A0A077ZIJ5_TRITR Loading...

CCHC-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZIJ5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 355 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	38.3	Very low	35	Very low	230 Å²	230	138.5 Å²	138.5	100%	1.133	67%	0.672	S	S	*	*				0	0.9	0	-77.5	178.6	170.6	0	0	114.6
2	L	35.6	Very low	35.4	Very low	168 Å²	168	130.9 Å²	130.9	88%	0.88	64%	0.643	S	S	*	*			trans	-96.2	-2.2	177.5	-80	155.4	0	0	0	114.6
3	T	34.7	Very low	36	Very low	118 Å²	118	124.7 Å²	124.7	72%	0.724	61%	0.608	S	S	*	*	S	Bend	trans	-93.7	-15.8	-175.5	45.4	0	0	0	0	114.3
4	M	33.3	Very low	36.5	Very low	143 Å²	143	126.9 Å²	126.9	70%	0.704	61%	0.607	S	S	*	*	H	α-helix	trans	-80.5	-24	-179.1	-76.8	178.1	68.5	0	0	114	F6 F7	M4-F6 PolarHBondContact O-N 3.14Å; M4-F7 PolarHBondContact O-N 3.35Å
5	G	34	Very low	36.8	Very low	51 Å²	51	122 Å²	122	53%	0.526	59%	0.588	S	S	.	*	H	α-helix	trans	-70.7	-26.9	-179.8	0	0	0	0	0	114.5
6	F	33	Very low	37.2	Very low	176 Å²	176	117.1 Å²	117.1	77%	0.772	57%	0.569	S	S	*	*	H	α-helix	trans	-77.7	-31.6	177.4	-96.9	-90.5	0	0	0	112.9	M4 W8	M4-F6 PolarHBondContact O-N 3.14Å; F6-W8 VanDerWaalsContact C-N 3.34Å; F6-W8 PolarHBondContact O-N 3.38Å
7	F	31.6	Very low	37.4	Very low	166 Å²	166	111.8 Å²	111.8	73%	0.728	54%	0.542	S	S	*	.	H	α-helix	trans	-70.8	-32.9	-178.1	-131.4	-95.9	0	0	0	111.9	M4 W11	M4-F7 PolarHBondContact O-N 3.35Å; F7-W11 WeakPolarHBondContact O-CB 3.34Å; F7-W11 PolarHBondContact O-N 2.86Å
8	W	35.5	Very low	37.4	Very low	102 Å²	102	114.8 Å²	114.8	39%	0.386	55%	0.547	S	S	.	.	H	α-helix	trans	-82.1	-33.8	-177.3	-97.4	74.3	0	0	0	114.9	F6 S10 W11 C12 V84	F6-W8 VanDerWaalsContact C-N 3.34Å; F6-W8 PolarHBondContact O-N 3.38Å; W8-S10 VanDerWaalsContact C-N 3.29Å; W8-S10 PolarHBondContact O-N 3.46Å; W8-W11 HydrophobicContact CD2-CE3 4.44Å; W8-W11 HydrophobicContact CE3-CE3 4.23Å; W8-W11 HydrophobicContact CH2-CE3 4.29Å; W8-W11 HydrophobicContact CH2-CZ3 4Å; W8-W11 HydrophobicContact CZ2-CE3 4.46Å; W8-W11 HydrophobicContact CZ2-CZ3 4.38Å; W8-W11 HydrophobicContact CZ3-CE3 4.14Å; W8-W11 HydrophobicContact CZ3-CZ3 4.12Å; W8-W11 CarbonylContact O-C 3.59Å; W8-W11 PolarHBondContact O-N 3.36Å; W8-W11 VanDerWaalsContact O-N 3.12Å; W8-C12 WeakPolarHBondContact O-CB 3.36Å; W8-C12 PolarHBondContact O-N 3.42Å; W8-V84 HydrophobicContact CH2-CG1 3.99Å; W8-V84 HydrophobicContact CZ3-CG1 3.68Å
9	R	36.4	Very low	37.6	Very low	187 Å²	187	111.9 Å²	111.9	71%	0.706	53%	0.534	S	S	*	.	H	α-helix	trans	-61.3	-42.9	170.6	-77.1	-176.1	174.9	-146.3	-3.7	110.8	W11 Y13	R9-W11 VanDerWaalsContact C-N 3.34Å; R9-W11 PolarHBondContact O-N 3.39Å; R9-Y13 WeakPolarHBondContact O-CB 3.23Å; R9-Y13 PolarHBondContact O-N 3.24Å; R9-Y13 VanDerWaalsContact O-N 3.13Å
