarHBondContact O-N 3.41Å; F369-D377 HydrophobicContact CB-CB 4.12Å; F369-D377 HydrophobicContact CD1-CB 3.65Å; F369-D377 HydrophobicContact CD2-CB 3.88Å; F369-D377 HydrophobicContact CE1-CB 3.97Å; F369-D377 HydrophobicContact CE2-CB 4.2Å; F369-D377 HydrophobicContact CG-CB 3.61Å; F369-D377 HydrophobicContact CZ-CB 4.23Å; F369-V378 HydrophobicContact CB-CG2 3.64Å; F369-Y381 AromaticContact CD2-CD2 3.91Å; F369-Y381 HydrophobicContact CD2-CD2 3.91Å; F369-Y381 AromaticContact CD2-CE2 3.67Å; F369-Y381 HydrophobicContact CD2-CE2 3.67Å; F369-Y381 HydrophobicContact CE2-CD2 4.09Å; F369-Y381 AromaticContact CE2-CE2 3.36Å; F369-Y381 HydrophobicContact CE2-CE2 3.36Å; F369-Y381 HydrophobicContact CZ-CE2 4.49Å
370	F	97.6	Very high	97.6	Very high	46 Å²	46	50.6 Å²	50.6	20%	0.202	25%	0.252	C	S	.	.	H	α-helix	trans	-59.5	-47.7	170.6	-111.7	-66.1	0	0	0	111.7	A366 S367 C368 L372 K373 F375 V378 L382 N398 A402	A366-F370 WeakPolarHBondContact O-CB 3.46Å; A366-F370 PolarHBondContact O-N 2.88Å; S367-F370 WeakPolarHBondContact O-CB 3.33Å; S367-F370 PolarHBondContact O-N 2.92Å; C368-F370 VanDerWaalsContact C-N 3.3Å; C368-F370 PolarHBondContact O-N 3.23Å; F370-L372 PolarHBondContact O-N 3.13Å; F370-K373 PolarHBondContact O-N 3.09Å; F370-F375 HydrophobicContact CD1-CD1 4.27Å; F370-F375 AromaticContact CD1-CE1 3.8Å; F370-F375 HydrophobicContact CD1-CE1 3.8Å; F370-F375 HydrophobicContact CE1-CD1 4.06Å; F370-F375 AromaticContact CE1-CE1 3.7Å; F370-F375 HydrophobicContact CE1-CE1 3.7Å; F370-V378 HydrophobicContact CB-CG2 4.21Å; F370-V378 HydrophobicContact CD2-CB 4.34Å; F370-V378 HydrophobicContact CD2-CG1 3.48Å; F370-V378 VanDerWaalsContact CD2-CG1 3.48Å; F370-V378 HydrophobicContact CD2-CG2 3.8Å; F370-V378 HydrophobicContact CE2-CB 4.47Å; F370-V378 HydrophobicContact CE2-CG1 3.3Å; F370-V378 HydrophobicContact CE2-CG2 4.35Å; F370-V378 HydrophobicContact CG-CG1 4.35Å; F370-V378 HydrophobicContact CG-CG2 3.94Å; F370-V378 HydrophobicContact CZ-CG1 4.04Å; F370-V378 VanDerWaalsContact N-CG2 3.33Å; F370-L382 HydrophobicContact CE2-CD1 4.33Å; F370-N398 HydrophobicContact CE2-CB 3.97Å; F370-N398 HydrophobicContact CZ-CB 4.09Å; F370-N398 WeakPolarHBondContact CZ-O 3.46Å; F370-A402 HydrophobicContact CZ-CB 4.13Å
371	L	96.4	Very high	97.7	Very high	51 Å²	51	51.2 Å²	51.2	27%	0.267	25%	0.248	S	C	.	.	H	α-helix	trans	-64.8	-28.2	177.3	-64.7	178.6	0	0	0	112.3	M339 A342 Q343 F346 S367 C368 K373	M339-L371 HydrophobicContact SD-CD2 4.03Å; A342-L371 HydrophobicContact CB-CD1 3.96Å; Q343-L371 HydrophobicContact CG-CB 3.72Å; Q343-L371 HydrophobicContact CG-CD1 3.69Å; Q343-L371 HydrophobicContact CG-CG 4.37Å; F346-L371 HydrophobicContact CD2-CD1 4.09Å; F346-L371 HydrophobicContact CE2-CD1 3.98Å; S367-L371 WeakPolarHBondContact O-CG 3.29Å; S367-L371 PolarHBondContact O-N 2.92Å; S367-L371 VanDerWaalsContact O-N 3.1Å; C368-L371 PolarHBondContact O-N 3.37Å; C368-L371 VanDerWaalsContact O-N 3.15Å; L371-K373 VanDerWaalsContact C-N 3.32Å
372	L	96.4	Very high	97.8	Very high	76 Å²	76	51.8 Å²	51.8	40%	0.398	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-5.8	173.2	-64	173.4	0	0	0	113.6	C368 F369 F370 Q374	C368-L372 WeakPolarHBondContact O-CG 3.49Å; C368-L372 PolarHBondContact O-N 3.3Å; C368-L372 VanDerWaalsContact O-N 3.09Å; F369-L372 HydrophobicContact CD1-CD1 4.17Å; F369-L372 HydrophobicContact CE1-CD1 4.49Å; F369-L372 CarbonylContact O-C 3.52Å; F369-L372 PolarHBondContact O-N 3.42Å; F370-L372 PolarHBondContact O-N 3.13Å; L372-Q374 HydrophobicContact CB-CG 4.14Å; L372-Q374 PolarHBondContact O-N 3.41Å
373	K	96.9	Very high	97.8	Very high	163 Å²	163	51.9 Å²	51.9	71%	0.709	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	27.5	-174.4	-53.1	-177.9	179.1	-176.1	0	113.6	F369 F370 L371 F375	F369-K373 PolarHBondContact O-N 3.04Å; F370-K373 PolarHBondContact O-N 3.09Å; L371-K373 VanDerWaalsContact C-N 3.32Å; K373-F375 HydrophobicContact CB-CE2 3.97Å; K373-F375 HydrophobicContact CB-CZ 4.17Å; K373-F375 WeakPolarHBondContact O-CD2 3.48Å; K373-F375 WeakPolarHBondContact O-CE2 3.28Å; K373-F375 PolarHBondContact O-N 3.34Å
374	Q	98	Very high	97.8	Very high	88 Å²	88	50.7 Å²	50.7	41%	0.411	26%	0.256	S	S	.	.			trans	-94.2	75	177.4	-71.6	-179.2	-34.3	0	0	109.5	F369 L372 D376 D377 V378	F369-Q374 HydrophobicContact CB-CB 4.45Å; F369-Q374 HydrophobicContact CD1-CB 4.04Å; F369-Q374 PolarHBondContact O-N 3.41Å; L372-Q374 HydrophobicContact CB-CG 4.14Å; L372-Q374 PolarHBondContact O-N 3.41Å; Q374-D376 VanDerWaalsContact C-N 3.32Å; Q374-D376 PolarHBondContact O-N 3.36Å; Q374-D377 HydrophobicContact CB-CB 4.37Å; Q374-D377 PolarHBondContact O-N 3.29Å; Q374-V378 WeakPolarHBondContact O-CG2 3.2Å; Q374-V378 PolarHBondContact O-N 3.43Å; Q374-V378 VanDerWaalsContact O-N 3.08Å
375	F	98.3	Very high	97.7	Very high	49 Å²	49	50.7 Å²	50.7	22%	0.215	26%	0.256	C	S	.	.	H	α-helix	trans	-69.7	-25.6	-168.9	-59	-73.1	0	0	0	114.2	F370 K373 D377 V378 L379 A402 A405 T406	F370-F375 HydrophobicContact CD1-CD1 4.27Å; F370-F375 AromaticContact CD1-CE1 3.8Å; F370-F375 HydrophobicContact CD1-CE1 3.8Å; F370-F375 HydrophobicContact CE1-CD1 4.06Å; F370-F375 AromaticContact CE1-CE1 3.7Å; F370-F375 HydrophobicContact CE1-CE1 3.7Å; K373-F375 HydrophobicContact CB-CE2 3.97Å; K373-F375 HydrophobicContact CB-CZ 4.17Å; K373-F375 WeakPolarHBondContact O-CD2 3.48Å; K373-F375 WeakPolarHBondContact O-CE2 3.28Å; K373-F375 PolarHBondContact O-N 3.34Å; F375-D377 VanDerWaalsContact C-N 3.35Å; F375-V378 WeakPolarHBondContact O-CB 3.44Å; F375-V378 PolarHBondContact O-N 2.97Å; F375-L379 WeakPolarHBondContact O-CG 3.32Å; F375-L379 PolarHBondContact O-N 3.17Å; F375-L379 VanDerWaalsContact O-N 3.12Å; F375-A402 HydrophobicContact CD1-CB 4.42Å; F375-A405 HydrophobicContact CB-CB 4.02Å; F375-A405 HydrophobicContact CD1-CB 4Å; F375-A405 HydrophobicContact CD2-CB 3.47Å; F375-A405 VanDerWaalsContact CD2-CB 3.47Å; F375-A405 HydrophobicContact CE1-CB 4.33Å; F375-A405 HydrophobicContact CE2-CB 3.84Å; F375-A405 HydrophobicContact CG-CB 3.55Å; F375-A405 HydrophobicContact CZ-CB 4.26Å; F375-T406 HydrophobicContact CB-CG2 3.72Å
376	D	98.2	Very high	97.6	Very high	113 Å²	113	53.3 Å²	53.3	60%	0.604	27%	0.267	S	S	*	.	H	α-helix	trans	-61.7	-45.7	172.2	-64.2	-69.4	0	0	0	110.8	Q374 L379 I380 T406	Q374-D376 VanDerWaalsContact C-N 3.32Å; Q374-D376 PolarHBondContact O-N 3.36Å; D376-L379 PolarHBondContact O-N 2.95Å; D376-I380 PolarHBondContact O-N 3.03Å; D376-T406 VanDerWaalsContact OD1-CG2 3.3Å; D376-T406 WeakPolarHBondContact OD1-CG2 3.48Å
377	D	98.1	Very high	97.4	Very high	56 Å²	56	57 Å²	57	30%	0.299	29%	0.293	S	S	.	.	H	α-helix	trans	-67.9	-39.4	177	-62.1	-61.4	0	0	0	111.9	F369 Q374 F375 L379 I380 Y381	F369-D377 HydrophobicContact CB-CB 4.12Å; F369-D377 HydrophobicContact CD1-CB 3.65Å; F369-D377 HydrophobicContact CD2-CB 3.88Å; F369-D377 HydrophobicContact CE1-CB 3.97Å; F369-D377 HydrophobicContact CE2-CB 4.2Å; F369-D377 HydrophobicContact CG-CB 3.61Å; F369-D377 HydrophobicContact CZ-CB 4.23Å; Q374-D377 HydrophobicContact CB-CB 4.37Å; Q374-D377 PolarHBondContact O-N 3.29Å; F375-D377 VanDerWaalsContact C-N 3.35Å; D377-L379 PolarHBondContact O-N 3.46Å; D377-I380 WeakPolarHBondContact O-CB 3.47Å; D377-I380 PolarHBondContact O-N 3.36Å; D377-I380 VanDerWaalsContact O-N 3.1Å; D377-Y381 WeakPolarHBondContact O-CD2 3.24Å; D377-Y381 PolarHBondContact O-N 2.9Å
378	V	98.4	Very high	97.2	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-51.1	-46.8	171.8	171.2	0	0	0	0	110.8	F369 F370 Q374 F375 I380 Y381 L382 A402	F369-V378 HydrophobicContact CB-CG2 3.64Å; F370-V378 HydrophobicContact CB-CG2 4.21Å; F370-V378 HydrophobicContact CD2-CB 4.34Å; F370-V378 HydrophobicContact CD2-CG1 3.48Å; F370-V378 VanDerWaalsContact CD2-CG1 3.48Å; F370-V378 HydrophobicContact CD2-CG2 3.8Å; F370-V378 HydrophobicContact CE2-CB 4.47Å; F370-V378 HydrophobicContact CE2-CG1 3.3Å; F370-V378 HydrophobicContact CE2-CG2 4.35Å; F370-V378 HydrophobicContact CG-CG1 4.35Å; F370-V378 HydrophobicContact CG-CG2 3.94Å; F370-V378 HydrophobicContact CZ-CG1 4.04Å; F370-V378 VanDerWaalsContact N-CG2 3.33Å; Q374-V378 WeakPolarHBondContact O-CG2 3.2Å; Q374-V378 PolarHBondContact O-N 3.43Å; Q374-V378 VanDerWaalsContact O-N 3.08Å; F375-V378 WeakPolarHBondContact O-CB 3.44Å; F375-V378 PolarHBondContact O-N 2.97Å; V378-I380 VanDerWaalsContact C-N 3.32Å; V378-I380 PolarHBondContact O-N 3.43Å; V378-Y381 PolarHBondContact O-N 3.26Å; V378-L382 HydrophobicContact CG1-CD1 3.63Å; V378-L382 HydrophobicContact CG1-CG 3.91Å; V378-L382 WeakPolarHBondContact O-CG 3.49Å; V378-L382 PolarHBondContact O-N 3.05Å; V378-A402 HydrophobicContact CB-CB 4.4Å; V378-A402 HydrophobicContact CG1-CB 3.78Å
379	L	98.5	Very high	97	Very high	12 Å²	12	65.1 Å²	65.1	6%	0.063	32%	0.318	C	S	.	.	H	α-helix	trans	-66.5	-31.7	-177.9	-71.1	175.6	0	0	0	112.8	F375 D376 D377 Y381 N383 Y399 A402 K403 T406	F375-L379 WeakPolarHBondContact O-CG 3.32Å; F375-L379 PolarHBondContact O-N 3.17Å; F375-L379 VanDerWaalsContact O-N 3.12Å; D376-L379 PolarHBondContact O-N 2.95Å; D377-L379 PolarHBondContact O-N 3.46Å; L379-Y381 VanDerWaalsContact C-N 3.3Å; L379-Y381 PolarHBondContact O-N 3.18Å; L379-N383 WeakPolarHBondContact O-CB 3.43Å; L379-N383 PolarHBondContact O-N 3.37Å; L379-N383 PolarHBondContact O-ND2 3.07Å; L379-Y399 HydrophobicContact CD2-CD2 3.95Å; L379-Y399 HydrophobicContact CD2-CE2 3.8Å; L379-A402 HydrophobicContact CD2-CB 3.67Å; L379-A402 HydrophobicContact CG-CB 3.96Å; L379-K403 HydrophobicContact CD1-CD 4.03Å; L379-K403 HydrophobicContact CD2-CD 4.09Å; L379-K403 HydrophobicContact CD2-CG 3.95Å; L379-T406 HydrophobicContact CD1-CG2 3.89Å; L379-T406 WeakPolarHBondContact CD1-OG1 3.37Å
380	I	97.7	Very high	96.7	Very high	107 Å²	107	69.7 Å²	69.7	55%	0.549	34%	0.336	S	S	.	.	H	α-helix	trans	-56	-49	173.8	-63.2	174	0	0	0	109.7	D376 D377 V378	D376-I380 PolarHBondContact O-N 3.03Å; D377-I380 WeakPolarHBondContact O-CB 3.47Å; D377-I380 PolarHBondContact O-N 3.36Å; D377-I380 VanDerWaalsContact O-N 3.1Å; V378-I380 VanDerWaalsContact C-N 3.32Å; V378-I380 PolarHBondContact O-N 3.43Å
381	Y	97.9	Very high	96.5	Very high	64 Å²	64	73.1 Å²	73.1	25%	0.251	36%	0.356	S	S	.	.	H	α-helix	trans	-72.2	-49	-179.4	-70	-82.5	0	0	0	112.5	R362 M365 F369 D377 V378 L379 N383 S384 F385	R362-Y381 HydrophobicContact CB-CD1 4.13Å; R362-Y381 HydrophobicContact CG-CD1 4.19Å; M365-Y381 HydrophobicContact CB-CD1 3.54Å; M365-Y381 HydrophobicContact CB-CD2 3.92Å; M365-Y381 HydrophobicContact CB-CE1 3.31Å; M365-Y381 HydrophobicContact CB-CE2 3.76Å; M365-Y381 HydrophobicContact CB-CG 3.83Å; M365-Y381 VanDerWaalsContact CB-CZ 3.41Å; M365-Y381 HydrophobicContact CG-CD1 4.26Å; M365-Y381 HydrophobicContact CG-CE1 3.61Å; F369-Y381 AromaticContact CD2-CD2 3.91Å; F369-Y381 HydrophobicContact CD2-CD2 3.91Å; F369-Y381 AromaticContact CD2-CE2 3.67Å; F369-Y381 HydrophobicContact CD2-CE2 3.67Å; F369-Y381 HydrophobicContact CE2-CD2 4.09Å; F369-Y381 AromaticContact CE2-CE2 3.36Å; F369-Y381 HydrophobicContact CE2-CE2 3.36Å; F369-Y381 HydrophobicContact CZ-CE2 4.49Å; D377-Y381 WeakPolarHBondContact O-CD2 3.24Å; D377-Y381 PolarHBondContact O-N 2.9Å; V378-Y381 PolarHBondContact O-N 3.26Å; L379-Y381 VanDerWaalsContact C-N 3.3Å; L379-Y381 PolarHBondContact O-N 3.18Å; Y381-N383 VanDerWaalsContact C-N 3.34Å; Y381-N383 PolarHBondContact O-N 3.44Å; Y381-S384 WeakPolarHBondContact O-CB 3.49Å; Y381-S384 PolarHBondContact O-N 3.17Å; Y381-S384 PolarHBondContact O-OG 3.38Å; Y381-F385 WeakPolarHBondContact O-CD1 3.49Å; Y381-F385 WeakPolarHBondContact O-CE1 3.45Å
382	L	98.1	Very high	96.5	Very high	11 Å²	11	73.8 Å²	73.8	6%	0.058	36%	0.36	C	S	.	.	H	α-helix	trans	-60.8	-40.9	-178.1	-66.4	-173.5	0	0	0	112.6	A366 F370 V378 S384 F385 K386 F395 Y399	A366-L382 HydrophobicContact CB-CD2 3.81Å; A366-L382 HydrophobicContact CB-CG 4.27Å; F370-L382 HydrophobicContact CE2-CD1 4.33Å; V378-L382 HydrophobicContact CG1-CD1 3.63Å; V378-L382 HydrophobicContact CG1-CG 3.91Å; V378-L382 WeakPolarHBondContact O-CG 3.49Å; V378-L382 PolarHBondContact O-N 3.05Å; L382-S384 PolarHBondContact O-N 3.21Å; L382-F385 HydrophobicContact CD2-CE1 4.27Å; L382-F385 HydrophobicContact CD2-CE2 4.15Å; L382-F385 HydrophobicContact CD2-CZ 3.52Å; L382-F385 PolarHBondContact O-N 2.73Å; L382-K386 PolarHBondContact O-N 2.91Å; L382-K386 VanDerWaalsContact O-N 3.08Å; L382-F395 HydrophobicContact CB-CE2 4.14Å; L382-F395 HydrophobicContact CB-CZ 4.4Å; L382-F395 HydrophobicContact CD2-CD2 4.46Å; L382-F395 HydrophobicContact CD2-CE2 4.05Å; L382-Y399 HydrophobicContact CB-CD2 3.88Å; L382-Y399 HydrophobicContact CB-CE2 4.38Å; L382-Y399 HydrophobicContact CD1-CD2 3.97Å
383	N	98	Very high	96.6	Very high	72 Å²	72	71.7 Å²	71.7	39%	0.385	35%	0.349	S	S	.	.	H	α-helix	trans	-61.7	-31.2	177.4	-76.4	-43.4	0	0	0	112	L379 Y381 F385 Y399	L379-N383 WeakPolarHBondContact O-CB 3.43Å; L379-N383 PolarHBondContact O-N 3.37Å; L379-N383 PolarHBondContact O-ND2 3.07Å; Y381-N383 VanDerWaalsContact C-N 3.34Å; Y381-N383 PolarHBondContact O-N 3.44Å; N383-F385 VanDerWaalsContact C-N 3.26Å; N383-F385 PolarHBondContact O-N 2.7Å; N383-Y399 VanDerWaalsContact OD1-CE2 3.22Å; N383-Y399 WeakPolarHBondContact OD1-CE2 3.32Å; N383-Y399 PolarHBondContact OD1-OH 3.4Å
384	S	96.6	Very high	96.5	Very high	47 Å²	47	69 Å²	69	33%	0.329	34%	0.341	S	S	.	.	H	α-helix	trans	-71.1	-18.3	-174.4	84.7	0	0	0	0	114.4	R362 Y381 L382	R362-S384 WeakPolarHBondContact CD-OG 3.33Å; R362-S384 PolarHBondContact NH1-OG 3.08Å; Y381-S384 WeakPolarHBondContact O-CB 3.49Å; Y381-S384 PolarHBondContact O-N 3.17Å; Y381-S384 PolarHBondContact O-OG 3.38Å; L382-S384 PolarHBondContact O-N 3.21Å
385	F	95.2	Very high	96.5	Very high	4 Å²	4	65.3 Å²	65.3	2%	0.018	32%	0.324	C	S	.	.	H	α-helix	trans	-127.8	10.2	176.3	61.4	-99.1	0	0	0	113.6	I359 R362 Q363 Y381 L382 N383 S387 Y388 F389 F395	I359-F385 HydrophobicContact CG1-CB 4.39Å; R362-F385 HydrophobicContact CB-CD1 3.85Å; R362-F385 HydrophobicContact CB-CE1 3.95Å; Q363-F385 HydrophobicContact CG-CE1 4.09Å; Q363-F385 HydrophobicContact CG-CE2 3.93Å; Q363-F385 HydrophobicContact CG-CZ 3.57Å; Y381-F385 WeakPolarHBondContact O-CD1 3.49Å; Y381-F385 WeakPolarHBondContact O-CE1 3.45Å; L382-F385 HydrophobicContact CD2-CE1 4.27Å; L382-F385 HydrophobicContact CD2-CE2 4.15Å; L382-F385 HydrophobicContact CD2-CZ 3.52Å; L382-F385 PolarHBondContact O-N 2.73Å; N383-F385 VanDerWaalsContact C-N 3.26Å; N383-F385 PolarHBondContact O-N 2.7Å; F385-S387 PolarHBondContact O-N 3.48Å; F385-S387 VanDerWaalsContact O-N 3.15Å; F385-Y388 HydrophobicContact CB-CD2 4.1Å; F385-Y388 WeakPolarHBondContact O-CD2 3.48Å; F385-Y388 PolarHBondContact O-N 3.31Å; F385-F389 AromaticContact CD2-CD2 3.68Å; F385-F389 HydrophobicContact CD2-CD2 3.68Å; F385-F389 AromaticContact CD2-CE2 3.98Å; F385-F389 HydrophobicContact CD2-CE2 3.98Å; F385-F389 HydrophobicContact CE2-CD2 4.29Å; F385-F395 HydrophobicContact CD2-CD2 4.36Å; F385-F395 AromaticContact CD2-CE2 3.97Å; F385-F395 HydrophobicContact CD2-CE2 3.97Å; F385-F395 AromaticContact CE2-CD2 3.75Å; F385-F395 HydrophobicContact CE2-CD2 3.75Å; F385-F395 AromaticContact CE2-CE2 3.55Å; F385-F395 HydrophobicContact CE2-CE2 3.55Å; F385-F395 HydrophobicContact CZ-CE2 4.33Å
386	K	96.8	Very high	96.5	Very high	73 Å²	73	63.1 Å²	63.1	32%	0.317	31%	0.314	S	S	.	.	H	α-helix	trans	-51.5	-39.6	-179.4	178	174.5	-178	-179.7	0	113.5	L382 Y388 F389 Y390 F395 Y399	L382-K386 PolarHBondContact O-N 2.91Å; L382-K386 VanDerWaalsContact O-N 3.08Å; K386-Y388 PolarHBondContact O-N 3.34Å; K386-Y388 VanDerWaalsContact O-N 3.13Å; K386-F389 CarbonylContact O-C 3.41Å; K386-F389 PolarHBondContact O-N 2.95Å; K386-F389 VanDerWaalsContact O-N 3.1Å; K386-Y390 PolarHBondContact O-N 2.75Å; K386-F395 HydrophobicContact CB-CE1 4.25Å; K386-F395 HydrophobicContact CB-CZ 3.77Å; K386-F395 HydrophobicContact CG-CE1 3.85Å; K386-F395 HydrophobicContact CG-CZ 3.87Å; K386-Y399 HydrophobicContact CD-CE1 4.4Å; K386-Y399 HydrophobicContact CD-CE2 4.4Å; K386-Y399 PolarHBondContact NZ-OH 3.11Å
387	S	95	Very high	96.5	Very high	83 Å²	83	59.2 Å²	59.2	58%	0.58	29%	0.292	S	S	*	.	H	α-helix	trans	-61.7	-20.9	-178.4	54.8	0	0	0	0	114.1	F385 Y390	F385-S387 PolarHBondContact O-N 3.48Å; F385-S387 VanDerWaalsContact O-N 3.15Å; S387-Y390 VanDerWaalsContact O-CD1 3.31Å; S387-Y390 WeakPolarHBondContact O-CD1 3.37Å
388	Y	92.7	Very high	96.5	Very high	163 Å²	163	59.1 Å²	59.1	64%	0.639	29%	0.292	S	S	*	.	H	α-helix	trans	-88.5	-20.6	178.6	-56.9	-79.3	0	0	0	112.8	I359 F385 K386	I359-Y388 HydrophobicContact CD1-CD2 4.03Å; I359-Y388 HydrophobicContact CD1-CE2 4.4Å; I359-Y388 HydrophobicContact CD1-CG 4.11Å; F385-Y388 HydrophobicContact CB-CD2 4.1Å; F385-Y388 WeakPolarHBondContact O-CD2 3.48Å; F385-Y388 PolarHBondContact O-N 3.31Å; K386-Y388 PolarHBondContact O-N 3.34Å; K386-Y388 VanDerWaalsContact O-N 3.13Å
389	F	94.2	Very high	96.5	Very high	55 Å²	55	59.4 Å²	59.4	24%	0.241	29%	0.293	C	S	.	.	H	α-helix	trans	-127.7	17.5	-171.3	-62.6	-89.7	0	0	0	113.4	I359 F385 K386 N391 D392 F395	I359-F389 HydrophobicContact CD1-CE2 4.36Å; I359-F389 HydrophobicContact CG2-CE2 3.67Å; I359-F389 HydrophobicContact CG2-CZ 3.92Å; F385-F389 AromaticContact CD2-CD2 3.68Å; F385-F389 HydrophobicContact CD2-CD2 3.68Å; F385-F389 AromaticContact CD2-CE2 3.98Å; F385-F389 HydrophobicContact CD2-CE2 3.98Å; F385-F389 HydrophobicContact CE2-CD2 4.29Å; K386-F389 CarbonylContact O-C 3.41Å; K386-F389 PolarHBondContact O-N 2.95Å; K386-F389 VanDerWaalsContact O-N 3.1Å; F389-N391 PolarHBondContact O-N 3.03Å; F389-N391 VanDerWaalsContact O-N 3.12Å; F389-D392 HydrophobicContact CB-CB 4.12Å; F389-D392 HydrophobicContact CD1-CB 4.32Å; F389-D392 WeakPolarHBondContact O-CB 3.26Å; F389-D392 PolarHBondContact O-N 3.29Å; F389-F395 HydrophobicContact CB-CB 3.8Å; F389-F395 HydrophobicContact CB-CD1 4.09Å; F389-F395 HydrophobicContact CB-CD2 3.91Å; F389-F395 HydrophobicContact CB-CG 3.63Å; F389-F395 WeakPolarHBondContact O-CD1 3.45Å