10	S	36.4	Very low	37.6	Very low	44 Å²	44	112.3 Å²	112.3	31%	0.308	53%	0.534	S	S	.	.	H	α-helix	trans	-67.1	-32.8	173.1	-160.7	0	0	0	0	112.4	W8 R14	W8-S10 VanDerWaalsContact C-N 3.29Å; W8-S10 PolarHBondContact O-N 3.46Å; S10-R14 WeakPolarHBondContact O-CA 3.1Å; S10-R14 WeakPolarHBondContact O-CB 3.49Å; S10-R14 VanDerWaalsContact O-CG 3.25Å; S10-R14 WeakPolarHBondContact O-CG 3.25Å; S10-R14 PolarHBondContact O-N 3.44Å
11	W	36.9	Very low	37.8	Very low	139 Å²	139	112 Å²	112	53%	0.527	54%	0.539	S	S	.	.	H	α-helix	trans	-77.1	-40	178.6	-165	73.6	0	0	0	113.7	F7 W8 R9 Y13 T15	F7-W11 WeakPolarHBondContact O-CB 3.34Å; F7-W11 PolarHBondContact O-N 2.86Å; W8-W11 HydrophobicContact CD2-CE3 4.44Å; W8-W11 HydrophobicContact CE3-CE3 4.23Å; W8-W11 HydrophobicContact CH2-CE3 4.29Å; W8-W11 HydrophobicContact CH2-CZ3 4Å; W8-W11 HydrophobicContact CZ2-CE3 4.46Å; W8-W11 HydrophobicContact CZ2-CZ3 4.38Å; W8-W11 HydrophobicContact CZ3-CE3 4.14Å; W8-W11 HydrophobicContact CZ3-CZ3 4.12Å; W8-W11 CarbonylContact O-C 3.59Å; W8-W11 PolarHBondContact O-N 3.36Å; W8-W11 VanDerWaalsContact O-N 3.12Å; R9-W11 VanDerWaalsContact C-N 3.34Å; R9-W11 PolarHBondContact O-N 3.39Å; W11-Y13 VanDerWaalsContact C-N 3.33Å; W11-T15 VanDerWaalsContact CD1-OG1 3.26Å; W11-T15 VanDerWaalsContact CE2-OG1 3.27Å; W11-T15 HydrophobicContact CZ2-CG2 4.24Å; W11-T15 PolarHBondContact NE1-OG1 2.74Å; W11-T15 VanDerWaalsContact NE1-OG1 3.13Å; W11-T15 WeakPolarHBondContact O-CA 3.35Å; W11-T15 WeakPolarHBondContact O-CB 3Å; W11-T15 PolarHBondContact O-N 3.43Å; W11-T15 PolarHBondContact O-OG1 2.71Å
12	C	39.8	Very low	37.8	Very low	47 Å²	47	106.5 Å²	106.5	32%	0.318	51%	0.514	S	S	.	.	H	α-helix	trans	-66.2	-40.8	175	-156.2	0	0	0	0	109.9	W8 C16	W8-C12 WeakPolarHBondContact O-CB 3.36Å; W8-C12 PolarHBondContact O-N 3.42Å; C12-C16 WeakPolarHBondContact O-CB 3.29Å; C12-C16 PolarHBondContact O-N 3.03Å; C12-C16 VanDerWaalsContact O-N 3.11Å; C12-C16 PolarHBondContact O-SG 3.32Å
13	Y	42.5	Very low	37.9	Very low	50 Å²	50	106.8 Å²	106.8	20%	0.196	51%	0.509	C	S	.	.	H	α-helix	trans	-68.7	-49.4	173.7	-129	-77.1	0	0	0	112	R9 W11 Y17 R174 R175 Q177	R9-Y13 WeakPolarHBondContact O-CB 3.23Å; R9-Y13 PolarHBondContact O-N 3.24Å; R9-Y13 VanDerWaalsContact O-N 3.13Å; W11-Y13 VanDerWaalsContact C-N 3.33Å; Y13-Y17 AromaticContact CD1-CD2 3.99Å; Y13-Y17 HydrophobicContact CD1-CD2 3.99Å; Y13-Y17 AromaticContact CE1-CD2 3.77Å; Y13-Y17 HydrophobicContact CE1-CD2 3.77Å; Y13-Y17 AromaticContact CE1-CE2 3.86Å; Y13-Y17 HydrophobicContact CE1-CE2 3.86Å; Y13-Y17 VanDerWaalsContact O-CB 3.25Å; Y13-Y17 WeakPolarHBondContact O-CB 3.18Å; Y13-Y17 PolarHBondContact O-N 3.2Å; Y13-R174 PolarHBondContact OH-O 3.19Å; Y13-R175 WeakPolarHBondContact OH-CA 3.32Å; Y13-Q177 HydrophobicContact CD1-CG 4.07Å; Y13-Q177 HydrophobicContact CE1-CG 3.33Å