390	Y	91.7	Very high	96.5	Very high	131 Å²	131	58.8 Å²	58.8	51%	0.514	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.9	-175.4	70.9	-82	0	0	0	114.5	K386 S387 N396	K386-Y390 PolarHBondContact O-N 2.75Å; S387-Y390 VanDerWaalsContact O-CD1 3.31Å; S387-Y390 WeakPolarHBondContact O-CD1 3.37Å; Y390-N396 PolarHBondContact O-ND2 2.97Å
391	N	93.5	Very high	96.6	Very high	118 Å²	118	54.9 Å²	54.9	63%	0.631	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	3.5	174.9	-70.9	-24.6	0	0	0	113.3	F389	F389-N391 PolarHBondContact O-N 3.03Å; F389-N391 VanDerWaalsContact O-N 3.12Å
392	D	96.3	Very high	96.6	Very high	64 Å²	64	51.8 Å²	51.8	34%	0.342	26%	0.257	S	S	.	.			trans	-88.1	121.8	-179.4	-177.8	82.1	0	0	0	110.4	F389 I394 F395 N396	F389-D392 HydrophobicContact CB-CB 4.12Å; F389-D392 HydrophobicContact CD1-CB 4.32Å; F389-D392 WeakPolarHBondContact O-CB 3.26Å; F389-D392 PolarHBondContact O-N 3.29Å; D392-I394 VanDerWaalsContact C-N 3.33Å; D392-I394 PolarHBondContact O-N 3.3Å; D392-I394 WeakPolarHBondContact OD2-CB 3.46Å; D392-I394 PolarHBondContact OD2-N 2.93Å; D392-F395 HydrophobicContact CB-CB 3.98Å; D392-F395 PolarHBondContact O-N 3.1Å; D392-F395 WeakPolarHBondContact OD2-CB 3.4Å; D392-F395 PolarHBondContact OD2-N 3.47Å; D392-N396 WeakPolarHBondContact O-CB 3.48Å; D392-N396 PolarHBondContact O-N 3.42Å; D392-N396 PolarHBondContact O-ND2 3.22Å
393	D	97.8	Very high	96.6	Very high	33 Å²	33	52.2 Å²	52.2	18%	0.176	26%	0.258	C	S	.	.	H	α-helix	trans	-63.3	-37.4	-175.9	-75.4	-15.4	0	0	0	112.5	N396 F397 I419 Q420 S421 M424	D393-N396 PolarHBondContact O-N 2.85Å; D393-F397 VanDerWaalsContact O-CB 3.32Å; D393-F397 WeakPolarHBondContact O-CB 3.32Å; D393-F397 PolarHBondContact O-N 3.04Å; D393-I419 HydrophobicContact CB-CG2 4.11Å; D393-I419 VanDerWaalsContact OD1-CA 3.3Å; D393-I419 WeakPolarHBondContact OD1-CA 3.45Å; D393-Q420 PolarHBondContact OD1-N 2.99Å; D393-Q420 PolarHBondContact OD2-N 3.29Å; D393-S421 WeakPolarHBondContact OD2-CA 3.36Å; D393-S421 WeakPolarHBondContact OD2-CB 3.47Å; D393-S421 PolarHBondContact OD2-N 3.1Å; D393-M424 HydrophobicContact CB-SD 3.86Å
394	I	96.3	Very high	96.6	Very high	105 Å²	105	49.2 Å²	49.2	54%	0.538	24%	0.243	S	C	.	.	H	α-helix	trans	-69.8	-43.9	-179.4	-61.8	172	0	0	0	109.9	D392 F397 N398 M424	D392-I394 VanDerWaalsContact C-N 3.33Å; D392-I394 PolarHBondContact O-N 3.3Å; D392-I394 WeakPolarHBondContact OD2-CB 3.46Å; D392-I394 PolarHBondContact OD2-N 2.93Å; I394-F397 PolarHBondContact O-N 3.13Å; I394-N398 PolarHBondContact O-N 3.32Å; I394-N398 VanDerWaalsContact O-N 3.15Å; I394-N398 PolarHBondContact O-ND2 3.07Å; I394-M424 HydrophobicContact CG1-SD 4.47Å
395	F	97.9	Very high	96.6	Very high	12 Å²	12	48.8 Å²	48.8	5%	0.053	24%	0.243	C	C	.	.	H	α-helix	trans	-59	-51.3	172.9	174.3	-91.8	0	0	0	111	L382 F385 K386 F389 D392 F397 N398 Y399	L382-F395 HydrophobicContact CB-CE2 4.14Å; L382-F395 HydrophobicContact CB-CZ 4.4Å; L382-F395 HydrophobicContact CD2-CD2 4.46Å; L382-F395 HydrophobicContact CD2-CE2 4.05Å; F385-F395 HydrophobicContact CD2-CD2 4.36Å; F385-F395 AromaticContact CD2-CE2 3.97Å; F385-F395 HydrophobicContact CD2-CE2 3.97Å; F385-F395 AromaticContact CE2-CD2 3.75Å; F385-F395 HydrophobicContact CE2-CD2 3.75Å; F385-F395 AromaticContact CE2-CE2 3.55Å; F385-F395 HydrophobicContact CE2-CE2 3.55Å; F385-F395 HydrophobicContact CZ-CE2 4.33Å; K386-F395 HydrophobicContact CB-CE1 4.25Å; K386-F395 HydrophobicContact CB-CZ 3.77Å; K386-F395 HydrophobicContact CG-CE1 3.85Å; K386-F395 HydrophobicContact CG-CZ 3.87Å; F389-F395 HydrophobicContact CB-CB 3.8Å; F389-F395 HydrophobicContact CB-CD1 4.09Å; F389-F395 HydrophobicContact CB-CD2 3.91Å; F389-F395 HydrophobicContact CB-CG 3.63Å; F389-F395 WeakPolarHBondContact O-CD1 3.45Å; D392-F395 HydrophobicContact CB-CB 3.98Å; D392-F395 PolarHBondContact O-N 3.1Å; D392-F395 WeakPolarHBondContact OD2-CB 3.4Å; D392-F395 PolarHBondContact OD2-N 3.47Å; F395-F397 VanDerWaalsContact C-N 3.28Å; F395-F397 PolarHBondContact O-N 2.86Å; F395-N398 PolarHBondContact O-N 2.88Å; F395-Y399 HydrophobicContact CE1-CD2 4.5Å; F395-Y399 HydrophobicContact CE1-CG 4.23Å; F395-Y399 HydrophobicContact CZ-CD2 4.14Å; F395-Y399 HydrophobicContact CZ-CG 4.31Å; F395-Y399 VanDerWaalsContact O-CB 3.23Å; F395-Y399 WeakPolarHBondContact O-CB 3.34Å; F395-Y399 PolarHBondContact O-N 3.32Å
396	N	98.3	Very high	96.7	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.016	25%	0.252	C	S	.	.	H	α-helix	trans	-61.4	-37.6	-178.1	-77.2	-36.3	0	0	0	112	Y390 D392 D393 A400 I419	Y390-N396 PolarHBondContact O-ND2 2.97Å; D392-N396 WeakPolarHBondContact O-CB 3.48Å; D392-N396 PolarHBondContact O-N 3.42Å; D392-N396 PolarHBondContact O-ND2 3.22Å; D393-N396 PolarHBondContact O-N 2.85Å; N396-A400 WeakPolarHBondContact O-CB 3.35Å; N396-A400 PolarHBondContact O-N 2.86Å; N396-I419 HydrophobicContact CB-CG1 4.04Å
397	F	98.4	Very high	96.7	Very high	30 Å²	30	49.1 Å²	49.1	13%	0.132	26%	0.261	C	S	.	.	H	α-helix	trans	-60.1	-54.8	174.1	-179.5	-100.2	0	0	0	112.7	D393 I394 F395 Y399 A400 Q401 F416 I419 M424 I429 Y430	D393-F397 VanDerWaalsContact O-CB 3.32Å; D393-F397 WeakPolarHBondContact O-CB 3.32Å; D393-F397 PolarHBondContact O-N 3.04Å; I394-F397 PolarHBondContact O-N 3.13Å; F395-F397 VanDerWaalsContact C-N 3.28Å; F395-F397 PolarHBondContact O-N 2.86Å; F397-Y399 VanDerWaalsContact C-N 3.33Å; F397-Y399 PolarHBondContact O-N 3.36Å; F397-A400 PolarHBondContact O-N 2.97Å; F397-Q401 VanDerWaalsContact CE1-CD 3.49Å; F397-Q401 HydrophobicContact CE1-CG 4.45Å; F397-Q401 VanDerWaalsContact CE1-OE1 3.28Å; F397-Q401 WeakPolarHBondContact O-CG 3.43Å; F397-Q401 PolarHBondContact O-N 3.39Å; F397-F416 HydrophobicContact CD2-CD1 4.48Å; F397-F416 AromaticContact CD2-CE1 3.96Å; F397-F416 HydrophobicContact CD2-CE1 3.96Å; F397-F416 HydrophobicContact CE2-CE1 4.27Å; F397-I419 HydrophobicContact CB-CD1 3.67Å; F397-I419 HydrophobicContact CD2-CD1 4.06Å; F397-I419 HydrophobicContact CG-CD1 4.38Å; F397-M424 HydrophobicContact CB-CE 3.4Å; F397-M424 VanDerWaalsContact CB-CE 3.4Å; F397-M424 HydrophobicContact CD1-CE 4.28Å; F397-M424 HydrophobicContact CD2-CE 3.9Å; F397-M424 HydrophobicContact CG-CE 3.61Å; F397-I429 HydrophobicContact CZ-CB 4.3Å; F397-I429 HydrophobicContact CZ-CG2 3.8Å; F397-Y430 HydrophobicContact CD2-CD2 4.22Å; F397-Y430 HydrophobicContact CE2-CD2 4.42Å
398	N	97.9	Very high	96.8	Very high	55 Å²	55	48.5 Å²	48.5	29%	0.294	25%	0.251	S	S	.	.	H	α-helix	trans	-63.2	-42.1	179.8	-69.5	-44.9	0	0	0	111	F370 I394 F395 A400 Q401 A402	F370-N398 HydrophobicContact CE2-CB 3.97Å; F370-N398 HydrophobicContact CZ-CB 4.09Å; F370-N398 WeakPolarHBondContact CZ-O 3.46Å; I394-N398 PolarHBondContact O-N 3.32Å; I394-N398 VanDerWaalsContact O-N 3.15Å; I394-N398 PolarHBondContact O-ND2 3.07Å; F395-N398 PolarHBondContact O-N 2.88Å; N398-A400 PolarHBondContact O-N 3.15Å; N398-Q401 PolarHBondContact O-N 3.33Å; N398-A402 PolarHBondContact O-N 2.74Å
399	Y	98.4	Very high	97.1	Very high	5 Å²	5	41.8 Å²	41.8	2%	0.02	23%	0.227	C	C	.	.	H	α-helix	trans	-61.2	-44.6	177.2	-174.6	-105.8	0	0	0	112.3	L379 L382 N383 K386 F395 F397 A402 K403 A415	L379-Y399 HydrophobicContact CD2-CD2 3.95Å; L379-Y399 HydrophobicContact CD2-CE2 3.8Å; L382-Y399 HydrophobicContact CB-CD2 3.88Å; L382-Y399 HydrophobicContact CB-CE2 4.38Å; L382-Y399 HydrophobicContact CD1-CD2 3.97Å; N383-Y399 VanDerWaalsContact OD1-CE2 3.22Å; N383-Y399 WeakPolarHBondContact OD1-CE2 3.32Å; N383-Y399 PolarHBondContact OD1-OH 3.4Å; K386-Y399 HydrophobicContact CD-CE1 4.4Å; K386-Y399 HydrophobicContact CD-CE2 4.4Å; K386-Y399 PolarHBondContact NZ-OH 3.11Å; F395-Y399 HydrophobicContact CE1-CD2 4.5Å; F395-Y399 HydrophobicContact CE1-CG 4.23Å; F395-Y399 HydrophobicContact CZ-CD2 4.14Å; F395-Y399 HydrophobicContact CZ-CG 4.31Å; F395-Y399 VanDerWaalsContact O-CB 3.23Å; F395-Y399 WeakPolarHBondContact O-CB 3.34Å; F395-Y399 PolarHBondContact O-N 3.32Å; F397-Y399 VanDerWaalsContact C-N 3.33Å; F397-Y399 PolarHBondContact O-N 3.36Å; Y399-A402 PolarHBondContact O-N 3.1Å; Y399-K403 HydrophobicContact CD1-CG 4.22Å; Y399-K403 HydrophobicContact CE1-CG 3.89Å; Y399-K403 VanDerWaalsContact CZ-CE 3.43Å; Y399-K403 WeakPolarHBondContact O-CB 3.29Å; Y399-K403 WeakPolarHBondContact O-CG 3.48Å; Y399-K403 PolarHBondContact O-N 2.91Å; Y399-K403 WeakPolarHBondContact OH-CE 3.48Å; Y399-A415 HydrophobicContact CD1-CB 3.99Å
400	A	98.4	Very high	97.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.7	-42.1	178.2	0	0	0	0	0	112	N396 F397 N398 K403 A404 A415 F416	N396-A400 WeakPolarHBondContact O-CB 3.35Å; N396-A400 PolarHBondContact O-N 2.86Å; F397-A400 PolarHBondContact O-N 2.97Å; N398-A400 PolarHBondContact O-N 3.15Å; A400-K403 PolarHBondContact O-N 3.02Å; A400-A404 VanDerWaalsContact O-CB 3.31Å; A400-A404 WeakPolarHBondContact O-CB 3.31Å; A400-A404 PolarHBondContact O-N 3.05Å; A400-A415 HydrophobicContact CB-CB 3.67Å; A400-F416 HydrophobicContact CB-CB 4.37Å; A400-F416 HydrophobicContact CB-CD1 3.55Å; A400-F416 HydrophobicContact CB-CD2 3.61Å; A400-F416 HydrophobicContact CB-CE1 3.55Å; A400-F416 HydrophobicContact CB-CE2 3.59Å; A400-F416 HydrophobicContact CB-CG 3.56Å; A400-F416 HydrophobicContact CB-CZ 3.55Å
401	Q	98.2	Very high	97.5	Very high	24 Å²	24	39.9 Å²	39.9	11%	0.112	23%	0.232	C	C	.	.	H	α-helix	trans	-59.3	-47	173.7	-72.9	-177.2	-46.7	0	0	111.8	F397 N398 K403 A404 A405 F416 W433	F397-Q401 VanDerWaalsContact CE1-CD 3.49Å; F397-Q401 HydrophobicContact CE1-CG 4.45Å; F397-Q401 VanDerWaalsContact CE1-OE1 3.28Å; F397-Q401 WeakPolarHBondContact O-CG 3.43Å; F397-Q401 PolarHBondContact O-N 3.39Å; N398-Q401 PolarHBondContact O-N 3.33Å; Q401-K403 PolarHBondContact O-N 3.33Å; Q401-A404 PolarHBondContact O-N 3.31Å; Q401-A405 VanDerWaalsContact O-CB 3.26Å; Q401-A405 WeakPolarHBondContact O-CB 3.02Å; Q401-A405 PolarHBondContact O-N 3.34Å; Q401-F416 HydrophobicContact CG-CE1 4.23Å; Q401-F416 HydrophobicContact CG-CZ 3.85Å; Q401-W433 HydrophobicContact CG-CD2 4.37Å; Q401-W433 HydrophobicContact CG-CG 4.2Å
402	A	98.3	Very high	97.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-39.7	178.8	0	0	0	0	0	112.3	F370 F375 V378 L379 N398 Y399 A405 T406	F370-A402 HydrophobicContact CZ-CB 4.13Å; F375-A402 HydrophobicContact CD1-CB 4.42Å; V378-A402 HydrophobicContact CB-CB 4.4Å; V378-A402 HydrophobicContact CG1-CB 3.78Å; L379-A402 HydrophobicContact CD2-CB 3.67Å; L379-A402 HydrophobicContact CG-CB 3.96Å; N398-A402 PolarHBondContact O-N 2.74Å; Y399-A402 PolarHBondContact O-N 3.1Å; A402-A405 PolarHBondContact O-N 3.08Å; A402-T406 WeakPolarHBondContact O-CG2 3.24Å; A402-T406 PolarHBondContact O-N 2.91Å; A402-T406 VanDerWaalsContact O-N 3.13Å; A402-T406 PolarHBondContact O-OG1 2.91Å
403	K	98.4	Very high	97.9	Very high	19 Å²	19	32 Å²	32	8%	0.083	19%	0.189	C	C	.	.	H	α-helix	trans	-63.8	-46.8	173.9	-78	-71.3	-178.5	164.2	0	112.2	L379 Y399 A400 Q401 A405 T406 G407 N408 E411	L379-K403 HydrophobicContact CD1-CD 4.03Å; L379-K403 HydrophobicContact CD2-CD 4.09Å; L379-K403 HydrophobicContact CD2-CG 3.95Å; Y399-K403 HydrophobicContact CD1-CG 4.22Å; Y399-K403 HydrophobicContact CE1-CG 3.89Å; Y399-K403 VanDerWaalsContact CZ-CE 3.43Å; Y399-K403 WeakPolarHBondContact O-CB 3.29Å; Y399-K403 WeakPolarHBondContact O-CG 3.48Å; Y399-K403 PolarHBondContact O-N 2.91Å; Y399-K403 WeakPolarHBondContact OH-CE 3.48Å; A400-K403 PolarHBondContact O-N 3.02Å; Q401-K403 PolarHBondContact O-N 3.33Å; K403-A405 VanDerWaalsContact C-N 3.33Å; K403-A405 PolarHBondContact O-N 3.23Å; K403-T406 PolarHBondContact O-N 3.08Å; K403-T406 PolarHBondContact O-OG1 2.85Å; K403-G407 PolarHBondContact O-N 3.24Å; K403-N408 HydrophobicContact CB-CB 4.35Å; K403-N408 HydrophobicContact CD-CB 3.82Å; K403-N408 CarbonylContact O-C 3.49Å; K403-N408 WeakPolarHBondContact O-CA 3.41Å; K403-N408 WeakPolarHBondContact O-CB 3.35Å; K403-N408 PolarHBondContact O-N 2.97Å; K403-E411 HydrophobicContact CD-CB 4.15Å; K403-E411 WeakPolarHBondContact CE-OE2 3.34Å; K403-E411 HydrophobicContact CG-CB 4.41Å; K403-E411 IonicContact NZ-OE1 2.62Å; K403-E411 PolarHBondContact NZ-OE1 3.16Å; K403-E411 IonicContact NZ-OE2 3.56Å; K403-E411 PolarHBondContact NZ-OE2 2.95Å
404	A	98	Very high	97.9	Very high	9 Å²	9	36.3 Å²	36.3	7%	0.074	21%	0.208	C	C	.	.	H	α-helix	trans	-63.4	-39.8	177.8	0	0	0	0	0	111.8	A400 Q401 T406 G407 W433	A400-A404 VanDerWaalsContact O-CB 3.31Å; A400-A404 WeakPolarHBondContact O-CB 3.31Å; A400-A404 PolarHBondContact O-N 3.05Å; Q401-A404 PolarHBondContact O-N 3.31Å; A404-T406 VanDerWaalsContact C-N 3.34Å; A404-T406 PolarHBondContact O-N 2.82Å; A404-G407 PolarHBondContact O-N 3.4Å; A404-G407 VanDerWaalsContact O-N 3.16Å; A404-W433 HydrophobicContact CB-CE3 3.66Å; A404-W433 HydrophobicContact CB-CZ3 3.75Å
405	A	97.3	Very high	97.9	Very high	39 Å²	39	31.5 Å²	31.5	32%	0.322	18%	0.184	S	C	.	.	H	α-helix	trans	-66.8	-31.6	179.2	0	0	0	0	0	113.6	F375 Q401 A402 K403 G407 W433	F375-A405 HydrophobicContact CB-CB 4.02Å; F375-A405 HydrophobicContact CD1-CB 4Å; F375-A405 HydrophobicContact CD2-CB 3.47Å; F375-A405 VanDerWaalsContact CD2-CB 3.47Å; F375-A405 HydrophobicContact CE1-CB 4.33Å; F375-A405 HydrophobicContact CE2-CB 3.84Å; F375-A405 HydrophobicContact CG-CB 3.55Å; F375-A405 HydrophobicContact CZ-CB 4.26Å; Q401-A405 VanDerWaalsContact O-CB 3.26Å; Q401-A405 WeakPolarHBondContact O-CB 3.02Å; Q401-A405 PolarHBondContact O-N 3.34Å; A402-A405 PolarHBondContact O-N 3.08Å; K403-A405 VanDerWaalsContact C-N 3.33Å; K403-A405 PolarHBondContact O-N 3.23Å; A405-G407 VanDerWaalsContact C-N 3.26Å; A405-G407 PolarHBondContact O-N 3.35Å; A405-W433 HydrophobicContact CB-CH2 4.09Å; A405-W433 HydrophobicContact CB-CZ3 4.42Å
406	T	97.6	Very high	98	Very high	33 Å²	33	31 Å²	31	20%	0.202	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	5.1	174.6	53.8	0	0	0	0	113.5	F375 D376 L379 A402 K403 A404 N408	F375-T406 HydrophobicContact CB-CG2 3.72Å; D376-T406 VanDerWaalsContact OD1-CG2 3.3Å; D376-T406 WeakPolarHBondContact OD1-CG2 3.48Å; L379-T406 HydrophobicContact CD1-CG2 3.89Å; L379-T406 WeakPolarHBondContact CD1-OG1 3.37Å; A402-T406 WeakPolarHBondContact O-CG2 3.24Å; A402-T406 PolarHBondContact O-N 2.91Å; A402-T406 VanDerWaalsContact O-N 3.13Å; A402-T406 PolarHBondContact O-OG1 2.91Å; K403-T406 PolarHBondContact O-N 3.08Å; K403-T406 PolarHBondContact O-OG1 2.85Å; A404-T406 VanDerWaalsContact C-N 3.34Å; A404-T406 PolarHBondContact O-N 2.82Å; T406-N408 VanDerWaalsContact C-N 3.31Å; T406-N408 PolarHBondContact O-N 3.45Å; T406-N408 PolarHBondContact OG1-ND2 3.28Å; T406-N408 VanDerWaalsContact OG1-ND2 3.14Å
407	G	96.2	Very high	97.9	Very high	50 Å²	50	34.9 Å²	34.9	52%	0.515	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	-4.1	179.8	0	0	0	0	0	114.9	K403 A404 A405 T409	K403-G407 PolarHBondContact O-N 3.24Å; A404-G407 PolarHBondContact O-N 3.4Å; A404-G407 VanDerWaalsContact O-N 3.16Å; A405-G407 VanDerWaalsContact C-N 3.26Å; A405-G407 PolarHBondContact O-N 3.35Å; G407-T409 PolarHBondContact O-N 3.13Å
408	N	97.5	Very high	97.9	Very high	70 Å²	70	37.9 Å²	37.9	37%	0.374	22%	0.219	S	C	.	.			trans	-77.4	57.2	175.5	-62.6	-54.2	0	0	0	111.4	K403 T406 S410 E411 G412	K403-N408 HydrophobicContact CB-CB 4.35Å; K403-N408 HydrophobicContact CD-CB 3.82Å; K403-N408 CarbonylContact O-C 3.49Å; K403-N408 WeakPolarHBondContact O-CA 3.41Å; K403-N408 WeakPolarHBondContact O-CB 3.35Å; K403-N408 PolarHBondContact O-N 2.97Å; T406-N408 VanDerWaalsContact C-N 3.31Å; T406-N408 PolarHBondContact O-N 3.45Å; T406-N408 PolarHBondContact OG1-ND2 3.28Å; T406-N408 VanDerWaalsContact OG1-ND2 3.14Å; N408-S410 PolarHBondContact O-N 3.46Å; N408-E411 PolarHBondContact O-N 2.88Å; N408-G412 PolarHBondContact O-N 3.15Å
409	T	97.7	Very high	97.9	Very high	22 Å²	22	35.3 Å²	35.3	14%	0.135	21%	0.205	C	C	.	.	H	α-helix	trans	-70.4	-25.3	-169.3	48.2	0	0	0	0	114.1	G407 E413 M440 N441	G407-T409 PolarHBondContact O-N 3.13Å; T409-E413 WeakPolarHBondContact O-CB 3.4Å; T409-E413 PolarHBondContact O-N 2.94Å; T409-M440 HydrophobicContact CG2-CB 3.74Å; T409-M440 HydrophobicContact CG2-CG 3.99Å; T409-N441 PolarHBondContact O-ND2 2.92Å; T409-N441 PolarHBondContact OG1-OD1 3.01Å
410	S	98.3	Very high	97.9	Very high	67 Å²	67	41 Å²	41	47%	0.469	23%	0.232	S	C	.	.	H	α-helix	trans	-64.6	-51.5	172.2	-167.4	0	0	0	0	111.4	N408 G412 E413 E414 N441	N408-S410 PolarHBondContact O-N 3.46Å; S410-G412 VanDerWaalsContact C-N 3.31Å; S410-G412 PolarHBondContact O-N 3.4Å; S410-E413 WeakPolarHBondContact O-CB 3.34Å; S410-E413 PolarHBondContact O-N 3.06Å; S410-E414 PolarHBondContact O-N 3.11Å; S410-E414 VanDerWaalsContact O-N 3.11Å; S410-N441 PolarHBondContact N-OD1 3.45Å
411	E	97.6	Very high	97.8	Very high	80 Å²	80	42.8 Å²	42.8	37%	0.374	24%	0.244	S	C	.	.	H	α-helix	trans	-66.9	-33.8	176.1	-70	-175.1	-124.5	0	0	111.9	K403 N408 E414 A415	K403-E411 HydrophobicContact CD-CB 4.15Å; K403-E411 WeakPolarHBondContact CE-OE2 3.34Å; K403-E411 HydrophobicContact CG-CB 4.41Å; K403-E411 IonicContact NZ-OE1 2.62Å; K403-E411 PolarHBondContact NZ-OE1 3.16Å; K403-E411 IonicContact NZ-OE2 3.56Å; K403-E411 PolarHBondContact NZ-OE2 2.95Å; N408-E411 PolarHBondContact O-N 2.88Å; E411-E414 PolarHBondContact O-N 3.28Å; E411-A415 WeakPolarHBondContact O-CB 3.37Å; E411-A415 PolarHBondContact O-N 3.1Å
412	G	98	Very high	97.7	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.6	-43.1	172.6	0	0	0	0	0	112.5	N408 S410 A415 F416	N408-G412 PolarHBondContact O-N 3.15Å; S410-G412 VanDerWaalsContact C-N 3.31Å; S410-G412 PolarHBondContact O-N 3.4Å; G412-A415 PolarHBondContact O-N 3.03Å; G412-F416 WeakPolarHBondContact O-CD2 3.07Å; G412-F416 PolarHBondContact O-N 2.82Å