14	R	42.9	Very low	37.9	Very low	156 Å²	156	111.3 Å²	111.3	59%	0.589	52%	0.518	S	S	*	.	H	α-helix	trans	-71.5	-30.7	-179.1	-79	178.8	160.5	-153.6	-3.5	114.1	S10 R18	S10-R14 WeakPolarHBondContact O-CA 3.1Å; S10-R14 WeakPolarHBondContact O-CB 3.49Å; S10-R14 VanDerWaalsContact O-CG 3.25Å; S10-R14 WeakPolarHBondContact O-CG 3.25Å; S10-R14 PolarHBondContact O-N 3.44Å; R14-R18 WeakPolarHBondContact O-CA 3.43Å; R14-R18 WeakPolarHBondContact O-CB 3.5Å; R14-R18 WeakPolarHBondContact O-CG 3.26Å; R14-R18 PolarHBondContact O-N 3.01Å
15	T	41.4	Very low	37.9	Very low	53 Å²	53	108.7 Å²	108.7	33%	0.325	51%	0.514	S	S	.	.	H	α-helix	trans	-82.4	-42.1	-178.6	-50.7	0	0	0	0	109.8	W11 Y17 I19	W11-T15 VanDerWaalsContact CD1-OG1 3.26Å; W11-T15 VanDerWaalsContact CE2-OG1 3.27Å; W11-T15 HydrophobicContact CZ2-CG2 4.24Å; W11-T15 PolarHBondContact NE1-OG1 2.74Å; W11-T15 VanDerWaalsContact NE1-OG1 3.13Å; W11-T15 WeakPolarHBondContact O-CA 3.35Å; W11-T15 WeakPolarHBondContact O-CB 3Å; W11-T15 PolarHBondContact O-N 3.43Å; W11-T15 PolarHBondContact O-OG1 2.71Å; T15-Y17 VanDerWaalsContact C-N 3.32Å; T15-Y17 PolarHBondContact O-N 3.4Å; T15-I19 WeakPolarHBondContact O-CD1 3.38Å
16	C	43.6	Very low	37.9	Very low	43 Å²	43	112.6 Å²	112.6	29%	0.291	53%	0.527	S	S	.	.	H	α-helix	trans	-67.4	-29.2	171.8	-64.3	0	0	0	0	112.8	C12	C12-C16 WeakPolarHBondContact O-CB 3.29Å; C12-C16 PolarHBondContact O-N 3.03Å; C12-C16 VanDerWaalsContact O-N 3.11Å; C12-C16 PolarHBondContact O-SG 3.32Å
17	Y	39.6	Very low	37.8	Very low	27 Å²	27	110 Å²	110	11%	0.106	53%	0.526	C	S	.	.	H	α-helix	trans	-95.4	-23.6	177.3	-99.6	-87.7	0	0	0	116.5	Y13 T15 I19 F20 V21 P142 Q177	Y13-Y17 AromaticContact CD1-CD2 3.99Å; Y13-Y17 HydrophobicContact CD1-CD2 3.99Å; Y13-Y17 AromaticContact CE1-CD2 3.77Å; Y13-Y17 HydrophobicContact CE1-CD2 3.77Å; Y13-Y17 AromaticContact CE1-CE2 3.86Å; Y13-Y17 HydrophobicContact CE1-CE2 3.86Å; Y13-Y17 VanDerWaalsContact O-CB 3.25Å; Y13-Y17 WeakPolarHBondContact O-CB 3.18Å; Y13-Y17 PolarHBondContact O-N 3.2Å; T15-Y17 VanDerWaalsContact C-N 3.32Å; T15-Y17 PolarHBondContact O-N 3.4Å; Y17-I19 PolarHBondContact O-N 3.04Å; Y17-F20 HydrophobicContact CD1-CB 4.46Å; Y17-F20 WeakPolarHBondContact O-CB 3.28Å; Y17-F20 PolarHBondContact O-N 2.79Å; Y17-V21 PolarHBondContact O-N 3.29Å; Y17-P142 HydrophobicContact CE1-CB 4.4Å; Y17-Q177 VanDerWaalsContact CD1-NE2 3.26Å; Y17-Q177 PolarHBondContact OH-NE2 3.38Å
18	R	38.4	Very low	37.8	Very low	167 Å²	167	109.8 Å²	109.8	63%	0.63	53%	0.527	S	S	*	.	H	α-helix	trans	-63	-25.6	177.1	-95.4	-179.6	153.1	-179	-7.2	112.8	R14 F20 N22	R14-R18 WeakPolarHBondContact O-CA 3.43Å; R14-R18 WeakPolarHBondContact O-CB 3.5Å; R14-R18 WeakPolarHBondContact O-CG 3.26Å; R14-R18 PolarHBondContact O-N 3.01Å; R18-F20 PolarHBondContact O-N 2.95Å; R18-N22 PolarHBondContact O-N 3.27Å