413	E	98.5	Very high	97.5	Very high	17 Å²	17	54.1 Å²	54.1	8%	0.079	30%	0.295	C	S	.	.	H	α-helix	trans	-59.4	-50.2	174.1	-174.4	-173.4	146.9	0	0	110.9	T409 S410 A415 F416 L417 L434 C437 Y438 N441 K443	T409-E413 WeakPolarHBondContact O-CB 3.4Å; T409-E413 PolarHBondContact O-N 2.94Å; S410-E413 WeakPolarHBondContact O-CB 3.34Å; S410-E413 PolarHBondContact O-N 3.06Å; E413-A415 VanDerWaalsContact C-N 3.33Å; E413-A415 PolarHBondContact O-N 3.19Å; E413-F416 PolarHBondContact O-N 2.96Å; E413-L417 HydrophobicContact CG-CD1 4.05Å; E413-L417 VanDerWaalsContact O-CG 3.29Å; E413-L417 WeakPolarHBondContact O-CG 3.23Å; E413-L417 PolarHBondContact O-N 3.23Å; E413-L417 VanDerWaalsContact O-N 3.08Å; E413-L434 HydrophobicContact CG-CD1 4.39Å; E413-C437 HydrophobicContact CB-CB 4.09Å; E413-Y438 HydrophobicContact CG-CD1 4.06Å; E413-Y438 HydrophobicContact CG-CE1 3.8Å; E413-Y438 WeakPolarHBondContact OE1-CE1 3.38Å; E413-N441 PolarHBondContact OE2-ND2 2.91Å; E413-K443 IonicContact OE1-NZ 2.58Å; E413-K443 PolarHBondContact OE1-NZ 2.88Å; E413-K443 IonicContact OE2-NZ 3.65Å; E413-K443 PolarHBondContact OE2-NZ 3.05Å
414	E	98	Very high	97.4	Very high	122 Å²	122	55 Å²	55	57%	0.57	30%	0.3	S	S	*	.	H	α-helix	trans	-57.5	-45.9	178.9	-71	174.5	-167.7	0	0	111.7	S410 E411 L417 L418	S410-E414 PolarHBondContact O-N 3.11Å; S410-E414 VanDerWaalsContact O-N 3.11Å; E411-E414 PolarHBondContact O-N 3.28Å; E414-L417 PolarHBondContact O-N 2.95Å; E414-L418 PolarHBondContact O-N 2.86Å
415	A	97.8	Very high	97.3	Very high	5 Å²	5	56.9 Å²	56.9	4%	0.041	31%	0.306	C	S	.	.	H	α-helix	trans	-66.4	-40.2	179.7	0	0	0	0	0	113.2	Y399 A400 E411 G412 E413 L417 L418	Y399-A415 HydrophobicContact CD1-CB 3.99Å; A400-A415 HydrophobicContact CB-CB 3.67Å; E411-A415 WeakPolarHBondContact O-CB 3.37Å; E411-A415 PolarHBondContact O-N 3.1Å; G412-A415 PolarHBondContact O-N 3.03Å; E413-A415 VanDerWaalsContact C-N 3.33Å; E413-A415 PolarHBondContact O-N 3.19Å; A415-L417 VanDerWaalsContact C-N 3.25Å; A415-L417 PolarHBondContact O-N 3.42Å; A415-L418 WeakPolarHBondContact O-CB 3.38Å; A415-L418 PolarHBondContact O-N 3.19Å
416	F	98.5	Very high	97.2	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.2	-32.1	173.6	-80.7	-54.6	0	0	0	112.7	F397 A400 Q401 G412 E413 L418 I419 Y430 W433 L434	F397-F416 HydrophobicContact CD2-CD1 4.48Å; F397-F416 AromaticContact CD2-CE1 3.96Å; F397-F416 HydrophobicContact CD2-CE1 3.96Å; F397-F416 HydrophobicContact CE2-CE1 4.27Å; A400-F416 HydrophobicContact CB-CB 4.37Å; A400-F416 HydrophobicContact CB-CD1 3.55Å; A400-F416 HydrophobicContact CB-CD2 3.61Å; A400-F416 HydrophobicContact CB-CE1 3.55Å; A400-F416 HydrophobicContact CB-CE2 3.59Å; A400-F416 HydrophobicContact CB-CG 3.56Å; A400-F416 HydrophobicContact CB-CZ 3.55Å; Q401-F416 HydrophobicContact CG-CE1 4.23Å; Q401-F416 HydrophobicContact CG-CZ 3.85Å; G412-F416 WeakPolarHBondContact O-CD2 3.07Å; G412-F416 PolarHBondContact O-N 2.82Å; E413-F416 PolarHBondContact O-N 2.96Å; F416-L418 VanDerWaalsContact C-N 3.31Å; F416-I419 HydrophobicContact CD1-CD1 4.26Å; F416-I419 PolarHBondContact O-N 3.2Å; F416-Y430 HydrophobicContact CB-CE2 3.92Å; F416-Y430 AromaticContact CD1-CD2 3.69Å; F416-Y430 HydrophobicContact CD1-CD2 3.69Å; F416-Y430 AromaticContact CD1-CE2 3.67Å; F416-Y430 HydrophobicContact CD1-CE2 3.67Å; F416-Y430 HydrophobicContact CE1-CD2 4.26Å; F416-Y430 HydrophobicContact CG-CE2 4.17Å; F416-Y430 WeakPolarHBondContact O-CE2 3.46Å; F416-Y430 PolarHBondContact O-OH 3.35Å; F416-W433 HydrophobicContact CE1-CB 4.23Å; F416-W433 HydrophobicContact CE2-CB 3.66Å; F416-W433 HydrophobicContact CZ-CB 3.37Å; F416-W433 HydrophobicContact CZ-CG 4.1Å; F416-L434 HydrophobicContact CB-CD1 3.91Å; F416-L434 HydrophobicContact CD2-CD1 4.47Å
417	L	97.8	Very high	97.1	Very high	86 Å²	86	62.6 Å²	62.6	45%	0.45	33%	0.331	S	S	.	.	H	α-helix	trans	-77.7	-14	178.9	-68.8	174.7	0	0	0	113.6	E413 E414 A415 I419	E413-L417 HydrophobicContact CG-CD1 4.05Å; E413-L417 VanDerWaalsContact O-CG 3.29Å; E413-L417 WeakPolarHBondContact O-CG 3.23Å; E413-L417 PolarHBondContact O-N 3.23Å; E413-L417 VanDerWaalsContact O-N 3.08Å; E414-L417 PolarHBondContact O-N 2.95Å; A415-L417 VanDerWaalsContact C-N 3.25Å; A415-L417 PolarHBondContact O-N 3.42Å; L417-I419 VanDerWaalsContact C-N 3.3Å
418	L	97.3	Very high	97.1	Very high	93 Å²	93	62.6 Å²	62.6	49%	0.487	32%	0.315	S	S	.	.	H	α-helix	trans	-73.1	-24	171.8	-67.3	176.3	0	0	0	112.6	E414 A415 F416 Q420	E414-L418 PolarHBondContact O-N 2.86Å; A415-L418 WeakPolarHBondContact O-CB 3.38Å; A415-L418 PolarHBondContact O-N 3.19Å; F416-L418 VanDerWaalsContact C-N 3.31Å; L418-Q420 PolarHBondContact O-N 3.04Å; L418-Q420 PolarHBondContact O-NE2 3.39Å
419	I	98.3	Very high	97	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.315	C	S	.	.			trans	-62.4	130.1	-176.8	-62.4	-178	0	0	0	110.3	D393 N396 F397 F416 L417 M424 K425 Y430	D393-I419 HydrophobicContact CB-CG2 4.11Å; D393-I419 VanDerWaalsContact OD1-CA 3.3Å; D393-I419 WeakPolarHBondContact OD1-CA 3.45Å; N396-I419 HydrophobicContact CB-CG1 4.04Å; F397-I419 HydrophobicContact CB-CD1 3.67Å; F397-I419 HydrophobicContact CD2-CD1 4.06Å; F397-I419 HydrophobicContact CG-CD1 4.38Å; F416-I419 HydrophobicContact CD1-CD1 4.26Å; F416-I419 PolarHBondContact O-N 3.2Å; L417-I419 VanDerWaalsContact C-N 3.3Å; I419-M424 HydrophobicContact CD1-CE 4.41Å; I419-M424 HydrophobicContact CG2-CB 4.14Å; I419-M424 HydrophobicContact CG2-SD 4.49Å; I419-K425 HydrophobicContact CG2-CG 4.47Å; I419-K425 WeakPolarHBondContact O-CE 3.36Å; I419-K425 PolarHBondContact O-NZ 3.3Å; I419-Y430 HydrophobicContact CB-CE2 4.36Å; I419-Y430 HydrophobicContact CD1-CD2 3.99Å; I419-Y430 HydrophobicContact CD1-CE2 3.81Å
420	Q	97.6	Very high	97	Very high	125 Å²	125	62.1 Å²	62.1	58%	0.584	31%	0.31	S	S	*	.			trans	-101.7	-32	179.5	-60	-53.5	-43.6	0	0	113.2	D393 L418 E422 K425	D393-Q420 PolarHBondContact OD1-N 2.99Å; D393-Q420 PolarHBondContact OD2-N 3.29Å; L418-Q420 PolarHBondContact O-N 3.04Å; L418-Q420 PolarHBondContact O-NE2 3.39Å; Q420-E422 PolarHBondContact O-N 2.62Å; Q420-E422 VanDerWaalsContact O-N 3.17Å; Q420-K425 PolarHBondContact O-NZ 3.23Å
421	S	96.6	Very high	97	Very high	37 Å²	37	59.9 Å²	59.9	26%	0.259	29%	0.293	S	S	.	.			trans	-55.8	114.3	-177.5	175.7	0	0	0	0	113.2	D393 K423 M424 K425	D393-S421 WeakPolarHBondContact OD2-CA 3.36Å; D393-S421 WeakPolarHBondContact OD2-CB 3.47Å; D393-S421 PolarHBondContact OD2-N 3.1Å; S421-K423 VanDerWaalsContact C-N 3.28Å; S421-K423 PolarHBondContact O-N 3.09Å; S421-M424 PolarHBondContact O-N 3.08Å; S421-M424 VanDerWaalsContact O-N 3.17Å; S421-M424 PolarHBondContact OG-N 3.41Å; S421-K425 WeakPolarHBondContact O-CG 3.32Å; S421-K425 PolarHBondContact O-N 3.39Å
422	E	95.9	Very high	97.1	Very high	113 Å²	113	56.5 Å²	56.5	53%	0.528	28%	0.278	S	S	.	.	H	α-helix	trans	-66.4	-29	175.6	-63.3	-57	131.8	0	0	112.3	Q420 M424 K425 N426	Q420-E422 PolarHBondContact O-N 2.62Å; Q420-E422 VanDerWaalsContact O-N 3.17Å; E422-M424 VanDerWaalsContact C-N 3.31Å; E422-M424 PolarHBondContact O-N 2.92Å; E422-K425 PolarHBondContact O-N 3Å; E422-K425 WeakPolarHBondContact OE1-CD 3.33Å; E422-K425 IonicContact OE1-NZ 3Å; E422-K425 PolarHBondContact OE1-NZ 2.82Å; E422-N426 WeakPolarHBondContact O-CB 3.37Å; E422-N426 PolarHBondContact O-N 3.31Å; E422-N426 VanDerWaalsContact O-N 3.16Å; E422-N426 PolarHBondContact O-ND2 3.48Å
423	K	95	Very high	97.1	Very high	150 Å²	150	59 Å²	59	65%	0.652	29%	0.288	S	S	*	.	H	α-helix	trans	-59.2	-46.6	171.9	-176.8	-175.9	176.7	-174	0	109.8	D299 S421 D427	D299-K423 IonicContact OD2-NZ 3.2Å; D299-K423 PolarHBondContact OD2-NZ 3.08Å; S421-K423 VanDerWaalsContact C-N 3.28Å; S421-K423 PolarHBondContact O-N 3.09Å; K423-D427 PolarHBondContact O-N 2.91Å
424	M	96.2	Very high	97.1	Very high	36 Å²	36	58.4 Å²	58.4	18%	0.177	29%	0.285	C	S	.	.	H	α-helix	trans	-72.7	-39	-179.2	-65.9	178.4	72.9	0	0	112.3	D393 I394 F397 I419 S421 E422 N426 D427 Y430	D393-M424 HydrophobicContact CB-SD 3.86Å; I394-M424 HydrophobicContact CG1-SD 4.47Å; F397-M424 HydrophobicContact CB-CE 3.4Å; F397-M424 VanDerWaalsContact CB-CE 3.4Å; F397-M424 HydrophobicContact CD1-CE 4.28Å; F397-M424 HydrophobicContact CD2-CE 3.9Å; F397-M424 HydrophobicContact CG-CE 3.61Å; I419-M424 HydrophobicContact CD1-CE 4.41Å; I419-M424 HydrophobicContact CG2-CB 4.14Å; I419-M424 HydrophobicContact CG2-SD 4.49Å; S421-M424 PolarHBondContact O-N 3.08Å; S421-M424 VanDerWaalsContact O-N 3.17Å; S421-M424 PolarHBondContact OG-N 3.41Å; E422-M424 VanDerWaalsContact C-N 3.31Å; E422-M424 PolarHBondContact O-N 2.92Å; M424-N426 PolarHBondContact O-N 3.37Å; M424-D427 VanDerWaalsContact O-CB 3.27Å; M424-D427 WeakPolarHBondContact O-CB 3.43Å; M424-D427 PolarHBondContact O-N 3.26Å; M424-D427 VanDerWaalsContact O-N 3.09Å; M424-Y430 WeakPolarHBondContact O-CB 3.46Å
425	K	96.5	Very high	97.1	Very high	49 Å²	49	52.6 Å²	52.6	21%	0.213	26%	0.258	C	S	.	.	H	α-helix	trans	-64.3	-28	178.9	-72.6	176.4	-171.5	163.4	0	113.8	I419 Q420 S421 E422 Y430 L431	I419-K425 HydrophobicContact CG2-CG 4.47Å; I419-K425 WeakPolarHBondContact O-CE 3.36Å; I419-K425 PolarHBondContact O-NZ 3.3Å; Q420-K425 PolarHBondContact O-NZ 3.23Å; S421-K425 WeakPolarHBondContact O-CG 3.32Å; S421-K425 PolarHBondContact O-N 3.39Å; E422-K425 PolarHBondContact O-N 3Å; E422-K425 WeakPolarHBondContact OE1-CD 3.33Å; E422-K425 IonicContact OE1-NZ 3Å; E422-K425 PolarHBondContact OE1-NZ 2.82Å; K425-Y430 HydrophobicContact CB-CD1 4.42Å; K425-Y430 HydrophobicContact CB-CE1 4.14Å; K425-Y430 HydrophobicContact CG-CE1 4.08Å; K425-Y430 WeakPolarHBondContact O-CD1 3.37Å; K425-L431 WeakPolarHBondContact O-CD2 3.41Å
426	N	94.6	Very high	97.1	Very high	117 Å²	117	56.2 Å²	56.2	63%	0.626	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-6.5	176.4	-68.7	-50.7	0	0	0	113.1	E422 M424	E422-N426 WeakPolarHBondContact O-CB 3.37Å; E422-N426 PolarHBondContact O-N 3.31Å; E422-N426 VanDerWaalsContact O-N 3.16Å; E422-N426 PolarHBondContact O-ND2 3.48Å; M424-N426 PolarHBondContact O-N 3.37Å
427	D	94.9	Very high	97.1	Very high	76 Å²	76	56.2 Å²	56.2	41%	0.406	27%	0.27	S	S	.	.	S	Bend	trans	-72.6	135.5	177.8	-172.2	-80.5	0	0	0	111.2	K423 M424 I429 Y430 L431	K423-D427 PolarHBondContact O-N 2.91Å; M424-D427 VanDerWaalsContact O-CB 3.27Å; M424-D427 WeakPolarHBondContact O-CB 3.43Å; M424-D427 PolarHBondContact O-N 3.26Å; M424-D427 VanDerWaalsContact O-N 3.09Å; D427-I429 VanDerWaalsContact C-N 3.26Å; D427-I429 PolarHBondContact O-N 2.97Å; D427-I429 WeakPolarHBondContact OD1-CA 3.45Å; D427-I429 VanDerWaalsContact OD1-CB 3.22Å; D427-I429 WeakPolarHBondContact OD1-CB 3.29Å; D427-I429 WeakPolarHBondContact OD1-CG1 3.48Å; D427-I429 PolarHBondContact OD1-N 3.31Å; D427-Y430 WeakPolarHBondContact O-CB 3.5Å; D427-Y430 PolarHBondContact O-N 3.42Å; D427-Y430 VanDerWaalsContact O-N 3.15Å; D427-L431 WeakPolarHBondContact O-CG 3.34Å; D427-L431 PolarHBondContact O-N 3.48Å
428	Y	96	Very high	97.1	Very high	50 Å²	50	53.2 Å²	53.2	20%	0.196	25%	0.253	C	S	.	.	H	α-helix	trans	-58.2	-36.3	-179.6	165.3	-105.2	0	0	0	113.3	L431 S432 E459 S462 L463	Y428-L431 PolarHBondContact O-N 3.02Å; Y428-S432 VanDerWaalsContact O-CB 3.28Å; Y428-S432 WeakPolarHBondContact O-CB 3.42Å; Y428-S432 PolarHBondContact O-N 2.88Å; Y428-S432 PolarHBondContact O-OG 3.49Å; Y428-E459 VanDerWaalsContact CB-CD 3.5Å; Y428-E459 WeakPolarHBondContact CB-OE1 3.47Å; Y428-E459 HydrophobicContact CD2-CB 3.7Å; Y428-E459 HydrophobicContact CD2-CG 4.25Å; Y428-E459 HydrophobicContact CE2-CB 4.44Å; Y428-E459 WeakPolarHBondContact CE2-O 3.45Å; Y428-E459 HydrophobicContact CG-CB 3.94Å; Y428-E459 HydrophobicContact CG-CG 3.98Å; Y428-S462 VanDerWaalsContact OH-CB 3.25Å; Y428-S462 WeakPolarHBondContact OH-CB 3.43Å; Y428-L463 HydrophobicContact CE2-CB 4.23Å
429	I	96.5	Very high	97.2	Very high	71 Å²	71	48.8 Å²	48.8	36%	0.364	23%	0.23	S	C	.	.	H	α-helix	trans	-65.9	-42.7	179.5	-55.4	-61.2	0	0	0	109.7	F397 D427 S432 W433	F397-I429 HydrophobicContact CZ-CB 4.3Å; F397-I429 HydrophobicContact CZ-CG2 3.8Å; D427-I429 VanDerWaalsContact C-N 3.26Å; D427-I429 PolarHBondContact O-N 2.97Å; D427-I429 WeakPolarHBondContact OD1-CA 3.45Å; D427-I429 VanDerWaalsContact OD1-CB 3.22Å; D427-I429 WeakPolarHBondContact OD1-CB 3.29Å; D427-I429 WeakPolarHBondContact OD1-CG1 3.48Å; D427-I429 PolarHBondContact OD1-N 3.31Å; I429-S432 WeakPolarHBondContact CA-OG 3.44Å; I429-S432 PolarHBondContact O-OG 3.19Å; I429-W433 PolarHBondContact O-N 3.34Å; I429-W433 VanDerWaalsContact O-N 3.15Å
430	Y	98.1	Very high	97.2	Very high	11 Å²	11	51.7 Å²	51.7	4%	0.043	24%	0.244	C	C	.	.	H	α-helix	trans	-58.7	-52	172.7	174	-93.7	0	0	0	111.5	F397 F416 I419 M424 K425 D427 S432 W433 L434	F397-Y430 HydrophobicContact CD2-CD2 4.22Å; F397-Y430 HydrophobicContact CE2-CD2 4.42Å; F416-Y430 HydrophobicContact CB-CE2 3.92Å; F416-Y430 AromaticContact CD1-CD2 3.69Å; F416-Y430 HydrophobicContact CD1-CD2 3.69Å; F416-Y430 AromaticContact CD1-CE2 3.67Å; F416-Y430 HydrophobicContact CD1-CE2 3.67Å; F416-Y430 HydrophobicContact CE1-CD2 4.26Å; F416-Y430 HydrophobicContact CG-CE2 4.17Å; F416-Y430 WeakPolarHBondContact O-CE2 3.46Å; F416-Y430 PolarHBondContact O-OH 3.35Å; I419-Y430 HydrophobicContact CB-CE2 4.36Å; I419-Y430 HydrophobicContact CD1-CD2 3.99Å; I419-Y430 HydrophobicContact CD1-CE2 3.81Å; M424-Y430 WeakPolarHBondContact O-CB 3.46Å; K425-Y430 HydrophobicContact CB-CD1 4.42Å; K425-Y430 HydrophobicContact CB-CE1 4.14Å; K425-Y430 HydrophobicContact CG-CE1 4.08Å; K425-Y430 WeakPolarHBondContact O-CD1 3.37Å; D427-Y430 WeakPolarHBondContact O-CB 3.5Å; D427-Y430 PolarHBondContact O-N 3.42Å; D427-Y430 VanDerWaalsContact O-N 3.15Å; Y430-S432 VanDerWaalsContact C-N 3.35Å; Y430-S432 PolarHBondContact O-N 2.89Å; Y430-W433 PolarHBondContact O-N 2.88Å; Y430-L434 HydrophobicContact CE1-CD2 3.79Å; Y430-L434 WeakPolarHBondContact O-CB 3.44Å; Y430-L434 PolarHBondContact O-N 3.48Å
431	L	98	Very high	97.2	Very high	19 Å²	19	47.4 Å²	47.4	10%	0.099	23%	0.225	C	C	.	.	H	α-helix	trans	-61	-42.8	-176.7	-67.9	172.5	0	0	0	112.2	K425 D427 Y428 A435 L450 M454	K425-L431 WeakPolarHBondContact O-CD2 3.41Å; D427-L431 WeakPolarHBondContact O-CG 3.34Å; D427-L431 PolarHBondContact O-N 3.48Å; Y428-L431 PolarHBondContact O-N 3.02Å; L431-A435 WeakPolarHBondContact O-CB 3.49Å; L431-A435 PolarHBondContact O-N 2.99Å; L431-L450 HydrophobicContact CD2-CD2 4.06Å; L431-M454 HydrophobicContact CD1-CE 4.12Å; L431-M454 HydrophobicContact CD1-CG 4.11Å; L431-M454 HydrophobicContact CD1-SD 3.97Å
432	S	98	Very high	97.2	Very high	9 Å²	9	53.7 Å²	53.7	6%	0.063	25%	0.248	C	C	.	.	H	α-helix	trans	-66.3	-41.9	-179.8	59.5	0	0	0	0	112.7	Y428 I429 Y430 R436	Y428-S432 VanDerWaalsContact O-CB 3.28Å; Y428-S432 WeakPolarHBondContact O-CB 3.42Å; Y428-S432 PolarHBondContact O-N 2.88Å; Y428-S432 PolarHBondContact O-OG 3.49Å; I429-S432 WeakPolarHBondContact CA-OG 3.44Å; I429-S432 PolarHBondContact O-OG 3.19Å; Y430-S432 VanDerWaalsContact C-N 3.35Å; Y430-S432 PolarHBondContact O-N 2.89Å; S432-R436 PolarHBondContact O-N 3.42Å
433	W	98.1	Very high	97.3	Very high	53 Å²	53	52.3 Å²	52.3	20%	0.201	24%	0.24	C	C	.	.	H	α-helix	trans	-70.9	-41.1	176.1	-81.4	103.7	0	0	0	112.8	Q401 A404 A405 F416 I429 Y430 R436 C437	Q401-W433 HydrophobicContact CG-CD2 4.37Å; Q401-W433 HydrophobicContact CG-CG 4.2Å; A404-W433 HydrophobicContact CB-CE3 3.66Å; A404-W433 HydrophobicContact CB-CZ3 3.75Å; A405-W433 HydrophobicContact CB-CH2 4.09Å; A405-W433 HydrophobicContact CB-CZ3 4.42Å; F416-W433 HydrophobicContact CE1-CB 4.23Å; F416-W433 HydrophobicContact CE2-CB 3.66Å; F416-W433 HydrophobicContact CZ-CB 3.37Å; F416-W433 HydrophobicContact CZ-CG 4.1Å; I429-W433 PolarHBondContact O-N 3.34Å; I429-W433 VanDerWaalsContact O-N 3.15Å; Y430-W433 PolarHBondContact O-N 2.88Å; W433-R436 WeakPolarHBondContact O-CB 3.42Å; W433-R436 PolarHBondContact O-N 3.24Å; W433-C437 PolarHBondContact O-N 3.41Å
434	L	98.5	Very high	97.4	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.021	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-42	175.7	-179.5	60.2	0	0	0	111.4	E413 F416 Y430 R436 C437 Y438 L450	E413-L434 HydrophobicContact CG-CD1 4.39Å; F416-L434 HydrophobicContact CB-CD1 3.91Å; F416-L434 HydrophobicContact CD2-CD1 4.47Å; Y430-L434 HydrophobicContact CE1-CD2 3.79Å; Y430-L434 WeakPolarHBondContact O-CB 3.44Å; Y430-L434 PolarHBondContact O-N 3.48Å; L434-R436 VanDerWaalsContact C-N 3.32Å; L434-R436 PolarHBondContact O-N 3.26Å; L434-C437 WeakPolarHBondContact O-CB 3.46Å; L434-C437 PolarHBondContact O-N 3.16Å; L434-Y438 HydrophobicContact CD1-CE1 4.12Å; L434-Y438 HydrophobicContact CD1-CE2 4.05Å; L434-Y438 HydrophobicContact CD2-CE2 4Å; L434-Y438 HydrophobicContact CG-CD2 4.15Å; L434-Y438 HydrophobicContact CG-CE2 3.7Å; L434-Y438 PolarHBondContact O-N 3.39Å; L434-L450 HydrophobicContact CB-CD1 4.22Å; L434-L450 HydrophobicContact CD2-CD1 4.04Å; L434-L450 HydrophobicContact CD2-CD2 4.37Å; L434-L450 HydrophobicContact CG-CD1 3.99Å
435	A	98.4	Very high	97.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.2	-43.5	174.1	0	0	0	0	0	111.7	L431 Y438 I439 A447 L450 L463 L466	L431-A435 WeakPolarHBondContact O-CB 3.49Å; L431-A435 PolarHBondContact O-N 2.99Å; A435-Y438 PolarHBondContact O-N 3.43Å; A435-I439 VanDerWaalsContact O-CG1 3.29Å; A435-I439 WeakPolarHBondContact O-CG1 3.41Å; A435-I439 PolarHBondContact O-N 3.04Å; A435-A447 HydrophobicContact CB-CB 3.99Å; A435-L450 HydrophobicContact CB-CD1 4.05Å; A435-L463 HydrophobicContact CB-CD1 3.69Å; A435-L466 HydrophobicContact CB-CD2 4.41Å
436	R	98.2	Very high	97.6	Very high	81 Å²	81	49.9 Å²	49.9	31%	0.306	23%	0.228	S	C	.	.	H	α-helix	trans	-58.7	-47.7	173.4	176.8	169.7	-73.3	172.5	3.8	111.5	S432 W433 L434 Y438 I439 M440 L466 D470	S432-R436 PolarHBondContact O-N 3.42Å; W433-R436 WeakPolarHBondContact O-CB 3.42Å; W433-R436 PolarHBondContact O-N 3.24Å; L434-R436 VanDerWaalsContact C-N 3.32Å; L434-R436 PolarHBondContact O-N 3.26Å; R436-Y438 VanDerWaalsContact C-N 3.34Å; R436-Y438 PolarHBondContact O-N 3.01Å; R436-I439 PolarHBondContact O-N 3.11Å; R436-M440 HydrophobicContact CG-CE 4.31Å; R436-M440 HydrophobicContact CG-CG 4.21Å; R436-M440 WeakPolarHBondContact O-CB 3.44Å; R436-M440 WeakPolarHBondContact O-CG 3.44Å; R436-M440 PolarHBondContact O-N 3.32Å; R436-L466 HydrophobicContact CB-CD2 4.41Å; R436-D470 IonicContact CZ-OD2 3.21Å; R436-D470 IonicContact NE-OD2 2.73Å; R436-D470 PolarHBondContact NE-OD2 3.35Å; R436-D470 IonicContact NH2-OD2 3.57Å; R436-D470 PolarHBondContact NH2-OD2 3.3Å
437	C	98.4	Very high	97.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-56.2	-47.4	175.6	-79.6	0	0	0	0	111.9	E413 W433 L434 I439 M440 N441	E413-C437 HydrophobicContact CB-CB 4.09Å; W433-C437 PolarHBondContact O-N 3.41Å; L434-C437 WeakPolarHBondContact O-CB 3.46Å; L434-C437 PolarHBondContact O-N 3.16Å; C437-I439 PolarHBondContact O-N 3.5Å; C437-M440 PolarHBondContact O-N 2.9Å; C437-N441 VanDerWaalsContact O-CB 3.28Å; C437-N441 WeakPolarHBondContact O-CB 3.31Å; C437-N441 VanDerWaalsContact O-CG 3.24Å; C437-N441 PolarHBondContact O-N 3.34Å; C437-N441 PolarHBondContact O-ND2 2.93Å
438	Y	98.6	Very high	97.9	Very high	24 Å²	24	41.9 Å²	41.9	9%	0.094	18%	0.184	C	C	.	.	H	α-helix	trans	-59.3	-43.7	177.1	-73.8	-32.9	0	0	0	113.3	E413 L434 A435 R436 N441 K442 K443 L446 L450	E413-Y438 HydrophobicContact CG-CD1 4.06Å; E413-Y438 HydrophobicContact CG-CE1 3.8Å; E413-Y438 WeakPolarHBondContact OE1-CE1 3.38Å; L434-Y438 HydrophobicContact CD1-CE1 4.12Å; L434-Y438 HydrophobicContact CD1-CE2 4.05Å; L434-Y438 HydrophobicContact CD2-CE2 4Å; L434-Y438 HydrophobicContact CG-CD2 4.15Å; L434-Y438 HydrophobicContact CG-CE2 3.7Å; L434-Y438 PolarHBondContact O-N 3.39Å; A435-Y438 PolarHBondContact O-N 3.43Å; R436-Y438 VanDerWaalsContact C-N 3.34Å; R436-Y438 PolarHBondContact O-N 3.01Å; Y438-N441 CarbonylContact O-C 3.58Å; Y438-N441 PolarHBondContact O-N 3.44Å; Y438-K442 PolarHBondContact O-N 3.03Å; Y438-K443 HydrophobicContact CD1-CD 4.37Å; Y438-K443 CarbonylContact O-C 3.5Å; Y438-K443 WeakPolarHBondContact O-CA 3.41Å; Y438-K443 PolarHBondContact O-N 3.48Å; Y438-L446 HydrophobicContact CD1-CB 4.05Å; Y438-L446 HydrophobicContact CD1-CD1 3.85Å; Y438-L446 HydrophobicContact CD2-CB 3.48Å; Y438-L446 VanDerWaalsContact CD2-CB 3.48Å; Y438-L446 HydrophobicContact CE1-CB 4.18Å; Y438-L446 HydrophobicContact CE1-CD1 3.62Å; Y438-L446 HydrophobicContact CE2-CB 3.61Å; Y438-L446 HydrophobicContact CE2-CD1 4.46Å; Y438-L446 HydrophobicContact CG-CB 3.71Å; Y438-L446 HydrophobicContact CG-CD1 4.38Å; Y438-L450 HydrophobicContact CD2-CD1 3.96Å; Y438-L450 HydrophobicContact CE2-CD1 3.86Å; Y438-L450 HydrophobicContact CE2-CG 4.23Å
439	I	98.4	Very high	98	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.9	-46.9	178.4	-67	166.4	0	0	0	110.3	A435 R436 C437 N441 K442 A447 L466 I467 D470 M474 Q476	A435-I439 VanDerWaalsContact O-CG1 3.29Å; A435-I439 WeakPolarHBondContact O-CG1 3.41Å; A435-I439 PolarHBondContact O-N 3.04Å; R436-I439 PolarHBondContact O-N 3.11Å; C437-I439 PolarHBondContact O-N 3.5Å; I439-N441 VanDerWaalsContact C-N 3.27Å; I439-N441 PolarHBondContact O-N 3.3Å; I439-K442 PolarHBondContact O-N 2.99Å; I439-K442 VanDerWaalsContact O-N 3.09Å; I439-A447 HydrophobicContact CD1-CB 4.08Å; I439-A447 HydrophobicContact CG1-CB 3.77Å; I439-L466 HydrophobicContact CD1-CD2 4.16Å; I439-I467 HydrophobicContact CD1-CB 4.37Å; I439-I467 HydrophobicContact CD1-CG1 4.19Å; I439-I467 HydrophobicContact CD1-CG2 4.47Å; I439-D470 HydrophobicContact CD1-CB 4.04Å; I439-D470 HydrophobicContact CG2-CB 4.02Å; I439-M474 HydrophobicContact CG2-CB 4.29Å; I439-M474 HydrophobicContact CG2-CG 3.97Å; I439-Q476 PolarHBondContact O-NE2 3.32Å
440	M	97.7	Very high	98	Very high	60 Å²	60	40.2 Å²	40.2	30%	0.296	18%	0.177	S	C	.	.	H	α-helix	trans	-63.5	-34.5	178.8	-63.8	-62.9	-178.9	0	0	112	T409 R436 C437 K442 M474	T409-M440 HydrophobicContact CG2-CB 3.74Å; T409-M440 HydrophobicContact CG2-CG 3.99Å; R436-M440 HydrophobicContact CG-CE 4.31Å; R436-M440 HydrophobicContact CG-CG 4.21Å; R436-M440 WeakPolarHBondContact O-CB 3.44Å; R436-M440 WeakPolarHBondContact O-CG 3.44Å; R436-M440 PolarHBondContact O-N 3.32Å; C437-M440 PolarHBondContact O-N 2.9Å; M440-K442 PolarHBondContact O-N 3.22Å; M440-M474 HydrophobicContact SD-CE 4.23Å; M440-M474 HydrophobicContact SD-CG 3.88Å; M440-M474 HydrophobicContact SD-SD 3.54Å
441	N	97.8	Very high	98	Very high	35 Å²	35	41.4 Å²	41.4	19%	0.187	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	15.7	176.1	-65.3	-25.8	0	0	0	113.9	T409 S410 E413 C437 Y438 I439 K443	T409-N441 PolarHBondContact O-ND2 2.92Å; T409-N441 PolarHBondContact OG1-OD1 3.01Å; S410-N441 PolarHBondContact N-OD1 3.45Å; E413-N441 PolarHBondContact OE2-ND2 2.91Å; C437-N441 VanDerWaalsContact O-CB 3.28Å; C437-N441 WeakPolarHBondContact O-CB 3.31Å; C437-N441 VanDerWaalsContact O-CG 3.24Å; C437-N441 PolarHBondContact O-N 3.34Å; C437-N441 PolarHBondContact O-ND2 2.93Å; Y438-N441 CarbonylContact O-C 3.58Å; Y438-N441 PolarHBondContact O-N 3.44Å; I439-N441 VanDerWaalsContact C-N 3.27Å; I439-N441 PolarHBondContact O-N 3.3Å; N441-K443 VanDerWaalsContact C-N 3.3Å; N441-K443 PolarHBondContact O-N 3.26Å
442	K	97.2	Very high	97.9	Very high	170 Å²	170	45.8 Å²	45.8	74%	0.739	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	31.6	177.6	-54.1	178.8	-178.5	174.4	0	114.6	Y438 I439 M440 P444	Y438-K442 PolarHBondContact O-N 3.03Å; I439-K442 PolarHBondContact O-N 2.99Å; I439-K442 VanDerWaalsContact O-N 3.09Å; M440-K442 PolarHBondContact O-N 3.22Å; K442-P444 WeakPolarHBondContact O-CD 3.48Å
443	K	97.8	Very high	97.7	Very high	84 Å²	84	53.3 Å²	53.3	37%	0.365	24%	0.236	S	C	.	.			trans	-118.7	50.3	176.5	-57.8	168.6	-169.7	161	0	112	E413 Y438 N441 R445 L446	E413-K443 IonicContact OE1-NZ 2.58Å; E413-K443 PolarHBondContact OE1-NZ 2.88Å; E413-K443 IonicContact OE2-NZ 3.65Å; E413-K443 PolarHBondContact OE2-NZ 3.05Å; Y438-K443 HydrophobicContact CD1-CD 4.37Å; Y438-K443 CarbonylContact O-C 3.5Å; Y438-K443 WeakPolarHBondContact O-CA 3.41Å; Y438-K443 PolarHBondContact O-N 3.48Å; N441-K443 VanDerWaalsContact C-N 3.3Å; N441-K443 PolarHBondContact O-N 3.26Å; K443-R445 PolarHBondContact O-N 2.94Å; K443-L446 HydrophobicContact CB-CD1 3.99Å; K443-L446 HydrophobicContact CB-CG 4.25Å; K443-L446 HydrophobicContact CD-CD1 3.91Å; K443-L446 HydrophobicContact CG-CD1 4.44Å; K443-L446 PolarHBondContact O-N 3.49Å
444	P	97.5	Very high	97.6	Very high	14 Å²	14	52.6 Å²	52.6	9%	0.091	24%	0.235	C	C	.	.	H	α-helix	trans	-60.3	-24.9	-175.3	24.6	-34.4	0	0	0	114	K442 L446 A447 W448 Q476 Y479	K442-P444 WeakPolarHBondContact O-CD 3.48Å; P444-L446 VanDerWaalsContact C-N 3.26Å; P444-L446 PolarHBondContact O-N 3.31Å; P444-A447 PolarHBondContact O-N 3.4Å; P444-W448 PolarHBondContact O-N 3.43Å; P444-Q476 VanDerWaalsContact CD-OE1 3.25Å; P444-Q476 HydrophobicContact CG-CB 4.24Å; P444-Q476 HydrophobicContact CG-CG 4.28Å; P444-Y479 HydrophobicContact CB-CD2 3.52Å; P444-Y479 HydrophobicContact CB-CE2 4.15Å; P444-Y479 HydrophobicContact CB-CG 3.79Å; P444-Y479 HydrophobicContact CG-CD2 3.43Å; P444-Y479 VanDerWaalsContact CG-CD2 3.43Å; P444-Y479 HydrophobicContact CG-CE2 3.79Å; P444-Y479 HydrophobicContact CG-CG 4.23Å
445	R	98	Very high	97.3	Very high	130 Å²	130	60.6 Å²	60.6	49%	0.491	27%	0.272	S	S	.	.	H	α-helix	trans	-54.5	-43.1	172.2	-173.2	178.6	61.3	83.5	0.6	112.1	K443 W448 E449 Y479	K443-R445 PolarHBondContact O-N 2.94Å; R445-W448 WeakPolarHBondContact O-CB 3.37Å; R445-W448 PolarHBondContact O-N 3.19Å; R445-E449 IonicContact CZ-OE1 3.53Å; R445-E449 IonicContact NH1-OE1 2.67Å; R445-E449 PolarHBondContact NH1-OE1 3.03Å; R445-E449 IonicContact NH1-OE2 3.56Å; R445-E449 WeakPolarHBondContact O-CG 3.37Å; R445-E449 PolarHBondContact O-N 2.67Å; R445-Y479 HydrophobicContact CB-CE1 4.36Å; R445-Y479 HydrophobicContact CB-CE2 4.38Å; R445-Y479 VanDerWaalsContact CB-OH 3.24Å; R445-Y479 WeakPolarHBondContact CB-OH 3.5Å; R445-Y479 WeakPolarHBondContact CG-OH 3.44Å
446	L	98.2	Very high	97	Very high	40 Å²	40	66.9 Å²	66.9	21%	0.209	31%	0.311	C	S	.	.	H	α-helix	trans	-70	-38.3	-179.2	-61.1	-179.2	0	0	0	111.2	Y438 K443 P444 W448 E449 L450	Y438-L446 HydrophobicContact CD1-CB 4.05Å; Y438-L446 HydrophobicContact CD1-CD1 3.85Å; Y438-L446 HydrophobicContact CD2-CB 3.48Å; Y438-L446 VanDerWaalsContact CD2-CB 3.48Å; Y438-L446 HydrophobicContact CE1-CB 4.18Å; Y438-L446 HydrophobicContact CE1-CD1 3.62Å; Y438-L446 HydrophobicContact CE2-CB 3.61Å; Y438-L446 HydrophobicContact CE2-CD1 4.46Å; Y438-L446 HydrophobicContact CG-CB 3.71Å; Y438-L446 HydrophobicContact CG-CD1 4.38Å; K443-L446 HydrophobicContact CB-CD1 3.99Å; K443-L446 HydrophobicContact CB-CG 4.25Å; K443-L446 HydrophobicContact CD-CD1 3.91Å; K443-L446 HydrophobicContact CG-CD1 4.44Å; K443-L446 PolarHBondContact O-N 3.49Å; P444-L446 VanDerWaalsContact C-N 3.26Å; P444-L446 PolarHBondContact O-N 3.31Å; L446-W448 VanDerWaalsContact C-N 3.31Å; L446-W448 PolarHBondContact O-N 3.44Å; L446-E449 WeakPolarHBondContact O-CB 3.4Å; L446-E449 PolarHBondContact O-N 3.19Å; L446-L450 WeakPolarHBondContact O-CG 3.41Å; L446-L450 PolarHBondContact O-N 3.45Å
447	A	98.1	Very high	96.8	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.7	-40.8	172.2	0	0	0	0	0	111.7	A435 I439 P444 E449 L450 Y451 I467	A435-A447 HydrophobicContact CB-CB 3.99Å; I439-A447 HydrophobicContact CD1-CB 4.08Å; I439-A447 HydrophobicContact CG1-CB 3.77Å; P444-A447 PolarHBondContact O-N 3.4Å; A447-E449 VanDerWaalsContact C-N 3.34Å; A447-E449 PolarHBondContact O-N 3.48Å; A447-L450 WeakPolarHBondContact O-CB 3.47Å; A447-L450 PolarHBondContact O-N 3Å; A447-Y451 PolarHBondContact O-N 2.83Å; A447-I467 HydrophobicContact CB-CD1 4.48Å; A447-I467 HydrophobicContact CB-CG1 4.35Å; A447-I467 WeakPolarHBondContact O-CD1 3.44Å
448	W	98.2	Very high	96.6	Very high	25 Å²	25	68 Å²	68	10%	0.095	34%	0.34	C	S	.	.	H	α-helix	trans	-63.2	-39.2	174	-171	-96.1	0	0	0	112.4	P444 R445 L446 L450 Y451 L452 L464 I467 Y479 K482 A483 V486	P444-W448 PolarHBondContact O-N 3.43Å; R445-W448 WeakPolarHBondContact O-CB 3.37Å; R445-W448 PolarHBondContact O-N 3.19Å; L446-W448 VanDerWaalsContact C-N 3.31Å; L446-W448 PolarHBondContact O-N 3.44Å; W448-L450 VanDerWaalsContact C-N 3.33Å; W448-L450 PolarHBondContact O-N 2.92Å; W448-Y451 HydrophobicContact CH2-CD1 4.36Å; W448-Y451 HydrophobicContact CH2-CE1 4.29Å; W448-Y451 HydrophobicContact CZ2-CD1 4.38Å; W448-Y451 HydrophobicContact CZ2-CE1 4.37Å; W448-Y451 HydrophobicContact CZ3-CD1 4.41Å; W448-Y451 WeakPolarHBondContact O-CB 3.33Å; W448-Y451 PolarHBondContact O-N 3.41Å; W448-L452 WeakPolarHBondContact O-CG 3.49Å; W448-L452 PolarHBondContact O-N 3.24Å; W448-L464 HydrophobicContact CH2-CD1 4.11Å; W448-L464 HydrophobicContact CZ3-CD1 3.73Å; W448-I467 HydrophobicContact CE3-CG2 4.31Å; W448-Y479 HydrophobicContact CB-CD1 3.71Å; W448-Y479 HydrophobicContact CB-CE1 3.76Å; W448-Y479 HydrophobicContact CD2-CD1 4.2Å; W448-Y479 HydrophobicContact CE3-CD1 4.39Å; W448-Y479 AromaticContact CG-CD1 3.91Å; W448-Y479 HydrophobicContact CG-CD1 3.91Å; W448-Y479 AromaticContact CG-CE1 3.96Å; W448-Y479 HydrophobicContact CG-CE1 3.96Å; W448-K482 HydrophobicContact CH2-CB 3.9Å; W448-K482 HydrophobicContact CZ2-CB 4.3Å; W448-K482 HydrophobicContact CZ3-CB 4.16Å; W448-A483 HydrophobicContact CZ3-CB 3.87Å; W448-V486 HydrophobicContact CH2-CG2 4.12Å
449	E	97.9	Very high	96.5	Very high	66 Å²	66	71.3 Å²	71.3	31%	0.308	36%	0.357	S	S	.	.	H	α-helix	trans	-65.4	-32.6	175.2	-76.9	170.7	-165.8	0	0	113.3	R445 L446 A447 L452 K453	R445-E449 IonicContact CZ-OE1 3.53Å; R445-E449 IonicContact NH1-OE1 2.67Å; R445-E449 PolarHBondContact NH1-OE1 3.03Å; R445-E449 IonicContact NH1-OE2 3.56Å; R445-E449 WeakPolarHBondContact O-CG 3.37Å; R445-E449 PolarHBondContact O-N 2.67Å; L446-E449 WeakPolarHBondContact O-CB 3.4Å; L446-E449 PolarHBondContact O-N 3.19Å; A447-E449 VanDerWaalsContact C-N 3.34Å; A447-E449 PolarHBondContact O-N 3.48Å; E449-L452 PolarHBondContact O-N 3.05Å; E449-K453 WeakPolarHBondContact O-CG 3.42Å; E449-K453 PolarHBondContact O-N 3.4Å
450	L	97	Very high	96.4	Very high	19 Å²	19	71.6 Å²	71.6	10%	0.099	36%	0.359	C	S	.	.	H	α-helix	trans	-61.6	-47.9	171.2	-66	178.4	0	0	0	110.6	L431 L434 A435 Y438 L446 A447 W448 L452 K453	L431-L450 HydrophobicContact CD2-CD2 4.06Å; L434-L450 HydrophobicContact CB-CD1 4.22Å; L434-L450 HydrophobicContact CD2-CD1 4.04Å; L434-L450 HydrophobicContact CD2-CD2 4.37Å; L434-L450 HydrophobicContact CG-CD1 3.99Å; A435-L450 HydrophobicContact CB-CD1 4.05Å; Y438-L450 HydrophobicContact CD2-CD1 3.96Å; Y438-L450 HydrophobicContact CE2-CD1 3.86Å; Y438-L450 HydrophobicContact CE2-CG 4.23Å; L446-L450 WeakPolarHBondContact O-CG 3.41Å; L446-L450 PolarHBondContact O-N 3.45Å; A447-L450 WeakPolarHBondContact O-CB 3.47Å; A447-L450 PolarHBondContact O-N 3Å; W448-L450 VanDerWaalsContact C-N 3.33Å; W448-L450 PolarHBondContact O-N 2.92Å; L450-L452 PolarHBondContact O-N 3.32Å; L450-K453 PolarHBondContact O-N 3Å
451	Y	97.1	Very high	96.3	Very high	36 Å²	36	71 Å²	71	14%	0.141	36%	0.355	C	S	.	.	H	α-helix	trans	-58.7	-44.7	175.9	165.4	-103.5	0	0	0	112.4	A447 W448 K453 M454 L464	A447-Y451 PolarHBondContact O-N 2.83Å; W448-Y451 HydrophobicContact CH2-CD1 4.36Å; W448-Y451 HydrophobicContact CH2-CE1 4.29Å; W448-Y451 HydrophobicContact CZ2-CD1 4.38Å; W448-Y451 HydrophobicContact CZ2-CE1 4.37Å; W448-Y451 HydrophobicContact CZ3-CD1 4.41Å; W448-Y451 WeakPolarHBondContact O-CB 3.33Å; W448-Y451 PolarHBondContact O-N 3.41Å; Y451-K453 PolarHBondContact O-N 2.97Å; Y451-K453 VanDerWaalsContact O-N 3.16Å; Y451-M454 WeakPolarHBondContact O-CB 3.35Å; Y451-M454 PolarHBondContact O-N 3.38Å; Y451-L464 HydrophobicContact CD1-CD1 4.18Å; Y451-L464 HydrophobicContact CD2-CB 4.25Å; Y451-L464 HydrophobicContact CD2-CD1 4.23Å; Y451-L464 HydrophobicContact CE1-CD1 4.03Å; Y451-L464 HydrophobicContact CE2-CB 4.09Å; Y451-L464 HydrophobicContact CE2-CD1 4.09Å; Y451-L464 HydrophobicContact CE2-CD2 4.3Å; Y451-L464 HydrophobicContact CE2-CG 4.41Å; Y451-L464 HydrophobicContact CG-CD1 4.28Å
452	L	96.4	Very high	96.3	Very high	111 Å²	111	71.3 Å²	71.3	58%	0.581	36%	0.359	S	S	*	.	H	α-helix	trans	-63.5	-20.6	179.9	-70.9	179.2	0	0	0	114.2	W448 E449 L450	W448-L452 WeakPolarHBondContact O-CG 3.49Å; W448-L452 PolarHBondContact O-N 3.24Å; E449-L452 PolarHBondContact O-N 3.05Å; L450-L452 PolarHBondContact O-N 3.32Å
453	K	95.2	Very high	96.3	Very high	168 Å²	168	63.2 Å²	63.2	73%	0.73	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-12	176	-69.7	171.1	-175.8	179.3	0	112.9	E449 L450 Y451	E449-K453 WeakPolarHBondContact O-CG 3.42Å; E449-K453 PolarHBondContact O-N 3.4Å; L450-K453 PolarHBondContact O-N 3Å; Y451-K453 PolarHBondContact O-N 2.97Å; Y451-K453 VanDerWaalsContact O-N 3.16Å
454	M	94.7	Very high	96.3	Very high	37 Å²	37	59.2 Å²	59.2	18%	0.182	31%	0.307	C	S	.	.	S	Bend	trans	-83	144.9	178.4	-63.9	-175.9	75.5	0	0	111.3	L431 Y451 E459 L463	L431-M454 HydrophobicContact CD1-CE 4.12Å; L431-M454 HydrophobicContact CD1-CG 4.11Å; L431-M454 HydrophobicContact CD1-SD 3.97Å; Y451-M454 WeakPolarHBondContact O-CB 3.35Å; Y451-M454 PolarHBondContact O-N 3.38Å; M454-E459 HydrophobicContact CE-CB 3.85Å; M454-L463 HydrophobicContact SD-CB 4.22Å; M454-L463 HydrophobicContact SD-CD2 3.37Å; M454-L463 WeakPolarHBondContact SD-CD2 3.34Å; M454-L463 HydrophobicContact SD-CG 4.42Å
455	E	92.6	Very high	96.3	Very high	172 Å²	172	61.6 Å²	61.6	80%	0.804	32%	0.317	S	S	*	.			trans	-70.8	158.2	165.7	-63.5	-175.2	173.2	0	0	110.7	S457 S460	E455-S457 PolarHBondContact O-N 3.07Å; E455-S460 VanDerWaalsContact O-CB 3.26Å; E455-S460 WeakPolarHBondContact O-CB 3.43Å; E455-S460 PolarHBondContact O-OG 3.19Å
456	T	91.7	Very high	96.3	Very high	133 Å²	133	56.5 Å²	56.5	82%	0.816	30%	0.299	S	S	*	.	S	Bend	trans	-68	105.5	178.2	-57.6	0	0	0	0	110.2
457	S	93.7	Very high	96.3	Very high	47 Å²	47	54.6 Å²	54.6	33%	0.329	29%	0.289	S	S	.	.	S	Bend	trans	-146.2	169.9	-177.9	74.4	0	0	0	0	111.9	E455 E459 S460 F461	E455-S457 PolarHBondContact O-N 3.07Å; S457-E459 PolarHBondContact O-N 3.03Å; S457-E459 PolarHBondContact OG-N 3.32Å; S457-S460 PolarHBondContact N-OG 3.44Å; S457-S460 PolarHBondContact O-N 3.12Å; S457-S460 VanDerWaalsContact O-N 3.15Å; S457-S460 PolarHBondContact O-OG 3.36Å; S457-S460 PolarHBondContact OG-N 3.06Å; S457-S460 VanDerWaalsContact OG-N 3.17Å; S457-F461 PolarHBondContact O-N 2.95Å
458	G	94.7	Very high	96.3	Very high	57 Å²	57	54.6 Å²	54.6	59%	0.588	29%	0.289	S	S	*	.	H	α-helix	trans	-59.8	-29.9	173.3	0	0	0	0	0	113.4	S462	G458-S462 WeakPolarHBondContact O-CB 3.46Å; G458-S462 PolarHBondContact O-N 3.43Å; G458-S462 PolarHBondContact O-OG 3.28Å
459	E	95.9	Very high	96.3	Very high	94 Å²	94	56.9 Å²	56.9	44%	0.439	30%	0.303	S	S	.	.	H	α-helix	trans	-71.5	-42.3	174.9	-64.5	178.4	146.6	0	0	111.4	Y428 M454 S457 F461 S462 L463	Y428-E459 VanDerWaalsContact CB-CD 3.5Å; Y428-E459 WeakPolarHBondContact CB-OE1 3.47Å; Y428-E459 HydrophobicContact CD2-CB 3.7Å; Y428-E459 HydrophobicContact CD2-CG 4.25Å; Y428-E459 HydrophobicContact CE2-CB 4.44Å; Y428-E459 WeakPolarHBondContact CE2-O 3.45Å; Y428-E459 HydrophobicContact CG-CB 3.94Å; Y428-E459 HydrophobicContact CG-CG 3.98Å; M454-E459 HydrophobicContact CE-CB 3.85Å; S457-E459 PolarHBondContact O-N 3.03Å; S457-E459 PolarHBondContact OG-N 3.32Å; E459-F461 VanDerWaalsContact C-N 3.26Å; E459-F461 PolarHBondContact O-N 3.25Å; E459-S462 PolarHBondContact O-N 2.81Å; E459-L463 PolarHBondContact O-N 3.43Å
460	S	96	Very high	96.3	Very high	6 Å²	6	54.1 Å²	54.1	4%	0.042	29%	0.29	C	S	.	.	H	α-helix	trans	-61.6	-37.2	175.1	77	0	0	0	0	111.7	E455 S457 L464	E455-S460 VanDerWaalsContact O-CB 3.26Å; E455-S460 WeakPolarHBondContact O-CB 3.43Å; E455-S460 PolarHBondContact O-OG 3.19Å; S457-S460 PolarHBondContact N-OG 3.44Å; S457-S460 PolarHBondContact O-N 3.12Å; S457-S460 VanDerWaalsContact O-N 3.15Å; S457-S460 PolarHBondContact O-OG 3.36Å; S457-S460 PolarHBondContact OG-N 3.06Å; S457-S460 VanDerWaalsContact OG-N 3.17Å; S460-L464 WeakPolarHBondContact O-CB 3.46Å; S460-L464 PolarHBondContact O-N 3.19Å
461	F	96.7	Very high	96.4	Very high	48 Å²	48	53.2 Å²	53.2	21%	0.211	29%	0.286	C	S	.	.	H	α-helix	trans	-66.5	-44.1	174.4	-174.9	-92.5	0	0	0	111.5	S457 E459 L463 L464 Q465 L487 L490 D491 Y496	S457-F461 PolarHBondContact O-N 2.95Å; E459-F461 VanDerWaalsContact C-N 3.26Å; E459-F461 PolarHBondContact O-N 3.25Å; F461-L463 PolarHBondContact O-N 3.46Å; F461-L464 WeakPolarHBondContact O-CB 3.04Å; F461-L464 PolarHBondContact O-N 3.16Å; F461-Q465 HydrophobicContact CD1-CG 4.32Å; F461-Q465 HydrophobicContact CE1-CG 4.1Å; F461-Q465 VanDerWaalsContact CE1-NE2 3.33Å; F461-Q465 PolarHBondContact O-N 3.29Å; F461-L487 HydrophobicContact CD2-CD2 3.89Å; F461-L487 HydrophobicContact CE1-CD2 4.37Å; F461-L487 HydrophobicContact CE2-CD2 3.58Å; F461-L487 HydrophobicContact CG-CD2 4.41Å; F461-L487 HydrophobicContact CZ-CD2 3.86Å; F461-L490 HydrophobicContact CD2-CB 4.34Å; F461-L490 HydrophobicContact CD2-CD1 4.11Å; F461-L490 HydrophobicContact CE2-CB 4.13Å; F461-D491 HydrophobicContact CE2-CB 4.09Å; F461-D491 HydrophobicContact CZ-CB 4.03Å; F461-Y496 HydrophobicContact CZ-CE2 4.27Å; F461-Y496 WeakPolarHBondContact CZ-OH 3.48Å
462	S	97.5	Very high	96.4	Very high	41 Å²	41	56.2 Å²	56.2	29%	0.287	30%	0.297	S	S	.	.	H	α-helix	trans	-63.2	-40.3	176.3	-57.2	0	0	0	0	112.1	Y428 G458 E459 L464 Q465 L466	Y428-S462 VanDerWaalsContact OH-CB 3.25Å; Y428-S462 WeakPolarHBondContact OH-CB 3.43Å; G458-S462 WeakPolarHBondContact O-CB 3.46Å; G458-S462 PolarHBondContact O-N 3.43Å; G458-S462 PolarHBondContact O-OG 3.28Å; E459-S462 PolarHBondContact O-N 2.81Å; S462-L464 VanDerWaalsContact C-N 3.34Å; S462-L464 PolarHBondContact O-N 2.98Å; S462-Q465 PolarHBondContact O-N 3.36Å; S462-L466 PolarHBondContact O-N 3.33Å
463	L	97.8	Very high	96.4	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-41.2	174	-176.7	62.5	0	0	0	111.2	Y428 A435 M454 E459 F461 L466 I467	Y428-L463 HydrophobicContact CE2-CB 4.23Å; A435-L463 HydrophobicContact CB-CD1 3.69Å; M454-L463 HydrophobicContact SD-CB 4.22Å; M454-L463 HydrophobicContact SD-CD2 3.37Å; M454-L463 WeakPolarHBondContact SD-CD2 3.34Å; M454-L463 HydrophobicContact SD-CG 4.42Å; E459-L463 PolarHBondContact O-N 3.43Å; F461-L463 PolarHBondContact O-N 3.46Å; L463-L466 WeakPolarHBondContact O-CB 3.37Å; L463-L466 PolarHBondContact O-N 2.91Å; L463-I467 HydrophobicContact CD1-CD1 4.49Å; L463-I467 HydrophobicContact CG-CD1 4.01Å; L463-I467 HydrophobicContact CG-CG1 4.47Å; L463-I467 WeakPolarHBondContact O-CG1 3.37Å; L463-I467 PolarHBondContact O-N 3.35Å
464	L	97.6	Very high	96.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.8	-40.5	177.7	-170	67	0	0	0	112	W448 Y451 S460 F461 S462 L466 I467 A468 A483 V486 L487 L490	W448-L464 HydrophobicContact CH2-CD1 4.11Å; W448-L464 HydrophobicContact CZ3-CD1 3.73Å; Y451-L464 HydrophobicContact CD1-CD1 4.18Å; Y451-L464 HydrophobicContact CD2-CB 4.25Å; Y451-L464 HydrophobicContact CD2-CD1 4.23Å; Y451-L464 HydrophobicContact CE1-CD1 4.03Å; Y451-L464 HydrophobicContact CE2-CB 4.09Å; Y451-L464 HydrophobicContact CE2-CD1 4.09Å; Y451-L464 HydrophobicContact CE2-CD2 4.3Å; Y451-L464 HydrophobicContact CE2-CG 4.41Å; Y451-L464 HydrophobicContact CG-CD1 4.28Å; S460-L464 WeakPolarHBondContact O-CB 3.46Å; S460-L464 PolarHBondContact O-N 3.19Å; F461-L464 WeakPolarHBondContact O-CB 3.04Å; F461-L464 PolarHBondContact O-N 3.16Å; S462-L464 VanDerWaalsContact C-N 3.34Å; S462-L464 PolarHBondContact O-N 2.98Å; L464-L466 VanDerWaalsContact C-N 3.35Å; L464-I467 PolarHBondContact O-N 3.39Å; L464-A468 WeakPolarHBondContact O-CB 3.21Å; L464-A468 PolarHBondContact O-N 3.32Å; L464-A483 HydrophobicContact CD1-CB 3.79Å; L464-A483 HydrophobicContact CG-CB 4.34Å; L464-V486 HydrophobicContact CD2-CB 3.73Å; L464-V486 HydrophobicContact CD2-CG1 3.46Å; L464-V486 VanDerWaalsContact CD2-CG1 3.46Å; L464-L487 HydrophobicContact CB-CD2 4.1Å; L464-L487 HydrophobicContact CB-CG 4.47Å; L464-L487 HydrophobicContact CD2-CD2 3.66Å; L464-L487 HydrophobicContact CD2-CG 3.64Å; L464-L487 HydrophobicContact CG-CD1 4.35Å; L464-L487 HydrophobicContact CG-CD2 3.91Å; L464-L487 HydrophobicContact CG-CG 3.79Å; L464-L490 HydrophobicContact CD2-CD1 4.32Å
465	Q	97.8	Very high	96.5	Very high	64 Å²	64	53.5 Å²	53.5	30%	0.299	29%	0.29	S	S	.	.	H	α-helix	trans	-60.3	-42.9	171.3	-72.5	-177.1	-31.6	0	0	111.9	F461 S462 A468 N469 L487 Y496	F461-Q465 HydrophobicContact CD1-CG 4.32Å; F461-Q465 HydrophobicContact CE1-CG 4.1Å; F461-Q465 VanDerWaalsContact CE1-NE2 3.33Å; F461-Q465 PolarHBondContact O-N 3.29Å; S462-Q465 PolarHBondContact O-N 3.36Å; Q465-A468 PolarHBondContact O-N 2.96Å; Q465-N469 WeakPolarHBondContact O-CB 3.47Å; Q465-N469 PolarHBondContact O-N 2.9Å; Q465-N469 VanDerWaalsContact O-N 3.11Å; Q465-N469 PolarHBondContact O-ND2 3.1Å; Q465-L487 HydrophobicContact CG-CD1 4.14Å; Q465-L487 HydrophobicContact CG-CD2 3.72Å; Q465-Y496 PolarHBondContact NE2-OH 3.23Å
466	L	98.1	Very high	96.8	Very high	23 Å²	23	46.6 Å²	46.6	12%	0.12	26%	0.258	C	S	.	.	H	α-helix	trans	-60.6	-50.3	175.3	-177.3	156.3	0	0	0	110.8	A435 R436 I439 S462 L463 L464 A468 N469 D470	A435-L466 HydrophobicContact CB-CD2 4.41Å; R436-L466 HydrophobicContact CB-CD2 4.41Å; I439-L466 HydrophobicContact CD1-CD2 4.16Å; S462-L466 PolarHBondContact O-N 3.33Å; L463-L466 WeakPolarHBondContact O-CB 3.37Å; L463-L466 PolarHBondContact O-N 2.91Å; L464-L466 VanDerWaalsContact C-N 3.35Å; L466-A468 VanDerWaalsContact C-N 3.34Å; L466-A468 PolarHBondContact O-N 3.36Å; L466-N469 PolarHBondContact O-N 3.27Å; L466-D470 WeakPolarHBondContact O-CB 3.33Å; L466-D470 PolarHBondContact O-N 3.2Å
467	I	98.5	Very high	97	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.9	-47	179.6	-67.3	168.4	0	0	0	110.5	I439 A447 W448 L463 L464 N469 C471 A483	I439-I467 HydrophobicContact CD1-CB 4.37Å; I439-I467 HydrophobicContact CD1-CG1 4.19Å; I439-I467 HydrophobicContact CD1-CG2 4.47Å; A447-I467 HydrophobicContact CB-CD1 4.48Å; A447-I467 HydrophobicContact CB-CG1 4.35Å; A447-I467 WeakPolarHBondContact O-CD1 3.44Å; W448-I467 HydrophobicContact CE3-CG2 4.31Å; L463-I467 HydrophobicContact CD1-CD1 4.49Å; L463-I467 HydrophobicContact CG-CD1 4.01Å; L463-I467 HydrophobicContact CG-CG1 4.47Å; L463-I467 WeakPolarHBondContact O-CG1 3.37Å; L463-I467 PolarHBondContact O-N 3.35Å; L464-I467 PolarHBondContact O-N 3.39Å; I467-N469 PolarHBondContact O-N 3.11Å; I467-C471 WeakPolarHBondContact O-CB 3.34Å; I467-C471 PolarHBondContact O-N 3.22Å; I467-C471 PolarHBondContact O-SG 3.26Å; I467-A483 HydrophobicContact CG2-CB 4.21Å
468	A	98.2	Very high	97.2	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-56.1	-50.4	180	0	0	0	0	0	111.9	L464 Q465 L466 Y472 S480 A483 F484 L487	L464-A468 WeakPolarHBondContact O-CB 3.21Å; L464-A468 PolarHBondContact O-N 3.32Å; Q465-A468 PolarHBondContact O-N 2.96Å; L466-A468 VanDerWaalsContact C-N 3.34Å; L466-A468 PolarHBondContact O-N 3.36Å; A468-Y472 WeakPolarHBondContact O-CB 3.45Å; A468-Y472 PolarHBondContact O-N 3.01Å; A468-Y472 VanDerWaalsContact O-N 3.16Å; A468-S480 PolarHBondContact O-OG 3.33Å; A468-A483 HydrophobicContact CB-CB 3.59Å; A468-F484 HydrophobicContact CB-CD1 3.88Å; A468-F484 HydrophobicContact CB-CD2 4.06Å; A468-F484 HydrophobicContact CB-CE1 3.74Å; A468-F484 HydrophobicContact CB-CE2 3.93Å; A468-F484 HydrophobicContact CB-CG 4.03Å; A468-F484 HydrophobicContact CB-CZ 3.76Å; A468-L487 HydrophobicContact CB-CD1 3.79Å
469	N	98	Very high	97.3	Very high	73 Å²	73	41.4 Å²	41.4	39%	0.39	20%	0.2	S	C	.	.	H	α-helix	trans	-76	-46	-175.1	-75.7	-70	0	0	0	113.1	Q465 L466 I467 Y472 K473	Q465-N469 WeakPolarHBondContact O-CB 3.47Å; Q465-N469 PolarHBondContact O-N 2.9Å; Q465-N469 VanDerWaalsContact O-N 3.11Å; Q465-N469 PolarHBondContact O-ND2 3.1Å; L466-N469 PolarHBondContact O-N 3.27Å; I467-N469 PolarHBondContact O-N 3.11Å; N469-Y472 WeakPolarHBondContact O-CB 3.37Å; N469-Y472 PolarHBondContact O-N 2.84Å; N469-K473 WeakPolarHBondContact O-CG 3.36Å; N469-K473 PolarHBondContact O-N 2.87Å
470	D	97.9	Very high	97.4	Very high	7 Å²	7	37 Å²	37	4%	0.037	18%	0.179	C	C	.	.	H	α-helix	trans	-70.3	-37.6	-177.9	-75	-1.6	0	0	0	110.4	R436 I439 L466 Y472 K473 M474	R436-D470 IonicContact CZ-OD2 3.21Å; R436-D470 IonicContact NE-OD2 2.73Å; R436-D470 PolarHBondContact NE-OD2 3.35Å; R436-D470 IonicContact NH2-OD2 3.57Å; R436-D470 PolarHBondContact NH2-OD2 3.3Å; I439-D470 HydrophobicContact CD1-CB 4.04Å; I439-D470 HydrophobicContact CG2-CB 4.02Å; L466-D470 WeakPolarHBondContact O-CB 3.33Å; L466-D470 PolarHBondContact O-N 3.2Å; D470-Y472 VanDerWaalsContact C-N 3.34Å; D470-Y472 PolarHBondContact O-N 3.11Å; D470-K473 PolarHBondContact O-N 3.42Å; D470-K473 IonicContact OD1-NZ 3.43Å; D470-M474 WeakPolarHBondContact O-CB 3.24Å; D470-M474 WeakPolarHBondContact O-CG 3.38Å; D470-M474 PolarHBondContact O-N 3.22Å
471	C	98.3	Very high	97.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.3	-39.2	172.5	-70.9	0	0	0	0	111.8	I467 M474 G475 Q476	I467-C471 WeakPolarHBondContact O-CB 3.34Å; I467-C471 PolarHBondContact O-N 3.22Å; I467-C471 PolarHBondContact O-SG 3.26Å; C471-M474 PolarHBondContact O-N 3.02Å; C471-G475 PolarHBondContact O-N 2.93Å; C471-Q476 HydrophobicContact CB-CB 4.06Å; C471-Q476 WeakPolarHBondContact O-CA 3.36Å; C471-Q476 PolarHBondContact O-N 3.36Å
472	Y	98	Very high	97.5	Very high	99 Å²	99	36.8 Å²	36.8	39%	0.388	18%	0.178	S	C	.	.	H	α-helix	trans	-59.6	-50.2	176.1	-169.2	-87.7	0	0	0	111	A468 N469 D470 M474 G475 F477 S480 F484 A503	A468-Y472 WeakPolarHBondContact O-CB 3.45Å; A468-Y472 PolarHBondContact O-N 3.01Å; A468-Y472 VanDerWaalsContact O-N 3.16Å; N469-Y472 WeakPolarHBondContact O-CB 3.37Å; N469-Y472 PolarHBondContact O-N 2.84Å; D470-Y472 VanDerWaalsContact C-N 3.34Å; D470-Y472 PolarHBondContact O-N 3.11Å; Y472-M474 VanDerWaalsContact C-N 3.27Å; Y472-M474 PolarHBondContact O-N 2.97Å; Y472-G475 PolarHBondContact O-N 3.46Å; Y472-G475 VanDerWaalsContact O-N 3.07Å; Y472-F477 HydrophobicContact CD2-CD1 4.27Å; Y472-F477 HydrophobicContact CD2-CE1 4.38Å; Y472-F477 HydrophobicContact CE2-CD1 4.44Å; Y472-F477 HydrophobicContact CE2-CE1 4.35Å; Y472-S480 WeakPolarHBondContact CB-OG 3.14Å; Y472-F484 HydrophobicContact CD2-CE2 4.32Å; Y472-A503 HydrophobicContact CD2-CB 4.22Å; Y472-A503 HydrophobicContact CE2-CB 4.4Å
473	K	96.6	Very high	97.5	Very high	155 Å²	155	34.9 Å²	34.9	67%	0.674	16%	0.164	S	C	*	.	H	α-helix	trans	-59.2	-37.3	178.2	-71.4	171.7	-174	169.3	0	112.4	N469 D470 G475	N469-K473 WeakPolarHBondContact O-CG 3.36Å; N469-K473 PolarHBondContact O-N 2.87Å; D470-K473 PolarHBondContact O-N 3.42Å; D470-K473 IonicContact OD1-NZ 3.43Å; K473-G475 VanDerWaalsContact C-N 3.27Å; K473-G475 PolarHBondContact O-N 2.99Å
474	M	96.1	Very high	97.5	Very high	75 Å²	75	35.4 Å²	35.4	37%	0.369	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	3	179.2	-67.4	-58	-67.2	0	0	114.2	I439 M440 D470 C471 Y472 Q476	I439-M474 HydrophobicContact CG2-CB 4.29Å; I439-M474 HydrophobicContact CG2-CG 3.97Å; M440-M474 HydrophobicContact SD-CE 4.23Å; M440-M474 HydrophobicContact SD-CG 3.88Å; M440-M474 HydrophobicContact SD-SD 3.54Å; D470-M474 WeakPolarHBondContact O-CB 3.24Å; D470-M474 WeakPolarHBondContact O-CG 3.38Å; D470-M474 PolarHBondContact O-N 3.22Å; C471-M474 PolarHBondContact O-N 3.02Å; Y472-M474 VanDerWaalsContact C-N 3.27Å; Y472-M474 PolarHBondContact O-N 2.97Å; M474-Q476 HydrophobicContact CB-CG 4.2Å; M474-Q476 PolarHBondContact O-N 3.08Å
475	G	95.9	Very high	97.5	Very high	29 Å²	29	35.9 Å²	35.9	30%	0.299	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	17	-178.5	0	0	0	0	0	114.2	C471 Y472 K473 F477	C471-G475 PolarHBondContact O-N 2.93Å; Y472-G475 PolarHBondContact O-N 3.46Å; Y472-G475 VanDerWaalsContact O-N 3.07Å; K473-G475 VanDerWaalsContact C-N 3.27Å; K473-G475 PolarHBondContact O-N 2.99Å; G475-F477 WeakPolarHBondContact O-CD2 3.48Å; G475-F477 PolarHBondContact O-N 3.36Å; G475-F477 VanDerWaalsContact O-N 3.15Å
476	Q	96.9	Very high	97.4	Very high	28 Å²	28	33.9 Å²	33.9	13%	0.131	16%	0.161	C	C	.	.			trans	-91.2	59.7	-179.9	-64.2	168.9	19.4	0	0	109.7	I439 P444 C471 M474 Y478 Y479 S480	I439-Q476 PolarHBondContact O-NE2 3.32Å; P444-Q476 VanDerWaalsContact CD-OE1 3.25Å; P444-Q476 HydrophobicContact CG-CB 4.24Å; P444-Q476 HydrophobicContact CG-CG 4.28Å; C471-Q476 HydrophobicContact CB-CB 4.06Å; C471-Q476 WeakPolarHBondContact O-CA 3.36Å; C471-Q476 PolarHBondContact O-N 3.36Å; M474-Q476 HydrophobicContact CB-CG 4.2Å; M474-Q476 PolarHBondContact O-N 3.08Å; Q476-Y478 VanDerWaalsContact C-N 3.27Å; Q476-Y478 PolarHBondContact O-N 3.46Å; Q476-Y479 PolarHBondContact O-N 3.27Å; Q476-S480 PolarHBondContact O-N 2.96Å
477	F	97.8	Very high	97.3	Very high	37 Å²	37	32.8 Å²	32.8	16%	0.162	16%	0.155	C	C	.	.	H	α-helix	trans	-63.6	-27.9	-163.8	-59.1	-62.1	0	0	0	114.7	Y472 G475 S480 A481 A503 I507 M510	Y472-F477 HydrophobicContact CD2-CD1 4.27Å; Y472-F477 HydrophobicContact CD2-CE1 4.38Å; Y472-F477 HydrophobicContact CE2-CD1 4.44Å; Y472-F477 HydrophobicContact CE2-CE1 4.35Å; G475-F477 WeakPolarHBondContact O-CD2 3.48Å; G475-F477 PolarHBondContact O-N 3.36Å; G475-F477 VanDerWaalsContact O-N 3.15Å; F477-S480 PolarHBondContact O-N 2.91Å; F477-A481 WeakPolarHBondContact O-CB 3.15Å; F477-A481 PolarHBondContact O-N 3.4Å; F477-A503 WeakPolarHBondContact CB-O 3.21Å; F477-I507 HydrophobicContact CB-CG1 3.58Å; F477-M510 HydrophobicContact CD2-CG 4.03Å; F477-M510 HydrophobicContact CE2-CG 4.26Å
478	Y	96.7	Very high	97.2	Very high	47 Å²	47	34.2 Å²	34.2	18%	0.184	16%	0.162	C	C	.	.	H	α-helix	trans	-58.4	-53.8	178.6	177.6	-100.2	0	0	0	112.5	Q476 S480 A481 K482 T520 E523	Q476-Y478 VanDerWaalsContact C-N 3.27Å; Q476-Y478 PolarHBondContact O-N 3.46Å; Y478-S480 VanDerWaalsContact C-N 3.34Å; Y478-A481 PolarHBondContact O-N 3.45Å; Y478-K482 HydrophobicContact CD1-CD 4.22Å; Y478-K482 HydrophobicContact CE1-CD 3.55Å; Y478-K482 HydrophobicContact CE2-CD 4.32Å; Y478-K482 PolarHBondContact O-N 3.32Å; Y478-K482 VanDerWaalsContact O-N 3.15Å; Y478-T520 HydrophobicContact CD2-CG2 3.68Å; Y478-T520 HydrophobicContact CE2-CG2 4Å; Y478-E523 WeakPolarHBondContact CE2-OE2 3.22Å; Y478-E523 PolarHBondContact OH-OE2 3.25Å
479	Y	97.6	Very high	96.9	Very high	44 Å²	44	41.9 Å²	41.9	17%	0.173	19%	0.191	C	C	.	.	H	α-helix	trans	-71.2	-32.3	178.6	-72.7	-82	0	0	0	112.1	P444 R445 W448 Q476 K482 A483	P444-Y479 HydrophobicContact CB-CD2 3.52Å; P444-Y479 HydrophobicContact CB-CE2 4.15Å; P444-Y479 HydrophobicContact CB-CG 3.79Å; P444-Y479 HydrophobicContact CG-CD2 3.43Å; P444-Y479 VanDerWaalsContact CG-CD2 3.43Å; P444-Y479 HydrophobicContact CG-CE2 3.79Å; P444-Y479 HydrophobicContact CG-CG 4.23Å; R445-Y479 HydrophobicContact CB-CE1 4.36Å; R445-Y479 HydrophobicContact CB-CE2 4.38Å; R445-Y479 VanDerWaalsContact CB-OH 3.24Å; R445-Y479 WeakPolarHBondContact CB-OH 3.5Å; R445-Y479 WeakPolarHBondContact CG-OH 3.44Å; W448-Y479 HydrophobicContact CB-CD1 3.71Å; W448-Y479 HydrophobicContact CB-CE1 3.76Å; W448-Y479 HydrophobicContact CD2-CD1 4.2Å; W448-Y479 HydrophobicContact CE3-CD1 4.39Å; W448-Y479 AromaticContact CG-CD1 3.91Å; W448-Y479 HydrophobicContact CG-CD1 3.91Å; W448-Y479 AromaticContact CG-CE1 3.96Å; W448-Y479 HydrophobicContact CG-CE1 3.96Å; Q476-Y479 PolarHBondContact O-N 3.27Å; Y479-K482 PolarHBondContact O-N 3.03Å; Y479-A483 WeakPolarHBondContact O-CB 3.48Å; Y479-A483 PolarHBondContact O-N 3.38Å
480	S	98.1	Very high	96.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.1	-47.3	172.1	-177.4	0	0	0	0	111.9	A468 Y472 Q476 F477 Y478 K482 A483 F484	A468-S480 PolarHBondContact O-OG 3.33Å; Y472-S480 WeakPolarHBondContact CB-OG 3.14Å; Q476-S480 PolarHBondContact O-N 2.96Å; F477-S480 PolarHBondContact O-N 2.91Å; Y478-S480 VanDerWaalsContact C-N 3.34Å; S480-K482 PolarHBondContact O-N 3.47Å; S480-A483 PolarHBondContact O-N 2.89Å; S480-F484 WeakPolarHBondContact O-CD2 3.35Å; S480-F484 PolarHBondContact O-N 2.93Å; S480-F484 WeakPolarHBondContact OG-CE2 3.44Å
481	A	97.8	Very high	96.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.1	-41.4	179	0	0	0	0	0	112.2	F477 Y478 D485 A503 I507 L527	F477-A481 WeakPolarHBondContact O-CB 3.15Å; F477-A481 PolarHBondContact O-N 3.4Å; Y478-A481 PolarHBondContact O-N 3.45Å; A481-D485 WeakPolarHBondContact O-CB 3.49Å; A481-D485 PolarHBondContact O-N 3.35Å; A481-A503 HydrophobicContact CB-CB 3.7Å; A481-I507 HydrophobicContact CB-CD1 3.74Å; A481-L527 HydrophobicContact CB-CD1 3.95Å
482	K	97.3	Very high	96	Very high	51 Å²	51	50.9 Å²	50.9	22%	0.222	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-43.6	174	-72.6	-178.7	66.2	171.9	0	111.9	W448 Y478 Y479 S480 D485 V486 L527	W448-K482 HydrophobicContact CH2-CB 3.9Å; W448-K482 HydrophobicContact CZ2-CB 4.3Å; W448-K482 HydrophobicContact CZ3-CB 4.16Å; Y478-K482 HydrophobicContact CD1-CD 4.22Å; Y478-K482 HydrophobicContact CE1-CD 3.55Å; Y478-K482 HydrophobicContact CE2-CD 4.32Å; Y478-K482 PolarHBondContact O-N 3.32Å; Y478-K482 VanDerWaalsContact O-N 3.15Å; Y479-K482 PolarHBondContact O-N 3.03Å; S480-K482 PolarHBondContact O-N 3.47Å; K482-D485 PolarHBondContact O-N 3.43Å; K482-V486 WeakPolarHBondContact O-CG2 3.43Å; K482-V486 PolarHBondContact O-N 2.93Å; K482-V486 VanDerWaalsContact O-N 3.11Å; K482-L527 HydrophobicContact CG-CD1 4.41Å
483	A	97.6	Very high	95.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-47.5	178.8	0	0	0	0	0	111.6	W448 L464 I467 A468 Y479 S480 D485 V486 L487	W448-A483 HydrophobicContact CZ3-CB 3.87Å; L464-A483 HydrophobicContact CD1-CB 3.79Å; L464-A483 HydrophobicContact CG-CB 4.34Å; I467-A483 HydrophobicContact CG2-CB 4.21Å; A468-A483 HydrophobicContact CB-CB 3.59Å; Y479-A483 WeakPolarHBondContact O-CB 3.48Å; Y479-A483 PolarHBondContact O-N 3.38Å; S480-A483 PolarHBondContact O-N 2.89Å; A483-D485 VanDerWaalsContact C-N 3.35Å; A483-D485 PolarHBondContact O-N 3.02Å; A483-V486 PolarHBondContact O-N 3.43Å; A483-L487 WeakPolarHBondContact O-CG 3.43Å; A483-L487 PolarHBondContact O-N 3.22Å
484	F	97.9	Very high	95.5	Very high	11 Å²	11	45.9 Å²	45.9	5%	0.048	24%	0.237	C	C	.	.	H	α-helix	trans	-64	-35.5	176.3	-76	-59.7	0	0	0	113.4	A468 Y472 S480 V486 L487 E488 Y496 K500	A468-F484 HydrophobicContact CB-CD1 3.88Å; A468-F484 HydrophobicContact CB-CD2 4.06Å; A468-F484 HydrophobicContact CB-CE1 3.74Å; A468-F484 HydrophobicContact CB-CE2 3.93Å; A468-F484 HydrophobicContact CB-CG 4.03Å; A468-F484 HydrophobicContact CB-CZ 3.76Å; Y472-F484 HydrophobicContact CD2-CE2 4.32Å; S480-F484 WeakPolarHBondContact O-CD2 3.35Å; S480-F484 PolarHBondContact O-N 2.93Å; S480-F484 WeakPolarHBondContact OG-CE2 3.44Å; F484-V486 VanDerWaalsContact C-N 3.34Å; F484-L487 HydrophobicContact CD1-CD1 4.03Å; F484-L487 HydrophobicContact CE1-CD1 4.47Å; F484-L487 PolarHBondContact O-N 3.06Å; F484-E488 VanDerWaalsContact O-CB 3.28Å; F484-E488 WeakPolarHBondContact O-CB 3.48Å; F484-E488 PolarHBondContact O-N 2.85Å; F484-Y496 HydrophobicContact CD1-CD1 4.06Å; F484-Y496 HydrophobicContact CE1-CD1 4.24Å; F484-K500 HydrophobicContact CB-CB 3.75Å
485	D	96.5	Very high	95.4	Very high	10 Å²	10	48.9 Å²	48.9	5%	0.053	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-36.5	174.1	173.9	82	0	0	0	112.9	A481 K482 A483 R489 K500 L527 S530	A481-D485 WeakPolarHBondContact O-CB 3.49Å; A481-D485 PolarHBondContact O-N 3.35Å; K482-D485 PolarHBondContact O-N 3.43Å; A483-D485 VanDerWaalsContact C-N 3.35Å; A483-D485 PolarHBondContact O-N 3.02Å; D485-R489 WeakPolarHBondContact O-CG 3.26Å; D485-R489 PolarHBondContact O-N 3.29Å; D485-R489 PolarHBondContact O-NE 2.91Å; D485-R489 VanDerWaalsContact O-NE 3.13Å; D485-R489 IonicContact OD2-CZ 3.97Å; D485-R489 VanDerWaalsContact OD2-CZ 3.27Å; D485-R489 IonicContact OD2-NE 2.7Å; D485-R489 PolarHBondContact OD2-NE 3.47Å; D485-R489 IonicContact OD2-NH2 3.27Å; D485-R489 PolarHBondContact OD2-NH2 3.24Å; D485-K500 HydrophobicContact CB-CD 4.12Å; D485-K500 WeakPolarHBondContact OD1-CE 3.22Å; D485-K500 IonicContact OD1-NZ 3.15Å; D485-K500 PolarHBondContact OD1-NZ 3.13Å; D485-L527 HydrophobicContact CB-CD2 3.82Å; D485-S530 PolarHBondContact OD1-OG 2.72Å
486	V	95.9	Very high	95.5	Very high	22 Å²	22	48.3 Å²	48.3	13%	0.133	24%	0.24	C	C	.	.	H	α-helix	trans	-71.6	-43.4	173.4	178.2	0	0	0	0	110.4	W448 L464 K482 A483 F484 E488 R489 L490	W448-V486 HydrophobicContact CH2-CG2 4.12Å; L464-V486 HydrophobicContact CD2-CB 3.73Å; L464-V486 HydrophobicContact CD2-CG1 3.46Å; L464-V486 VanDerWaalsContact CD2-CG1 3.46Å; K482-V486 WeakPolarHBondContact O-CG2 3.43Å; K482-V486 PolarHBondContact O-N 2.93Å; K482-V486 VanDerWaalsContact O-N 3.11Å; A483-V486 PolarHBondContact O-N 3.43Å; F484-V486 VanDerWaalsContact C-N 3.34Å; V486-E488 PolarHBondContact O-N 3.12Å; V486-R489 PolarHBondContact O-N 2.8Å; V486-L490 HydrophobicContact CG1-CD1 3.87Å; V486-L490 HydrophobicContact CG1-CG 4.32Å; V486-L490 WeakPolarHBondContact O-CG 3.44Å; V486-L490 PolarHBondContact O-N 3.12Å
487	L	96.6	Very high	95.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.2	-48.2	176.7	-72.2	166.3	0	0	0	111.9	F461 L464 Q465 A468 A483 F484 R489 L490 D491 Y496	F461-L487 HydrophobicContact CD2-CD2 3.89Å; F461-L487 HydrophobicContact CE1-CD2 4.37Å; F461-L487 HydrophobicContact CE2-CD2 3.58Å; F461-L487 HydrophobicContact CG-CD2 4.41Å; F461-L487 HydrophobicContact CZ-CD2 3.86Å; L464-L487 HydrophobicContact CB-CD2 4.1Å; L464-L487 HydrophobicContact CB-CG 4.47Å; L464-L487 HydrophobicContact CD2-CD2 3.66Å; L464-L487 HydrophobicContact CD2-CG 3.64Å; L464-L487 HydrophobicContact CG-CD1 4.35Å; L464-L487 HydrophobicContact CG-CD2 3.91Å; L464-L487 HydrophobicContact CG-CG 3.79Å; Q465-L487 HydrophobicContact CG-CD1 4.14Å; Q465-L487 HydrophobicContact CG-CD2 3.72Å; A468-L487 HydrophobicContact CB-CD1 3.79Å; A483-L487 WeakPolarHBondContact O-CG 3.43Å; A483-L487 PolarHBondContact O-N 3.22Å; F484-L487 HydrophobicContact CD1-CD1 4.03Å; F484-L487 HydrophobicContact CE1-CD1 4.47Å; F484-L487 PolarHBondContact O-N 3.06Å; L487-R489 PolarHBondContact O-N 3.32Å; L487-L490 PolarHBondContact O-N 3.27Å; L487-L490 VanDerWaalsContact O-N 3.11Å; L487-D491 PolarHBondContact O-N 3.08Å; L487-D491 VanDerWaalsContact O-O 3.1Å; L487-Y496 HydrophobicContact CB-CD1 4.02Å; L487-Y496 HydrophobicContact CB-CD2 3.85Å; L487-Y496 HydrophobicContact CB-CE1 4.31Å; L487-Y496 HydrophobicContact CB-CE2 4.15Å; L487-Y496 HydrophobicContact CB-CG 3.8Å; L487-Y496 HydrophobicContact CD1-CD1 4.09Å; L487-Y496 HydrophobicContact CD1-CE1 4.13Å
488	E	94.9	Very high	95.3	Very high	30 Å²	30	49.9 Å²	49.9	14%	0.14	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-35.8	178.2	-178.2	-173.2	-161.7	0	0	112.5	F484 V486 D491 K500 T531	F484-E488 VanDerWaalsContact O-CB 3.28Å; F484-E488 WeakPolarHBondContact O-CB 3.48Å; F484-E488 PolarHBondContact O-N 2.85Å; V486-E488 PolarHBondContact O-N 3.12Å; E488-D491 CarbonylContact O-C 3.59Å; E488-K500 WeakPolarHBondContact OE2-CD 3.43Å; E488-K500 IonicContact OE2-NZ 2.82Å; E488-K500 PolarHBondContact OE2-NZ 3.02Å; E488-T531 VanDerWaalsContact CD-OG1 3.29Å; E488-T531 WeakPolarHBondContact OE1-CG2 3.49Å; E488-T531 PolarHBondContact OE1-OG1 3.08Å; E488-T531 PolarHBondContact OE2-OG1 3.24Å
489	R	93.2	Very high	95.3	Very high	162 Å²	162	48.2 Å²	48.2	61%	0.611	24%	0.244	S	C	*	.	H	α-helix	trans	-74.8	-33.6	177.1	-75.2	-176.1	-75.4	158	-10.1	113	D485 V486 L487	D485-R489 WeakPolarHBondContact O-CG 3.26Å; D485-R489 PolarHBondContact O-N 3.29Å; D485-R489 PolarHBondContact O-NE 2.91Å; D485-R489 VanDerWaalsContact O-NE 3.13Å; D485-R489 IonicContact OD2-CZ 3.97Å; D485-R489 VanDerWaalsContact OD2-CZ 3.27Å; D485-R489 IonicContact OD2-NE 2.7Å; D485-R489 PolarHBondContact OD2-NE 3.47Å; D485-R489 IonicContact OD2-NH2 3.27Å; D485-R489 PolarHBondContact OD2-NH2 3.24Å; V486-R489 PolarHBondContact O-N 2.8Å; L487-R489 PolarHBondContact O-N 3.32Å
490	L	93.2	Very high	95.3	Very high	94 Å²	94	46.1 Å²	46.1	49%	0.492	24%	0.236	S	C	.	.	H	α-helix	trans	-79.3	-37.1	178.9	-68.2	175.5	0	0	0	111.9	F461 L464 V486 L487	F461-L490 HydrophobicContact CD2-CB 4.34Å; F461-L490 HydrophobicContact CD2-CD1 4.11Å; F461-L490 HydrophobicContact CE2-CB 4.13Å; L464-L490 HydrophobicContact CD2-CD1 4.32Å; V486-L490 HydrophobicContact CG1-CD1 3.87Å; V486-L490 HydrophobicContact CG1-CG 4.32Å; V486-L490 WeakPolarHBondContact O-CG 3.44Å; V486-L490 PolarHBondContact O-N 3.12Å; L487-L490 PolarHBondContact O-N 3.27Å; L487-L490 VanDerWaalsContact O-N 3.11Å
491	D	92.8	Very high	95.2	Very high	64 Å²	64	49.4 Å²	49.4	34%	0.342	25%	0.248	S	C	.	.	S	Bend	trans	-144.3	107.9	-179.8	173.5	25.1	0	0	0	108.9	F461 L487 E488 N493 Y496	F461-D491 HydrophobicContact CE2-CB 4.09Å; F461-D491 HydrophobicContact CZ-CB 4.03Å; L487-D491 PolarHBondContact O-N 3.08Å; L487-D491 VanDerWaalsContact O-O 3.1Å; E488-D491 CarbonylContact O-C 3.59Å; D491-N493 PolarHBondContact O-N 3.22Å; D491-Y496 HydrophobicContact CB-CE2 4Å; D491-Y496 WeakPolarHBondContact O-CD2 3.31Å; D491-Y496 WeakPolarHBondContact O-CE2 3.42Å; D491-Y496 WeakPolarHBondContact OD2-CE2 3.36Å
492	P	89.4	Confident	95.2	Very high	110 Å²	110	50.2 Å²	50.2	71%	0.714	26%	0.257	S	S	*	.			trans	-73	45.3	-176.8	1.8	9.2	0	0	0	114.3
493	N	91.6	Very high	95.2	Very high	50 Å²	50	47.8 Å²	47.8	27%	0.267	25%	0.246	S	C	.	.			trans	-68.5	126.9	171.9	-177.7	-17.2	0	0	0	110.2	D491 E495 Y496	D491-N493 PolarHBondContact O-N 3.22Å; N493-E495 PolarHBondContact O-N 3.37Å; N493-E495 PolarHBondContact OD1-N 3.3Å; N493-Y496 HydrophobicContact CB-CD2 3.73Å; N493-Y496 HydrophobicContact CB-CE2 3.63Å; N493-Y496 HydrophobicContact CB-CG 4.47Å; N493-Y496 PolarHBondContact O-N 2.9Å
494	P	92.6	Very high	95.2	Very high	99 Å²	99	47.8 Å²	47.8	64%	0.643	25%	0.246	S	C	*	.	H	α-helix	trans	-52.3	-28.2	176.3	-28	35.4	0	0	0	115.2	Y496 W497 E498	P494-Y496 VanDerWaalsContact C-N 3.31Å; P494-Y496 PolarHBondContact O-N 3.15Å; P494-W497 WeakPolarHBondContact O-CB 3.4Å; P494-W497 PolarHBondContact O-N 3.41Å; P494-E498 WeakPolarHBondContact O-CG 3.36Å; P494-E498 PolarHBondContact O-N 3.32Å; P494-E498 VanDerWaalsContact O-N 3.15Å
495	E	94.6	Very high	95.2	Very high	138 Å²	138	50.5 Å²	50.5	65%	0.645	26%	0.263	S	S	*	.	H	α-helix	trans	-64.4	-32.4	178.3	-67.4	-173.3	169.8	0	0	113.1	N493 E498 G499	N493-E495 PolarHBondContact O-N 3.37Å; N493-E495 PolarHBondContact OD1-N 3.3Å; E495-E498 WeakPolarHBondContact O-CB 3.49Å; E495-E498 PolarHBondContact O-N 2.84Å; E495-G499 PolarHBondContact O-N 2.77Å
496	Y	96	Very high	95.2	Very high	18 Å²	18	50.2 Å²	50.2	7%	0.071	26%	0.263	C	S	.	.	H	α-helix	trans	-72.1	-33.8	177.4	-56.3	-40.5	0	0	0	111.8	F461 Q465 F484 L487 D491 N493 P494 E498 G499 K500	F461-Y496 HydrophobicContact CZ-CE2 4.27Å; F461-Y496 WeakPolarHBondContact CZ-OH 3.48Å; Q465-Y496 PolarHBondContact NE2-OH 3.23Å; F484-Y496 HydrophobicContact CD1-CD1 4.06Å; F484-Y496 HydrophobicContact CE1-CD1 4.24Å; L487-Y496 HydrophobicContact CB-CD1 4.02Å; L487-Y496 HydrophobicContact CB-CD2 3.85Å; L487-Y496 HydrophobicContact CB-CE1 4.31Å; L487-Y496 HydrophobicContact CB-CE2 4.15Å; L487-Y496 HydrophobicContact CB-CG 3.8Å; L487-Y496 HydrophobicContact CD1-CD1 4.09Å; L487-Y496 HydrophobicContact CD1-CE1 4.13Å; D491-Y496 HydrophobicContact CB-CE2 4Å; D491-Y496 WeakPolarHBondContact O-CD2 3.31Å; D491-Y496 WeakPolarHBondContact O-CE2 3.42Å; D491-Y496 WeakPolarHBondContact OD2-CE2 3.36Å; N493-Y496 HydrophobicContact CB-CD2 3.73Å; N493-Y496 HydrophobicContact CB-CE2 3.63Å; N493-Y496 HydrophobicContact CB-CG 4.47Å; N493-Y496 PolarHBondContact O-N 2.9Å; P494-Y496 VanDerWaalsContact C-N 3.31Å; P494-Y496 PolarHBondContact O-N 3.15Å; Y496-E498 VanDerWaalsContact C-N 3.34Å; Y496-G499 PolarHBondContact O-N 2.92Å; Y496-K500 VanDerWaalsContact O-CB 3.24Å; Y496-K500 WeakPolarHBondContact O-CB 3.16Å; Y496-K500 PolarHBondContact O-N 3.38Å
497	W	95.3	Very high	95.3	Very high	13 Å²	13	49.3 Å²	49.3	5%	0.049	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-45.5	169	161.8	-108.3	0	0	0	110.9	P494 G499 K500 R501 L528 T531 N533 Q535 V536	P494-W497 WeakPolarHBondContact O-CB 3.4Å; P494-W497 PolarHBondContact O-N 3.41Å; W497-G499 VanDerWaalsContact C-N 3.34Å; W497-G499 PolarHBondContact O-N 2.97Å; W497-K500 HydrophobicContact CE3-CD 4.43Å; W497-K500 PolarHBondContact O-N 2.63Å; W497-R501 HydrophobicContact CD2-CB 4.4Å; W497-R501 HydrophobicContact CH2-CB 4.19Å; W497-R501 HydrophobicContact CH2-CG 4.28Å; W497-R501 HydrophobicContact CZ2-CB 3.96Å; W497-R501 HydrophobicContact CZ2-CG 3.92Å; W497-R501 HydrophobicContact CZ3-CB 4.49Å; W497-R501 WeakPolarHBondContact O-CB 3.14Å; W497-R501 PolarHBondContact O-N 3.13Å; W497-L528 HydrophobicContact CH2-CD2 4.32Å; W497-L528 HydrophobicContact CZ3-CD2 4.39Å; W497-T531 HydrophobicContact CD2-CG2 4.1Å; W497-T531 HydrophobicContact CE3-CG2 3.46Å; W497-T531 VanDerWaalsContact CE3-CG2 3.46Å; W497-T531 HydrophobicContact CH2-CG2 4.5Å; W497-T531 HydrophobicContact CZ3-CG2 3.68Å; W497-N533 HydrophobicContact CD2-CB 4.13Å; W497-N533 HydrophobicContact CE3-CB 4.49Å; W497-N533 HydrophobicContact CH2-CB 4.21Å; W497-N533 HydrophobicContact CZ2-CB 3.83Å; W497-N533 PolarHBondContact NE1-ND2 3.42Å; W497-N533 VanDerWaalsContact NE1-ND2 3.14Å; W497-Q535 HydrophobicContact CZ2-CB 4.16Å; W497-V536 HydrophobicContact CH2-CG2 3.42Å; W497-V536 VanDerWaalsContact CH2-CG2 3.42Å; W497-V536 HydrophobicContact CZ2-CG2 4.28Å; W497-V536 HydrophobicContact CZ3-CG2 3.86Å
498	E	95.7	Very high	95.3	Very high	84 Å²	84	50.7 Å²	50.7	39%	0.393	26%	0.264	S	S	.	.	H	α-helix	trans	-60.2	-44	178.4	-69.1	-65.5	134.1	0	0	111.7	P494 E495 Y496 R501 G502	P494-E498 WeakPolarHBondContact O-CG 3.36Å; P494-E498 PolarHBondContact O-N 3.32Å; P494-E498 VanDerWaalsContact O-N 3.15Å; E495-E498 WeakPolarHBondContact O-CB 3.49Å; E495-E498 PolarHBondContact O-N 2.84Å; Y496-E498 VanDerWaalsContact C-N 3.34Å; E498-R501 IonicContact OE1-CZ 2.69Å; E498-R501 IonicContact OE1-NH1 3.61Å; E498-R501 PolarHBondContact OE1-NH1 3.42Å; E498-R501 IonicContact OE1-NH2 3.39Å; E498-R501 IonicContact OE2-CZ 3.18Å; E498-R501 IonicContact OE2-NE 3.39Å; E498-R501 IonicContact OE2-NH1 2.85Å; E498-R501 PolarHBondContact OE2-NH1 3.06Å; E498-R501 IonicContact OE2-NH2 3.92Å; E498-R501 PolarHBondContact OE2-NH2 2.87Å; E498-G502 PolarHBondContact O-N 3.31Å
499	G	96.7	Very high	95.4	Very high	13 Å²	13	55.4 Å²	55.4	13%	0.134	29%	0.286	C	S	.	.	H	α-helix	trans	-61.5	-47.8	172.8	0	0	0	0	0	113.1	E495 Y496 W497 G502 A503	E495-G499 PolarHBondContact O-N 2.77Å; Y496-G499 PolarHBondContact O-N 2.92Å; W497-G499 VanDerWaalsContact C-N 3.34Å; W497-G499 PolarHBondContact O-N 2.97Å; G499-G502 PolarHBondContact O-N 3.02Å; G499-A503 WeakPolarHBondContact O-CB 3.36Å; G499-A503 PolarHBondContact O-N 2.84Å
500	K	97.3	Very high	95.5	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-45.6	177.2	-178.6	177.3	175	176.9	0	112	F484 D485 E488 Y496 W497 A503 C504 L527 S530 T531	F484-K500 HydrophobicContact CB-CB 3.75Å; D485-K500 HydrophobicContact CB-CD 4.12Å; D485-K500 WeakPolarHBondContact OD1-CE 3.22Å; D485-K500 IonicContact OD1-NZ 3.15Å; D485-K500 PolarHBondContact OD1-NZ 3.13Å; E488-K500 WeakPolarHBondContact OE2-CD 3.43Å; E488-K500 IonicContact OE2-NZ 2.82Å; E488-K500 PolarHBondContact OE2-NZ 3.02Å; Y496-K500 VanDerWaalsContact O-CB 3.24Å; Y496-K500 WeakPolarHBondContact O-CB 3.16Å; Y496-K500 PolarHBondContact O-N 3.38Å; W497-K500 HydrophobicContact CE3-CD 4.43Å; W497-K500 PolarHBondContact O-N 2.63Å; K500-A503 PolarHBondContact O-N 3.17Å; K500-C504 WeakPolarHBondContact O-CB 3.34Å; K500-C504 PolarHBondContact O-N 3.1Å; K500-C504 PolarHBondContact O-SG 3.46Å; K500-L527 WeakPolarHBondContact CE-O 3.42Å; K500-L527 PolarHBondContact NZ-O 3.17Å; K500-S530 PolarHBondContact NZ-OG 3.4Å; K500-T531 PolarHBondContact NZ-OG1 3.37Å
501	R	96.7	Very high	95.7	Very high	68 Å²	68	45.6 Å²	45.6	26%	0.257	25%	0.245	S	C	.	.	H	α-helix	trans	-58.5	-51.9	176.8	-173.6	-173.6	74.8	-162.6	0.6	110.1	W497 E498 A503 C504 V505 M539	W497-R501 HydrophobicContact CD2-CB 4.4Å; W497-R501 HydrophobicContact CH2-CB 4.19Å; W497-R501 HydrophobicContact CH2-CG 4.28Å; W497-R501 HydrophobicContact CZ2-CB 3.96Å; W497-R501 HydrophobicContact CZ2-CG 3.92Å; W497-R501 HydrophobicContact CZ3-CB 4.49Å; W497-R501 WeakPolarHBondContact O-CB 3.14Å; W497-R501 PolarHBondContact O-N 3.13Å; E498-R501 IonicContact OE1-CZ 2.69Å; E498-R501 IonicContact OE1-NH1 3.61Å; E498-R501 PolarHBondContact OE1-NH1 3.42Å; E498-R501 IonicContact OE1-NH2 3.39Å; E498-R501 IonicContact OE2-CZ 3.18Å; E498-R501 IonicContact OE2-NE 3.39Å; E498-R501 IonicContact OE2-NH1 2.85Å; E498-R501 PolarHBondContact OE2-NH1 3.06Å; E498-R501 IonicContact OE2-NH2 3.92Å; E498-R501 PolarHBondContact OE2-NH2 2.87Å; R501-A503 VanDerWaalsContact C-N 3.35Å; R501-A503 PolarHBondContact O-N 3.09Å; R501-C504 PolarHBondContact O-N 3.48Å; R501-V505 WeakPolarHBondContact O-CG2 3.25Å; R501-V505 PolarHBondContact O-N 3.07Å; R501-M539 HydrophobicContact CG-CE 4.01Å; R501-M539 HydrophobicContact CG-SD 3.62Å
502	G	97.1	Very high	95.8	Very high	17 Å²	17	46.2 Å²	46.2	18%	0.175	25%	0.25	C	S	.	.	H	α-helix	trans	-57.3	-46.6	176.9	0	0	0	0	0	112.1	E498 G499 V505 G506	E498-G502 PolarHBondContact O-N 3.31Å; G499-G502 PolarHBondContact O-N 3.02Å; G502-V505 PolarHBondContact O-N 2.7Å; G502-G506 PolarHBondContact O-N 2.99Å
503	A	97.6	Very high	96	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65	-43.3	179.4	0	0	0	0	0	111.9	Y472 F477 A481 G499 K500 R501 V505 G506 I507	Y472-A503 HydrophobicContact CD2-CB 4.22Å; Y472-A503 HydrophobicContact CE2-CB 4.4Å; F477-A503 WeakPolarHBondContact CB-O 3.21Å; A481-A503 HydrophobicContact CB-CB 3.7Å; G499-A503 WeakPolarHBondContact O-CB 3.36Å; G499-A503 PolarHBondContact O-N 2.84Å; K500-A503 PolarHBondContact O-N 3.17Å; R501-A503 VanDerWaalsContact C-N 3.35Å; R501-A503 PolarHBondContact O-N 3.09Å; A503-V505 VanDerWaalsContact C-N 3.35Å; A503-V505 PolarHBondContact O-N 3.42Å; A503-G506 CarbonylContact O-C 3.47Å; A503-G506 WeakPolarHBondContact O-CA 3.46Å; A503-G506 PolarHBondContact O-N 2.91Å; A503-G506 VanDerWaalsContact O-N 3.1Å; A503-I507 WeakPolarHBondContact O-CG1 3.38Å; A503-I507 PolarHBondContact O-N 3.37Å
504	C	97.9	Very high	96.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-41.1	176.3	-71.2	0	0	0	0	112.5	K500 R501 I507 F508 V524 L528 M539	K500-C504 WeakPolarHBondContact O-CB 3.34Å; K500-C504 PolarHBondContact O-N 3.1Å; K500-C504 PolarHBondContact O-SG 3.46Å; R501-C504 PolarHBondContact O-N 3.48Å; C504-I507 PolarHBondContact O-N 3.47Å; C504-F508 PolarHBondContact O-N 2.97Å; C504-F508 VanDerWaalsContact O-N 3.1Å; C504-V524 HydrophobicContact CB-CG1 3.94Å; C504-L528 HydrophobicContact CB-CD1 4.42Å; C504-L528 HydrophobicContact CB-CD2 3.87Å; C504-L528 HydrophobicContact CB-CG 4.16Å; C504-M539 HydrophobicContact CB-CE 4.35Å
505	V	97.3	Very high	96.2	Very high	68 Å²	68	49.1 Å²	49.1	41%	0.412	26%	0.264	S	S	.	.	H	α-helix	trans	-64.6	-41.3	172.6	175.8	0	0	0	0	110.8	R501 G502 A503 F508 Q509 M539	R501-V505 WeakPolarHBondContact O-CG2 3.25Å; R501-V505 PolarHBondContact O-N 3.07Å; G502-V505 PolarHBondContact O-N 2.7Å; A503-V505 VanDerWaalsContact C-N 3.35Å; A503-V505 PolarHBondContact O-N 3.42Å; V505-F508 PolarHBondContact O-N 3.01Å; V505-Q509 PolarHBondContact O-N 3.23Å; V505-M539 HydrophobicContact CG2-CE 3.47Å; V505-M539 VanDerWaalsContact CG2-CE 3.47Å
506	G	97	Very high	96.1	Very high	4 Å²	4	45.2 Å²	45.2	4%	0.041	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-43.7	175.9	0	0	0	0	0	113	G502 A503 F508 Q509 M510	G502-G506 PolarHBondContact O-N 2.99Å; A503-G506 CarbonylContact O-C 3.47Å; A503-G506 WeakPolarHBondContact O-CA 3.46Å; A503-G506 PolarHBondContact O-N 2.91Å; A503-G506 VanDerWaalsContact O-N 3.1Å; G506-F508 VanDerWaalsContact C-N 3.35Å; G506-F508 PolarHBondContact O-N 2.85Å; G506-Q509 PolarHBondContact O-N 3.19Å; G506-M510 VanDerWaalsContact O-CG 3.3Å; G506-M510 WeakPolarHBondContact O-CG 3.32Å; G506-M510 PolarHBondContact O-N 2.88Å
507	I	97.4	Very high	96	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.015	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-48.7	173.3	-60.6	162.7	0	0	0	109.7	F477 A481 A503 C504 Q509 M510 I511 E516 T520 V524	F477-I507 HydrophobicContact CB-CG1 3.58Å; A481-I507 HydrophobicContact CB-CD1 3.74Å; A503-I507 WeakPolarHBondContact O-CG1 3.38Å; A503-I507 PolarHBondContact O-N 3.37Å; C504-I507 PolarHBondContact O-N 3.47Å; I507-Q509 VanDerWaalsContact C-N 3.33Å; I507-Q509 PolarHBondContact O-N 3.09Å; I507-M510 WeakPolarHBondContact O-CB 3.5Å; I507-M510 PolarHBondContact O-N 3.48Å; I507-M510 VanDerWaalsContact O-N 3.08Å; I507-I511 HydrophobicContact CG2-CD1 3.99Å; I507-I511 HydrophobicContact CG2-CG1 4.39Å; I507-I511 WeakPolarHBondContact O-CG1 3.49Å; I507-I511 PolarHBondContact O-N 3.31Å; I507-E516 HydrophobicContact CG2-CG 4.25Å; I507-T520 HydrophobicContact CG2-CG2 3.88Å; I507-V524 HydrophobicContact CB-CG2 3.86Å; I507-V524 HydrophobicContact CD1-CG2 3.84Å; I507-V524 HydrophobicContact CG1-CG2 4.47Å; I507-V524 HydrophobicContact CG2-CG2 3.44Å; I507-V524 VanDerWaalsContact CG2-CG2 3.44Å
508	F	97.3	Very high	95.9	Very high	30 Å²	30	51.6 Å²	51.6	13%	0.132	28%	0.282	C	S	.	.	H	α-helix	trans	-60.9	-41.2	179.6	180	-116	0	0	0	112.5	C504 V505 G506 M510 I511 V512 L521 I542 M543 W546	C504-F508 PolarHBondContact O-N 2.97Å; C504-F508 VanDerWaalsContact O-N 3.1Å; V505-F508 PolarHBondContact O-N 3.01Å; G506-F508 VanDerWaalsContact C-N 3.35Å; G506-F508 PolarHBondContact O-N 2.85Å; F508-M510 VanDerWaalsContact C-N 3.3Å; F508-M510 PolarHBondContact O-N 3.4Å; F508-I511 PolarHBondContact O-N 3.49Å; F508-V512 HydrophobicContact CD1-CG2 4.48Å; F508-V512 HydrophobicContact CD2-CG2 4.43Å; F508-V512 HydrophobicContact CE1-CG2 4.14Å; F508-V512 HydrophobicContact CE2-CG2 4.09Å; F508-V512 HydrophobicContact CZ-CG2 3.93Å; F508-V512 VanDerWaalsContact O-CG2 3.29Å; F508-V512 WeakPolarHBondContact O-CG2 3.29Å; F508-V512 PolarHBondContact O-N 3.3Å; F508-L521 HydrophobicContact CD2-CD1 3.94Å; F508-L521 HydrophobicContact CE2-CD1 4.43Å; F508-I542 HydrophobicContact CE1-CG2 4.49Å; F508-M543 HydrophobicContact CB-CE 3.79Å; F508-M543 HydrophobicContact CD1-CE 4.46Å; F508-M543 HydrophobicContact CD1-CG 4.25Å; F508-M543 HydrophobicContact CD2-CG 3.87Å; F508-M543 HydrophobicContact CE1-CG 4.4Å; F508-M543 HydrophobicContact CE2-CB 4.35Å; F508-M543 HydrophobicContact CE2-CG 4.03Å; F508-M543 HydrophobicContact CG-CE 4.1Å; F508-M543 HydrophobicContact CG-CG 3.98Å; F508-M543 HydrophobicContact CZ-CG 4.3Å; F508-W546 HydrophobicContact CE2-CB 4.06Å; F508-W546 AromaticContact CE2-CD2 3.76Å; F508-W546 HydrophobicContact CE2-CD2 3.76Å; F508-W546 AromaticContact CE2-CE3 3.7Å; F508-W546 HydrophobicContact CE2-CE3 3.7Å; F508-W546 AromaticContact CE2-CG 3.92Å; F508-W546 HydrophobicContact CE2-CG 3.92Å; F508-W546 HydrophobicContact CE2-CZ3 4.46Å; F508-W546 HydrophobicContact CZ-CB 3.67Å; F508-W546 HydrophobicContact CZ-CD2 4.01Å; F508-W546 HydrophobicContact CZ-CE3 4.39Å; F508-W546 AromaticContact CZ-CG 3.67Å; F508-W546 HydrophobicContact CZ-CG 3.67Å
509	Q	96.8	Very high	95.8	Very high	129 Å²	129	53.8 Å²	53.8	60%	0.603	29%	0.292	S	S	*	.	H	α-helix	trans	-58.7	-42.1	173.1	-176.3	-176.6	6.3	0	0	111.7	V505 G506 I507 V512 A513	V505-Q509 PolarHBondContact O-N 3.23Å; G506-Q509 PolarHBondContact O-N 3.19Å; I507-Q509 VanDerWaalsContact C-N 3.33Å; I507-Q509 PolarHBondContact O-N 3.09Å; Q509-V512 PolarHBondContact O-N 2.86Å; Q509-A513 WeakPolarHBondContact O-CB 3.25Å; Q509-A513 PolarHBondContact O-N 3.46Å
510	M	96.1	Very high	95.7	Very high	47 Å²	47	53.9 Å²	53.9	23%	0.232	29%	0.29	C	S	.	.	H	α-helix	trans	-67.6	-35.6	177.9	-68.1	-66	-78.9	0	0	112.6	F477 G506 I507 F508 A513 G514 R515 E516	F477-M510 HydrophobicContact CD2-CG 4.03Å; F477-M510 HydrophobicContact CE2-CG 4.26Å; G506-M510 VanDerWaalsContact O-CG 3.3Å; G506-M510 WeakPolarHBondContact O-CG 3.32Å; G506-M510 PolarHBondContact O-N 2.88Å; I507-M510 WeakPolarHBondContact O-CB 3.5Å; I507-M510 PolarHBondContact O-N 3.48Å; I507-M510 VanDerWaalsContact O-N 3.08Å; F508-M510 VanDerWaalsContact C-N 3.3Å; F508-M510 PolarHBondContact O-N 3.4Å; M510-A513 CarbonylContact O-C 3.53Å; M510-A513 PolarHBondContact O-N 3.28Å; M510-G514 PolarHBondContact O-N 2.95Å; M510-G514 VanDerWaalsContact O-N 3.17Å; M510-R515 HydrophobicContact CE-CB 3.5Å; M510-R515 HydrophobicContact CE-CG 4.26Å; M510-R515 PolarHBondContact O-N 3.35Å; M510-R515 HydrophobicContact SD-CB 4.22Å; M510-E516 HydrophobicContact CB-CB 3.83Å; M510-E516 PolarHBondContact O-N 3.32Å
511	I	96.1	Very high	95.6	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.015	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-47.4	172.6	-67	171.6	0	0	0	110.3	I507 F508 A513 G514 E516 K518 L521 W546	I507-I511 HydrophobicContact CG2-CD1 3.99Å; I507-I511 HydrophobicContact CG2-CG1 4.39Å; I507-I511 WeakPolarHBondContact O-CG1 3.49Å; I507-I511 PolarHBondContact O-N 3.31Å; F508-I511 PolarHBondContact O-N 3.49Å; I511-A513 VanDerWaalsContact C-N 3.26Å; I511-A513 PolarHBondContact O-N 3.43Å; I511-G514 PolarHBondContact O-N 3.22Å; I511-E516 HydrophobicContact CG1-CB 3.78Å; I511-E516 HydrophobicContact CG1-CG 3.79Å; I511-K518 HydrophobicContact CG2-CG 4.22Å; I511-L521 HydrophobicContact CD1-CB 4.01Å; I511-L521 HydrophobicContact CD1-CD1 4.38Å; I511-W546 HydrophobicContact CG2-CH2 3.47Å; I511-W546 VanDerWaalsContact CG2-CH2 3.47Å; I511-W546 HydrophobicContact CG2-CZ2 4.34Å; I511-W546 HydrophobicContact CG2-CZ3 3.77Å
512	V	95.4	Very high	95.5	Very high	76 Å²	76	56.8 Å²	56.8	46%	0.461	30%	0.301	S	S	.	.	H	α-helix	trans	-60.8	-38.1	177.2	174.1	0	0	0	0	111.1	F508 Q509 G514 W546	F508-V512 HydrophobicContact CD1-CG2 4.48Å; F508-V512 HydrophobicContact CD2-CG2 4.43Å; F508-V512 HydrophobicContact CE1-CG2 4.14Å; F508-V512 HydrophobicContact CE2-CG2 4.09Å; F508-V512 HydrophobicContact CZ-CG2 3.93Å; F508-V512 VanDerWaalsContact O-CG2 3.29Å; F508-V512 WeakPolarHBondContact O-CG2 3.29Å; F508-V512 PolarHBondContact O-N 3.3Å; Q509-V512 PolarHBondContact O-N 2.86Å; V512-G514 PolarHBondContact O-N 2.9Å; V512-W546 HydrophobicContact CG2-CD2 4.32Å; V512-W546 HydrophobicContact CG2-CZ2 4.04Å
513	A	94.7	Very high	95.3	Very high	62 Å²	62	60.4 Å²	60.4	51%	0.512	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-1.9	176.6	0	0	0	0	0	114.3	Q509 M510 I511 R515	Q509-A513 WeakPolarHBondContact O-CB 3.25Å; Q509-A513 PolarHBondContact O-N 3.46Å; M510-A513 CarbonylContact O-C 3.53Å; M510-A513 PolarHBondContact O-N 3.28Å; I511-A513 VanDerWaalsContact C-N 3.26Å; I511-A513 PolarHBondContact O-N 3.43Å; A513-R515 VanDerWaalsContact C-N 3.27Å; A513-R515 HydrophobicContact CB-CG 4.41Å; A513-R515 PolarHBondContact O-N 3.45Å
514	G	93.3	Very high	95.2	Very high	66 Å²	66	60.5 Å²	60.5	68%	0.68	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	18.5	-178.9	0	0	0	0	0	114.7	M510 I511 V512	M510-G514 PolarHBondContact O-N 2.95Å; M510-G514 VanDerWaalsContact O-N 3.17Å; I511-G514 PolarHBondContact O-N 3.22Å; V512-G514 PolarHBondContact O-N 2.9Å
515	R	93	Very high	95.1	Very high	192 Å²	192	60.6 Å²	60.6	73%	0.725	31%	0.314	S	S	*	.	S	Bend	trans	-98	-9.4	179.3	-64.2	-176.8	-178.6	-179.1	-0.4	113.5	M510 A513	M510-R515 HydrophobicContact CE-CB 3.5Å; M510-R515 HydrophobicContact CE-CG 4.26Å; M510-R515 PolarHBondContact O-N 3.35Å; M510-R515 HydrophobicContact SD-CB 4.22Å; A513-R515 VanDerWaalsContact C-N 3.27Å; A513-R515 HydrophobicContact CB-CG 4.41Å; A513-R515 PolarHBondContact O-N 3.45Å
516	E	93.1	Very high	94.9	Very high	57 Å²	57	63.8 Å²	63.8	27%	0.266	33%	0.325	S	S	.	.	S	Bend	trans	-130.2	140.6	177.2	-174.8	65.2	-149.5	0	0	109	I507 M510 I511 T520	I507-E516 HydrophobicContact CG2-CG 4.25Å; M510-E516 HydrophobicContact CB-CB 3.83Å; M510-E516 PolarHBondContact O-N 3.32Å; I511-E516 HydrophobicContact CG1-CB 3.78Å; I511-E516 HydrophobicContact CG1-CG 3.79Å; E516-T520 HydrophobicContact CG-CG2 4.2Å; E516-T520 PolarHBondContact OE1-OG1 3.29Å
517	P	94.1	Very high	94.8	Very high	71 Å²	71	64.3 Å²	64.3	46%	0.461	33%	0.327	S	S	.	.			trans	-56	142.4	176.8	-25.7	35.8	0	0	0	112.7	E519 T520	P517-E519 WeakPolarHBondContact CB-OE2 3.48Å; P517-E519 PolarHBondContact O-N 3.26Å; P517-T520 WeakPolarHBondContact O-CB 3.49Å; P517-T520 PolarHBondContact O-N 2.97Å; P517-T520 PolarHBondContact O-OG1 2.68Å
518	K	94.3	Very high	94.8	Very high	93 Å²	93	64.2 Å²	64.2	40%	0.404	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-25.8	-178	-70.3	174.3	168.5	-172.6	0	111.8	I511 T520 L521 W546 V552	I511-K518 HydrophobicContact CG2-CG 4.22Å; K518-T520 VanDerWaalsContact C-N 3.26Å; K518-T520 PolarHBondContact O-N 2.96Å; K518-L521 WeakPolarHBondContact O-CB 3.39Å; K518-L521 PolarHBondContact O-N 2.85Å; K518-W546 HydrophobicContact CG-CH2 4.46Å; K518-V552 HydrophobicContact CB-CG1 3.88Å; K518-V552 HydrophobicContact CB-CG2 4.18Å; K518-V552 HydrophobicContact CD-CG2 3.81Å; K518-V552 HydrophobicContact CG-CG2 4.23Å
519	E	92.9	Very high	94.6	Very high	131 Å²	131	69.7 Å²	69.7	61%	0.612	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-31.4	178.3	-62.5	69.3	-150.9	0	0	111.8	P517 L521 R522	P517-E519 WeakPolarHBondContact CB-OE2 3.48Å; P517-E519 PolarHBondContact O-N 3.26Å; E519-L521 PolarHBondContact O-N 3.34Å; E519-R522 PolarHBondContact O-N 3.45Å; E519-R522 VanDerWaalsContact O-N 3.09Å
520	T	93.8	Very high	94.3	Very high	15 Å²	15	66.6 Å²	66.6	9%	0.092	34%	0.338	C	S	.	.	H	α-helix	trans	-57.8	-23.2	176.8	-51.1	0	0	0	0	111.7	Y478 I507 E516 P517 K518 R522 E523 V524	Y478-T520 HydrophobicContact CD2-CG2 3.68Å; Y478-T520 HydrophobicContact CE2-CG2 4Å; I507-T520 HydrophobicContact CG2-CG2 3.88Å; E516-T520 HydrophobicContact CG-CG2 4.2Å; E516-T520 PolarHBondContact OE1-OG1 3.29Å; P517-T520 WeakPolarHBondContact O-CB 3.49Å; P517-T520 PolarHBondContact O-N 2.97Å; P517-T520 PolarHBondContact O-OG1 2.68Å; K518-T520 VanDerWaalsContact C-N 3.26Å; K518-T520 PolarHBondContact O-N 2.96Å; T520-R522 PolarHBondContact O-N 2.94Å; T520-E523 PolarHBondContact O-N 2.91Å; T520-E523 VanDerWaalsContact O-N 3.08Å; T520-V524 WeakPolarHBondContact O-CG2 3.28Å; T520-V524 PolarHBondContact O-N 3.33Å; T520-V524 VanDerWaalsContact O-N 3.08Å
521	L	95.2	Very high	94	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-57.5	-33.4	176.8	-170.6	56.7	0	0	0	113.1	F508 I511 K518 E519 E523 V524 L525 M543 W546 A547 I554	F508-L521 HydrophobicContact CD2-CD1 3.94Å; F508-L521 HydrophobicContact CE2-CD1 4.43Å; I511-L521 HydrophobicContact CD1-CB 4.01Å; I511-L521 HydrophobicContact CD1-CD1 4.38Å; K518-L521 WeakPolarHBondContact O-CB 3.39Å; K518-L521 PolarHBondContact O-N 2.85Å; E519-L521 PolarHBondContact O-N 3.34Å; L521-E523 VanDerWaalsContact C-N 3.32Å; L521-E523 PolarHBondContact O-N 3.39Å; L521-V524 PolarHBondContact O-N 3.32Å; L521-L525 VanDerWaalsContact O-CG 3.32Å; L521-L525 WeakPolarHBondContact O-CG 3.28Å; L521-L525 PolarHBondContact O-N 3.44Å; L521-M543 HydrophobicContact CD1-CB 4.18Å; L521-M543 HydrophobicContact CD1-CG 4.35Å; L521-M543 HydrophobicContact CD1-SD 4.39Å; L521-W546 HydrophobicContact CD2-CE3 4.06Å; L521-W546 HydrophobicContact CD2-CZ3 4.04Å; L521-A547 HydrophobicContact CD2-CB 3.79Å; L521-I554 HydrophobicContact CB-CG2 4.39Å; L521-I554 HydrophobicContact CD2-CG2 3.66Å; L521-I554 HydrophobicContact CG-CG2 3.95Å
522	R	94.4	Very high	93.5	Very high	129 Å²	129	69.1 Å²	69.1	49%	0.487	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-41.9	177	-67	-171	-179.1	169.3	-0.2	111.7	E519 T520 L525 H526 P553 I554	E519-R522 PolarHBondContact O-N 3.45Å; E519-R522 VanDerWaalsContact O-N 3.09Å; T520-R522 PolarHBondContact O-N 2.94Å; R522-L525 PolarHBondContact O-N 2.98Å; R522-H526 PolarHBondContact O-N 3.47Å; R522-P553 VanDerWaalsContact CZ-O 3.29Å; R522-P553 PolarHBondContact NE-O 3Å; R522-P553 PolarHBondContact NH2-O 3.08Å; R522-I554 WeakPolarHBondContact CG-OXT 3.24Å
523	E	93.5	Very high	93.2	Very high	93 Å²	93	67.9 Å²	67.9	44%	0.435	37%	0.365	S	S	.	.	H	α-helix	trans	-69.4	-39.6	178.2	-62.8	-170.7	-163.3	0	0	111.3	Y478 T520 L521 L525 H526 L527	Y478-E523 WeakPolarHBondContact CE2-OE2 3.22Å; Y478-E523 PolarHBondContact OH-OE2 3.25Å; T520-E523 PolarHBondContact O-N 2.91Å; T520-E523 VanDerWaalsContact O-N 3.08Å; L521-E523 VanDerWaalsContact C-N 3.32Å; L521-E523 PolarHBondContact O-N 3.39Å; E523-L525 VanDerWaalsContact C-N 3.32Å; E523-L525 PolarHBondContact O-N 2.95Å; E523-H526 WeakPolarHBondContact O-CB 3.4Å; E523-H526 PolarHBondContact O-N 2.84Å; E523-H526 VanDerWaalsContact O-N 3.08Å; E523-L527 WeakPolarHBondContact O-CG 3.29Å; E523-L527 PolarHBondContact O-N 2.7Å
524	V	94.9	Very high	92.9	Very high	1 Å²	1	71.1 Å²	71.1	1%	0.006	38%	0.378	C	S	.	.	H	α-helix	trans	-58.2	-45.1	173.4	178.6	0	0	0	0	111.1	C504 I507 T520 L521 H526 L527 L528 M543	C504-V524 HydrophobicContact CB-CG1 3.94Å; I507-V524 HydrophobicContact CB-CG2 3.86Å; I507-V524 HydrophobicContact CD1-CG2 3.84Å; I507-V524 HydrophobicContact CG1-CG2 4.47Å; I507-V524 HydrophobicContact CG2-CG2 3.44Å; I507-V524 VanDerWaalsContact CG2-CG2 3.44Å; T520-V524 WeakPolarHBondContact O-CG2 3.28Å; T520-V524 PolarHBondContact O-N 3.33Å; T520-V524 VanDerWaalsContact O-N 3.08Å; L521-V524 PolarHBondContact O-N 3.32Å; V524-H526 VanDerWaalsContact C-N 3.28Å; V524-H526 PolarHBondContact O-N 2.93Å; V524-L527 PolarHBondContact O-N 2.69Å; V524-L528 HydrophobicContact CG1-CD1 4.06Å; V524-L528 HydrophobicContact CG1-CG 4.48Å; V524-L528 WeakPolarHBondContact O-CG 3.48Å; V524-L528 PolarHBondContact O-N 3.01Å; V524-M543 HydrophobicContact CG1-CE 4Å; V524-M543 HydrophobicContact CG1-SD 3.92Å
525	L	95.5	Very high	92.8	Very high	2 Å²	2	71.7 Å²	71.7	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-63.9	-34.7	176.6	-68	177	0	0	0	112.2	L521 R522 E523 R529 I540 M543 I554	L521-L525 VanDerWaalsContact O-CG 3.32Å; L521-L525 WeakPolarHBondContact O-CG 3.28Å; L521-L525 PolarHBondContact O-N 3.44Å; R522-L525 PolarHBondContact O-N 2.98Å; E523-L525 VanDerWaalsContact C-N 3.32Å; E523-L525 PolarHBondContact O-N 2.95Å; L525-R529 WeakPolarHBondContact O-CB 3.37Å; L525-R529 WeakPolarHBondContact O-CD 3.31Å; L525-R529 WeakPolarHBondContact O-CG 3.48Å; L525-R529 PolarHBondContact O-N 3Å; L525-R529 VanDerWaalsContact O-N 3.17Å; L525-I540 HydrophobicContact CD2-CB 4.25Å; L525-I540 HydrophobicContact CD2-CG1 3.9Å; L525-I540 HydrophobicContact CD2-CG2 4.04Å; L525-M543 HydrophobicContact CD2-CB 4.16Å; L525-M543 HydrophobicContact CD2-SD 4.26Å; L525-I554 HydrophobicContact CD1-CB 4.08Å; L525-I554 HydrophobicContact CD1-CD1 4.13Å; L525-I554 HydrophobicContact CD1-CG2 4.19Å
526	H	95	Very high	92.9	Very high	135 Å²	135	63 Å²	63	63%	0.625	33%	0.332	S	S	*	.	H	α-helix	trans	-67.3	-48.1	174.8	-177.5	72	0	0	0	111.7	R522 E523 V524 L528 R529 S530	R522-H526 PolarHBondContact O-N 3.47Å; E523-H526 WeakPolarHBondContact O-CB 3.4Å; E523-H526 PolarHBondContact O-N 2.84Å; E523-H526 VanDerWaalsContact O-N 3.08Å; V524-H526 VanDerWaalsContact C-N 3.28Å; V524-H526 PolarHBondContact O-N 2.93Å; H526-L528 VanDerWaalsContact C-N 3.32Å; H526-L528 PolarHBondContact O-N 3.43Å; H526-R529 PolarHBondContact O-N 3.49Å; H526-S530 PolarHBondContact O-N 2.99Å
527	L	95	Very high	92.9	Very high	16 Å²	16	67.1 Å²	67.1	8%	0.084	35%	0.351	C	S	.	.	H	α-helix	trans	-59	-41	175.8	-68.7	172.6	0	0	0	111.7	A481 K482 D485 K500 E523 V524 R529 S530	A481-L527 HydrophobicContact CB-CD1 3.95Å; K482-L527 HydrophobicContact CG-CD1 4.41Å; D485-L527 HydrophobicContact CB-CD2 3.82Å; K500-L527 WeakPolarHBondContact CE-O 3.42Å; K500-L527 PolarHBondContact NZ-O 3.17Å; E523-L527 WeakPolarHBondContact O-CG 3.29Å; E523-L527 PolarHBondContact O-N 2.7Å; V524-L527 PolarHBondContact O-N 2.69Å; L527-R529 PolarHBondContact O-N 2.96Å; L527-S530 PolarHBondContact O-N 3.24Å; L527-S530 PolarHBondContact O-OG 3.36Å
528	L	95.6	Very high	92.9	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-67.4	-36.8	178	-73.5	171.9	0	0	0	112.5	W497 C504 V524 H526 S530 T531 V536 M539 I540 M543	W497-L528 HydrophobicContact CH2-CD2 4.32Å; W497-L528 HydrophobicContact CZ3-CD2 4.39Å; C504-L528 HydrophobicContact CB-CD1 4.42Å; C504-L528 HydrophobicContact CB-CD2 3.87Å; C504-L528 HydrophobicContact CB-CG 4.16Å; V524-L528 HydrophobicContact CG1-CD1 4.06Å; V524-L528 HydrophobicContact CG1-CG 4.48Å; V524-L528 WeakPolarHBondContact O-CG 3.48Å; V524-L528 PolarHBondContact O-N 3.01Å; H526-L528 VanDerWaalsContact C-N 3.32Å; H526-L528 PolarHBondContact O-N 3.43Å; L528-S530 VanDerWaalsContact C-N 3.27Å; L528-S530 PolarHBondContact O-N 3.25Å; L528-T531 PolarHBondContact O-N 3.2Å; L528-V536 HydrophobicContact CB-CG1 4.18Å; L528-V536 VanDerWaalsContact O-CG1 3.26Å; L528-V536 WeakPolarHBondContact O-CG1 3.31Å; L528-V536 WeakPolarHBondContact O-CG2 3.47Å; L528-M539 HydrophobicContact CD1-CB 4.35Å; L528-M539 HydrophobicContact CD1-CE 4.12Å; L528-M539 HydrophobicContact CD2-CE 3.73Å; L528-M539 HydrophobicContact CD2-SD 4.26Å; L528-I540 HydrophobicContact CB-CD1 4.23Å; L528-I540 HydrophobicContact CB-CG1 4.23Å; L528-I540 HydrophobicContact CD1-CG1 4.19Å; L528-M543 HydrophobicContact CD1-CE 3.93Å; L528-M543 HydrophobicContact CD1-SD 3.67Å
529	R	94.1	Very high	93	Very high	146 Å²	146	67.7 Å²	67.7	55%	0.551	34%	0.343	S	S	*	.	H	α-helix	trans	-69.8	-19.8	-179.6	-77.4	171.1	-176.5	159	5	114.1	L525 H526 L527 T531 I540	L525-R529 WeakPolarHBondContact O-CB 3.37Å; L525-R529 WeakPolarHBondContact O-CD 3.31Å; L525-R529 WeakPolarHBondContact O-CG 3.48Å; L525-R529 PolarHBondContact O-N 3Å; L525-R529 VanDerWaalsContact O-N 3.17Å; H526-R529 PolarHBondContact O-N 3.49Å; L527-R529 PolarHBondContact O-N 2.96Å; R529-T531 PolarHBondContact O-N 2.95Å; R529-I540 HydrophobicContact CG-CD1 3.78Å
530	S	90.4	Very high	93.1	Very high	63 Å²	63	62.3 Å²	62.3	44%	0.441	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-11.9	176.1	63	0	0	0	0	112.7	D485 K500 H526 L527 L528	D485-S530 PolarHBondContact OD1-OG 2.72Å; K500-S530 PolarHBondContact NZ-OG 3.4Å; H526-S530 PolarHBondContact O-N 2.99Å; L527-S530 PolarHBondContact O-N 3.24Å; L527-S530 PolarHBondContact O-OG 3.36Å; L528-S530 VanDerWaalsContact C-N 3.27Å; L528-S530 PolarHBondContact O-N 3.25Å
531	T	89	Confident	93.2	Very high	16 Å²	16	69.6 Å²	69.6	10%	0.098	35%	0.345	C	S	.	.			trans	-103.3	135.8	-179.6	-58.6	0	0	0	0	112.4	E488 W497 K500 L528 R529 N533 V536	E488-T531 VanDerWaalsContact CD-OG1 3.29Å; E488-T531 WeakPolarHBondContact OE1-CG2 3.49Å; E488-T531 PolarHBondContact OE1-OG1 3.08Å; E488-T531 PolarHBondContact OE2-OG1 3.24Å; W497-T531 HydrophobicContact CD2-CG2 4.1Å; W497-T531 HydrophobicContact CE3-CG2 3.46Å; W497-T531 VanDerWaalsContact CE3-CG2 3.46Å; W497-T531 HydrophobicContact CH2-CG2 4.5Å; W497-T531 HydrophobicContact CZ3-CG2 3.68Å; K500-T531 PolarHBondContact NZ-OG1 3.37Å; L528-T531 PolarHBondContact O-N 3.2Å; R529-T531 PolarHBondContact O-N 2.95Å; T531-N533 VanDerWaalsContact C-N 3.27Å; T531-N533 HydrophobicContact CG2-CB 3.65Å; T531-N533 PolarHBondContact O-N 3.44Å; T531-V536 HydrophobicContact CG2-CG2 4.44Å
532	G	85.2	Confident	93.2	Very high	88 Å²	88	73.1 Å²	73.1	91%	0.907	36%	0.362	S	S	*	.			trans	-82.9	20.8	176.3	0	0	0	0	0	115.8
533	N	90	Very high	93.3	Very high	50 Å²	50	67.2 Å²	67.2	27%	0.267	34%	0.34	S	S	.	.			trans	-83.7	136.8	-175.5	-170.1	-65.1	0	0	0	111.4	W497 T531 Q535 V536	W497-N533 HydrophobicContact CD2-CB 4.13Å; W497-N533 HydrophobicContact CE3-CB 4.49Å; W497-N533 HydrophobicContact CH2-CB 4.21Å; W497-N533 HydrophobicContact CZ2-CB 3.83Å; W497-N533 PolarHBondContact NE1-ND2 3.42Å; W497-N533 VanDerWaalsContact NE1-ND2 3.14Å; T531-N533 VanDerWaalsContact C-N 3.27Å; T531-N533 HydrophobicContact CG2-CB 3.65Å; T531-N533 PolarHBondContact O-N 3.44Å; N533-Q535 PolarHBondContact O-N 3.43Å; N533-Q535 VanDerWaalsContact O-N 3.12Å; N533-Q535 WeakPolarHBondContact OD1-CB 3.47Å; N533-Q535 WeakPolarHBondContact OD1-CG 3.49Å; N533-Q535 PolarHBondContact OD1-N 3.31Å; N533-V536 HydrophobicContact CB-CG2 4.21Å; N533-V536 VanDerWaalsContact O-CB 3.25Å; N533-V536 WeakPolarHBondContact O-CB 3.33Å; N533-V536 VanDerWaalsContact O-CG2 3.32Å; N533-V536 WeakPolarHBondContact O-CG2 3.41Å; N533-V536 PolarHBondContact O-N 3.02Å
534	T	89.2	Confident	93.4	Very high	129 Å²	129	67.1 Å²	67.1	79%	0.791	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-24.1	-177.4	55.3	0	0	0	0	114	V536	T534-V536 VanDerWaalsContact C-N 3.3Å; T534-V536 PolarHBondContact O-N 3.21Å
535	Q	91.3	Very high	93.5	Very high	79 Å²	79	73.5 Å²	73.5	37%	0.369	37%	0.367	S	S	.	.	H	α-helix	trans	-72.4	-21.8	178.1	-63.2	177.2	-2.5	0	0	113.3	W497 N533 E537 Y538 M539	W497-Q535 HydrophobicContact CZ2-CB 4.16Å; N533-Q535 PolarHBondContact O-N 3.43Å; N533-Q535 VanDerWaalsContact O-N 3.12Å; N533-Q535 WeakPolarHBondContact OD1-CB 3.47Å; N533-Q535 WeakPolarHBondContact OD1-CG 3.49Å; N533-Q535 PolarHBondContact OD1-N 3.31Å; Q535-E537 VanDerWaalsContact C-N 3.33Å; Q535-E537 PolarHBondContact O-N 2.69Å; Q535-Y538 PolarHBondContact O-N 3.31Å; Q535-M539 PolarHBondContact O-N 3.4Å
536	V	93.6	Very high	93.5	Very high	10 Å²	10	75.2 Å²	75.2	6%	0.061	37%	0.373	C	S	.	.	H	α-helix	trans	-56.8	-45.7	-177.1	167.1	0	0	0	0	111.4	W497 L528 T531 N533 T534 Y538 M539 I540	W497-V536 HydrophobicContact CH2-CG2 3.42Å; W497-V536 VanDerWaalsContact CH2-CG2 3.42Å; W497-V536 HydrophobicContact CZ2-CG2 4.28Å; W497-V536 HydrophobicContact CZ3-CG2 3.86Å; L528-V536 HydrophobicContact CB-CG1 4.18Å; L528-V536 VanDerWaalsContact O-CG1 3.26Å; L528-V536 WeakPolarHBondContact O-CG1 3.31Å; L528-V536 WeakPolarHBondContact O-CG2 3.47Å; T531-V536 HydrophobicContact CG2-CG2 4.44Å; N533-V536 HydrophobicContact CB-CG2 4.21Å; N533-V536 VanDerWaalsContact O-CB 3.25Å; N533-V536 WeakPolarHBondContact O-CB 3.33Å; N533-V536 VanDerWaalsContact O-CG2 3.32Å; N533-V536 WeakPolarHBondContact O-CG2 3.41Å; N533-V536 PolarHBondContact O-N 3.02Å; T534-V536 VanDerWaalsContact C-N 3.3Å; T534-V536 PolarHBondContact O-N 3.21Å; V536-Y538 VanDerWaalsContact C-N 3.3Å; V536-Y538 PolarHBondContact O-N 3.05Å; V536-M539 PolarHBondContact O-N 3.36Å; V536-I540 HydrophobicContact CG1-CD1 3.53Å; V536-I540 HydrophobicContact CG1-CG1 4.19Å; V536-I540 WeakPolarHBondContact O-CB 3.29Å; V536-I540 WeakPolarHBondContact O-CG1 3.32Å; V536-I540 PolarHBondContact O-N 2.83Å
537	E	93.3	Very high	93.5	Very high	143 Å²	143	68.8 Å²	68.8	67%	0.668	34%	0.343	S	S	*	.	H	α-helix	trans	-62.1	-38.9	-177.1	-64.6	-168.5	163.3	0	0	112.5	Q535 R541	Q535-E537 VanDerWaalsContact C-N 3.33Å; Q535-E537 PolarHBondContact O-N 2.69Å; E537-R541 WeakPolarHBondContact O-CB 3.46Å; E537-R541 PolarHBondContact O-N 2.95Å
538	Y	94.8	Very high	93.5	Very high	155 Å²	155	76.7 Å²	76.7	61%	0.608	38%	0.377	S	S	*	.	H	α-helix	trans	-65.6	-46.7	177.9	179.2	-105.8	0	0	0	111.1	Q535 V536 R541 I542	Q535-Y538 PolarHBondContact O-N 3.31Å; V536-Y538 VanDerWaalsContact C-N 3.3Å; V536-Y538 PolarHBondContact O-N 3.05Å; Y538-R541 WeakPolarHBondContact O-CB 3.14Å; Y538-R541 PolarHBondContact O-N 3.11Å; Y538-I542 HydrophobicContact CD1-CD1 3.96Å; Y538-I542 HydrophobicContact CE1-CD1 3.42Å; Y538-I542 VanDerWaalsContact CE1-CD1 3.42Å; Y538-I542 HydrophobicContact CE2-CD1 4.16Å; Y538-I542 PolarHBondContact O-N 3.33Å
539	M	95.4	Very high	93.5	Very high	20 Å²	20	82.6 Å²	82.6	10%	0.099	40%	0.404	C	S	.	.	H	α-helix	trans	-61.3	-48	177.2	-67.3	176.8	60.7	0	0	111.9	R501 C504 V505 L528 Q535 V536 R541 I542 M543	R501-M539 HydrophobicContact CG-CE 4.01Å; R501-M539 HydrophobicContact CG-SD 3.62Å; C504-M539 HydrophobicContact CB-CE 4.35Å; V505-M539 HydrophobicContact CG2-CE 3.47Å; V505-M539 VanDerWaalsContact CG2-CE 3.47Å; L528-M539 HydrophobicContact CD1-CB 4.35Å; L528-M539 HydrophobicContact CD1-CE 4.12Å; L528-M539 HydrophobicContact CD2-CE 3.73Å; L528-M539 HydrophobicContact CD2-SD 4.26Å; Q535-M539 PolarHBondContact O-N 3.4Å; V536-M539 PolarHBondContact O-N 3.36Å; M539-R541 VanDerWaalsContact C-N 3.29Å; M539-R541 PolarHBondContact O-N 3.02Å; M539-I542 PolarHBondContact O-N 3.29Å; M539-M543 HydrophobicContact CE-CE 4.15Å; M539-M543 WeakPolarHBondContact O-CG 3.35Å; M539-M543 PolarHBondContact O-N 3.09Å
540	I	95.8	Very high	93.5	Very high	19 Å²	19	78.8 Å²	78.8	10%	0.097	40%	0.395	C	S	.	.	H	α-helix	trans	-59.2	-41.7	178.2	-72.1	178.2	0	0	0	110.6	L525 L528 R529 V536 I542 M543 K544	L525-I540 HydrophobicContact CD2-CB 4.25Å; L525-I540 HydrophobicContact CD2-CG1 3.9Å; L525-I540 HydrophobicContact CD2-CG2 4.04Å; L528-I540 HydrophobicContact CB-CD1 4.23Å; L528-I540 HydrophobicContact CB-CG1 4.23Å; L528-I540 HydrophobicContact CD1-CG1 4.19Å; R529-I540 HydrophobicContact CG-CD1 3.78Å; V536-I540 HydrophobicContact CG1-CD1 3.53Å; V536-I540 HydrophobicContact CG1-CG1 4.19Å; V536-I540 WeakPolarHBondContact O-CB 3.29Å; V536-I540 WeakPolarHBondContact O-CG1 3.32Å; V536-I540 PolarHBondContact O-N 2.83Å; I540-I542 VanDerWaalsContact C-N 3.34Å; I540-I542 PolarHBondContact O-N 3.38Å; I540-M543 PolarHBondContact O-N 3.09Å; I540-K544 HydrophobicContact CG2-CD 3.87Å; I540-K544 HydrophobicContact CG2-CG 4.11Å; I540-K544 WeakPolarHBondContact O-CB 3.14Å; I540-K544 VanDerWaalsContact O-CG 3.23Å; I540-K544 WeakPolarHBondContact O-CG 3.33Å; I540-K544 PolarHBondContact O-N 3.49Å
541	R	95.7	Very high	93.6	Very high	168 Å²	168	86.9 Å²	86.9	63%	0.634	42%	0.416	S	S	*	.	H	α-helix	trans	-59.7	-44.1	178.5	-170.8	-175.3	-56.7	178.5	3.2	112	E537 Y538 M539 K545	E537-R541 WeakPolarHBondContact O-CB 3.46Å; E537-R541 PolarHBondContact O-N 2.95Å; Y538-R541 WeakPolarHBondContact O-CB 3.14Å; Y538-R541 PolarHBondContact O-N 3.11Å; M539-R541 VanDerWaalsContact C-N 3.29Å; M539-R541 PolarHBondContact O-N 3.02Å; R541-K545 WeakPolarHBondContact O-CB 3.48Å; R541-K545 PolarHBondContact O-N 3.16Å
542	I	95.3	Very high	93.7	Very high	73 Å²	73	86.7 Å²	86.7	37%	0.374	42%	0.415	S	S	.	.	H	α-helix	trans	-64.3	-50	177.5	-66.9	170.3	0	0	0	110.6	F508 Y538 M539 I540 K544 K545 W546	F508-I542 HydrophobicContact CE1-CG2 4.49Å; Y538-I542 HydrophobicContact CD1-CD1 3.96Å; Y538-I542 HydrophobicContact CE1-CD1 3.42Å; Y538-I542 VanDerWaalsContact CE1-CD1 3.42Å; Y538-I542 HydrophobicContact CE2-CD1 4.16Å; Y538-I542 PolarHBondContact O-N 3.33Å; M539-I542 PolarHBondContact O-N 3.29Å; I540-I542 VanDerWaalsContact C-N 3.34Å; I540-I542 PolarHBondContact O-N 3.38Å; I542-K544 VanDerWaalsContact C-N 3.32Å; I542-K544 PolarHBondContact O-N 2.97Å; I542-K545 WeakPolarHBondContact O-CB 3.45Å; I542-K545 PolarHBondContact O-N 3.12Å; I542-W546 PolarHBondContact O-N 3.37Å
543	M	96.8	Very high	93.8	Very high	5 Å²	5	86.7 Å²	86.7	3%	0.025	40%	0.398	C	S	.	.	H	α-helix	trans	-60.1	-41.4	-179.8	-72.1	173.2	-178.1	0	0	112	F508 L521 V524 L525 L528 M539 I540 W546 A547	F508-M543 HydrophobicContact CB-CE 3.79Å; F508-M543 HydrophobicContact CD1-CE 4.46Å; F508-M543 HydrophobicContact CD1-CG 4.25Å; F508-M543 HydrophobicContact CD2-CG 3.87Å; F508-M543 HydrophobicContact CE1-CG 4.4Å; F508-M543 HydrophobicContact CE2-CB 4.35Å; F508-M543 HydrophobicContact CE2-CG 4.03Å; F508-M543 HydrophobicContact CG-CE 4.1Å; F508-M543 HydrophobicContact CG-CG 3.98Å; F508-M543 HydrophobicContact CZ-CG 4.3Å; L521-M543 HydrophobicContact CD1-CB 4.18Å; L521-M543 HydrophobicContact CD1-CG 4.35Å; L521-M543 HydrophobicContact CD1-SD 4.39Å; V524-M543 HydrophobicContact CG1-CE 4Å; V524-M543 HydrophobicContact CG1-SD 3.92Å; L525-M543 HydrophobicContact CD2-CB 4.16Å; L525-M543 HydrophobicContact CD2-SD 4.26Å; L528-M543 HydrophobicContact CD1-CE 3.93Å; L528-M543 HydrophobicContact CD1-SD 3.67Å; M539-M543 HydrophobicContact CE-CE 4.15Å; M539-M543 WeakPolarHBondContact O-CG 3.35Å; M539-M543 PolarHBondContact O-N 3.09Å; I540-M543 PolarHBondContact O-N 3.09Å; M543-W546 PolarHBondContact O-N 3.15Å; M543-A547 WeakPolarHBondContact O-CB 3.29Å; M543-A547 PolarHBondContact O-N 3.06Å
544	K	95.9	Very high	93.5	Very high	91 Å²	91	88.8 Å²	88.8	40%	0.396	41%	0.409	S	S	.	.	H	α-helix	trans	-64.8	-40.9	175.3	-74.8	-174.1	169.4	-175.4	0	112.9	I540 I542 A547 K548 I554	I540-K544 HydrophobicContact CG2-CD 3.87Å; I540-K544 HydrophobicContact CG2-CG 4.11Å; I540-K544 WeakPolarHBondContact O-CB 3.14Å; I540-K544 VanDerWaalsContact O-CG 3.23Å; I540-K544 WeakPolarHBondContact O-CG 3.33Å; I540-K544 PolarHBondContact O-N 3.49Å; I542-K544 VanDerWaalsContact C-N 3.32Å; I542-K544 PolarHBondContact O-N 2.97Å; K544-A547 PolarHBondContact O-N 2.93Å; K544-K548 PolarHBondContact O-N 3.48Å; K544-I554 HydrophobicContact CB-CD1 4.1Å; K544-I554 HydrophobicContact CD-CD1 4.43Å; K544-I554 HydrophobicContact CG-CD1 3.59Å
545	K	96.5	Very high	93.8	Very high	136 Å²	136	86.8 Å²	86.8	59%	0.591	39%	0.39	S	S	*	.	H	α-helix	trans	-60.4	-49.8	176.3	179.6	-178.6	171.3	-176.6	0	110.3	R541 I542 A547 K548 E549	R541-K545 WeakPolarHBondContact O-CB 3.48Å; R541-K545 PolarHBondContact O-N 3.16Å; I542-K545 WeakPolarHBondContact O-CB 3.45Å; I542-K545 PolarHBondContact O-N 3.12Å; K545-A547 VanDerWaalsContact C-N 3.35Å; K545-A547 PolarHBondContact O-N 3.2Å; K545-K548 PolarHBondContact O-N 3.15Å; K545-E549 WeakPolarHBondContact CE-OE1 3.38Å; K545-E549 WeakPolarHBondContact CG-OE1 3.48Å; K545-E549 IonicContact NZ-OE1 2.72Å; K545-E549 WeakPolarHBondContact O-CG 3.4Å; K545-E549 PolarHBondContact O-N 3.44Å
546	W	95.9	Very high	93.9	Very high	37 Å²	37	87.2 Å²	87.2	14%	0.14	39%	0.391	C	S	.	.	H	α-helix	trans	-60.1	-43.5	177.1	179.2	88.8	0	0	0	112.2	F508 I511 V512 K518 L521 I542 M543 K548 E549 N550 V552	F508-W546 HydrophobicContact CE2-CB 4.06Å; F508-W546 AromaticContact CE2-CD2 3.76Å; F508-W546 HydrophobicContact CE2-CD2 3.76Å; F508-W546 AromaticContact CE2-CE3 3.7Å; F508-W546 HydrophobicContact CE2-CE3 3.7Å; F508-W546 AromaticContact CE2-CG 3.92Å; F508-W546 HydrophobicContact CE2-CG 3.92Å; F508-W546 HydrophobicContact CE2-CZ3 4.46Å; F508-W546 HydrophobicContact CZ-CB 3.67Å; F508-W546 HydrophobicContact CZ-CD2 4.01Å; F508-W546 HydrophobicContact CZ-CE3 4.39Å; F508-W546 AromaticContact CZ-CG 3.67Å; F508-W546 HydrophobicContact CZ-CG 3.67Å; I511-W546 HydrophobicContact CG2-CH2 3.47Å; I511-W546 VanDerWaalsContact CG2-CH2 3.47Å; I511-W546 HydrophobicContact CG2-CZ2 4.34Å; I511-W546 HydrophobicContact CG2-CZ3 3.77Å; V512-W546 HydrophobicContact CG2-CD2 4.32Å; V512-W546 HydrophobicContact CG2-CZ2 4.04Å; K518-W546 HydrophobicContact CG-CH2 4.46Å; L521-W546 HydrophobicContact CD2-CE3 4.06Å; L521-W546 HydrophobicContact CD2-CZ3 4.04Å; I542-W546 PolarHBondContact O-N 3.37Å; M543-W546 PolarHBondContact O-N 3.15Å; W546-K548 VanDerWaalsContact C-N 3.33Å; W546-K548 PolarHBondContact O-N 2.75Å; W546-E549 PolarHBondContact O-N 3.2Å; W546-N550 HydrophobicContact CH2-CB 4.36Å; W546-N550 HydrophobicContact CZ2-CB 4.18Å; W546-N550 PolarHBondContact NE1-ND2 3.16Å; W546-N550 VanDerWaalsContact NE1-ND2 3.15Å; W546-N550 WeakPolarHBondContact O-CB 3.49Å; W546-N550 PolarHBondContact O-N 3.17Å; W546-N550 PolarHBondContact O-ND2 3.48Å; W546-V552 HydrophobicContact CH2-CG2 4.12Å; W546-V552 HydrophobicContact CZ3-CG2 3.82Å
547	A	95.1	Very high	93.9	Very high	0 Å²	0	91.5 Å²	91.5	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-58.7	-44	177.6	0	0	0	0	0	111.8	L521 M543 K544 K545 N550 R551 V552 I554	L521-A547 HydrophobicContact CD2-CB 3.79Å; M543-A547 WeakPolarHBondContact O-CB 3.29Å; M543-A547 PolarHBondContact O-N 3.06Å; K544-A547 PolarHBondContact O-N 2.93Å; K545-A547 VanDerWaalsContact C-N 3.35Å; K545-A547 PolarHBondContact O-N 3.2Å; A547-N550 CarbonylContact O-C 3.59Å; A547-N550 PolarHBondContact O-N 3.07Å; A547-R551 PolarHBondContact O-N 3.44Å; A547-V552 HydrophobicContact CB-CB 4.15Å; A547-V552 PolarHBondContact O-N 3.37Å; A547-I554 HydrophobicContact CB-CD1 4.05Å; A547-I554 HydrophobicContact CB-CG1 4.23Å; A547-I554 HydrophobicContact CB-CG2 3.74Å
548	K	95.7	Very high	93.9	Very high	182 Å²	182	88.5 Å²	88.5	79%	0.791	39%	0.394	S	S	*	.	H	α-helix	trans	-62.5	-46.5	176	-175.1	-178.5	178.7	-178.1	0	111.9	K544 K545 W546 N550 R551	K544-K548 PolarHBondContact O-N 3.48Å; K545-K548 PolarHBondContact O-N 3.15Å; W546-K548 VanDerWaalsContact C-N 3.33Å; W546-K548 PolarHBondContact O-N 2.75Å; K548-N550 VanDerWaalsContact C-N 3.26Å; K548-N550 PolarHBondContact O-N 3.49Å; K548-R551 PolarHBondContact O-N 3.08Å
549	E	95.3	Very high	93.9	Very high	124 Å²	124	84.3 Å²	84.3	58%	0.579	38%	0.381	S	S	*	.	H	α-helix	trans	-62.5	-34.1	178.8	-72.5	170.2	178.9	0	0	112.1	K545 W546	K545-E549 WeakPolarHBondContact CE-OE1 3.38Å; K545-E549 WeakPolarHBondContact CG-OE1 3.48Å; K545-E549 IonicContact NZ-OE1 2.72Å; K545-E549 WeakPolarHBondContact O-CG 3.4Å; K545-E549 PolarHBondContact O-N 3.44Å; W546-E549 PolarHBondContact O-N 3.2Å
550	N	94	Very high	93.8	Very high	67 Å²	67	88.6 Å²	88.6	36%	0.358	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	11.1	-177.2	-69.6	-89.7	0	0	0	113.9	W546 A547 K548 V552	W546-N550 HydrophobicContact CH2-CB 4.36Å; W546-N550 HydrophobicContact CZ2-CB 4.18Å; W546-N550 PolarHBondContact NE1-ND2 3.16Å; W546-N550 VanDerWaalsContact NE1-ND2 3.15Å; W546-N550 WeakPolarHBondContact O-CB 3.49Å; W546-N550 PolarHBondContact O-N 3.17Å; W546-N550 PolarHBondContact O-ND2 3.48Å; A547-N550 CarbonylContact O-C 3.59Å; A547-N550 PolarHBondContact O-N 3.07Å; K548-N550 VanDerWaalsContact C-N 3.26Å; K548-N550 PolarHBondContact O-N 3.49Å; N550-V552 HydrophobicContact CB-CG2 4.08Å; N550-V552 PolarHBondContact O-N 2.86Å
551	R	92	Very high	93.6	Very high	233 Å²	233	93.6 Å²	93.6	88%	0.879	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	37.1	179.7	-54.9	179.9	-176.9	-178.2	0.3	113.6	A547 K548	A547-R551 PolarHBondContact O-N 3.44Å; K548-R551 PolarHBondContact O-N 3.08Å
552	V	91	Very high	93.5	Very high	12 Å²	12	87.8 Å²	87.8	7%	0.073	41%	0.405	C	S	.	.			trans	-88.2	120.9	175.9	-175.3	0	0	0	0	109.3	K518 W546 A547 N550 I554	K518-V552 HydrophobicContact CB-CG1 3.88Å; K518-V552 HydrophobicContact CB-CG2 4.18Å; K518-V552 HydrophobicContact CD-CG2 3.81Å; K518-V552 HydrophobicContact CG-CG2 4.23Å; W546-V552 HydrophobicContact CH2-CG2 4.12Å; W546-V552 HydrophobicContact CZ3-CG2 3.82Å; A547-V552 HydrophobicContact CB-CB 4.15Å; A547-V552 PolarHBondContact O-N 3.37Å; N550-V552 HydrophobicContact CB-CG2 4.08Å; N550-V552 PolarHBondContact O-N 2.86Å; V552-I554 HydrophobicContact CG1-CG2 4.45Å; V552-I554 PolarHBondContact O-N 3.11Å
553	P	87.2	Confident	93.3	Very high	87 Å²	87	89.1 Å²	89.1	57%	0.565	41%	0.407	S	S	*	.			trans	-76.1	110.5	178.5	31	-33.2	0	0	0	109.8	R522	R522-P553 VanDerWaalsContact CZ-O 3.29Å; R522-P553 PolarHBondContact NE-O 3Å; R522-P553 PolarHBondContact NH2-O 3.08Å
554	I	84.6	Confident	93	Very high	95 Å²	95	96.7 Å²	96.7	49%	0.487	44%	0.442	S	S	.	.			trans	-103.3	0	179.1	49.7	164.3	0	0	0	113.5	L521 R522 L525 K544 A547 V552	L521-I554 HydrophobicContact CB-CG2 4.39Å; L521-I554 HydrophobicContact CD2-CG2 3.66Å; L521-I554 HydrophobicContact CG-CG2 3.95Å; R522-I554 WeakPolarHBondContact CG-OXT 3.24Å; L525-I554 HydrophobicContact CD1-CB 4.08Å; L525-I554 HydrophobicContact CD1-CD1 4.13Å; L525-I554 HydrophobicContact CD1-CG2 4.19Å; K544-I554 HydrophobicContact CB-CD1 4.1Å; K544-I554 HydrophobicContact CD-CD1 4.43Å; K544-I554 HydrophobicContact CG-CD1 3.59Å; A547-I554 HydrophobicContact CB-CD1 4.05Å; A547-I554 HydrophobicContact CB-CG1 4.23Å; A547-I554 HydrophobicContact CB-CG2 3.74Å; V552-I554 HydrophobicContact CG1-CG2 4.45Å; V552-I554 PolarHBondContact O-N 3.11Å

Retrieved 554 of 554 residues in 1678.4 ms (Link to these results)

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