19	I	40.3	Very low	37.6	Very low	60 Å²	60	111.2 Å²	111.2	31%	0.308	54%	0.542	S	S	.	.	H	α-helix	trans	-59.6	-29.4	171.6	-66.6	152	0	0	0	111.2	T15 Y17 E132	T15-I19 WeakPolarHBondContact O-CD1 3.38Å; Y17-I19 PolarHBondContact O-N 3.04Å; I19-E132 HydrophobicContact CD1-CG 3.75Å; I19-E132 WeakPolarHBondContact CD1-OE1 3.22Å; I19-E132 WeakPolarHBondContact CG1-OE1 3.42Å; I19-E132 HydrophobicContact CG2-CG 4.03Å; I19-E132 WeakPolarHBondContact CG2-OE1 3.01Å; I19-E132 WeakPolarHBondContact CG2-OE2 3.28Å
20	F	37.8	Very low	37.6	Very low	119 Å²	119	108.6 Å²	108.6	52%	0.522	54%	0.542	S	S	.	.	H	α-helix	trans	-94.1	-26.5	-173.6	-139.7	-91.6	0	0	0	114.4	Y17 R18 P142	Y17-F20 HydrophobicContact CD1-CB 4.46Å; Y17-F20 WeakPolarHBondContact O-CB 3.28Å; Y17-F20 PolarHBondContact O-N 2.79Å; R18-F20 PolarHBondContact O-N 2.95Å; F20-P142 HydrophobicContact CD1-CG 3.82Å; F20-P142 HydrophobicContact CD2-CG 3.59Å; F20-P142 HydrophobicContact CE1-CG 3.48Å; F20-P142 VanDerWaalsContact CE1-CG 3.48Å; F20-P142 HydrophobicContact CE2-CG 3.24Å; F20-P142 HydrophobicContact CG-CG 3.88Å; F20-P142 HydrophobicContact CZ-CG 3.2Å
21	V	42.9	Very low	37.3	Very low	107 Å²	107	113.1 Å²	113.1	65%	0.648	56%	0.563	S	S	*	*	H	α-helix	trans	-89.6	-24.2	-176.8	-179.5	0	0	0	0	112.8	Y17	Y17-V21 PolarHBondContact O-N 3.29Å
22	N	38.2	Very low	37	Very low	114 Å²	114	118.1 Å²	118.1	61%	0.61	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	9	-177	-94	-6.4	0	0	0	115.5	R18	R18-N22 PolarHBondContact O-N 3.27Å
23	K	37.9	Very low	36.4	Very low	174 Å²	174	125.3 Å²	125.3	76%	0.757	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	9.1	179.9	-101.1	-178.7	178.1	173.1	0	115.5
24	K	34.4	Very low	35.7	Very low	212 Å²	212	131.3 Å²	131.3	92%	0.922	63%	0.632	S	S	*	*	S	Bend	trans	-99.2	15.3	172.5	-91	-169.1	172.9	-172.8	0	114.6
25	S	32.6	Very low	35.2	Very low	88 Å²	88	127.6 Å²	127.6	62%	0.615	64%	0.643	S	S	*	*	S	Bend	trans	-148.3	50.5	-178.4	66.1	0	0	0	0	113.4
26	V	33.8	Very low	34.6	Very low	133 Å²	133	130.4 Å²	130.4	81%	0.806	66%	0.664	S	S	*	*			trans	-151.7	80	156.1	-171.1	0	0	0	0	107.5
27	T	31.3	Very low	33.9	Very low	121 Å²	121	136.9 Å²	136.9	74%	0.742	69%	0.69	S	S	*	*			trans	-74.5	153.3	149.9	38.8	0	0	0	0	108.2
28	E	30.7	Very low	33.5	Very low	163 Å²	163	140 Å²	140	76%	0.762	71%	0.712	S	S	*	*			trans	87.9	117.5	165.2	-64.8	169.7	171.7	0	0	117.9
29	D	31.8	Very low	33	Very low	132 Å²	132	141.4 Å²	141.4	71%	0.706	73%	0.726	S	S	*	*			trans	110.1	115.3	133.3	-71.8	-2.9	0	0	0	121.8
30	N	36.1	Very low	32.6	Very low	131 Å²	131	148.8 Å²	148.8	70%	0.701	75%	0.75	S	S	*	*			trans	95.7	82.6	138.6	-59.2	-27	0	0	0	120.5
31	N	29.9	Very low	32.2	Very low	140 Å²	140	147.9 Å²	147.9	75%	0.749	76%	0.764	S	S	*	*				15.6	111.1	114.9	-157.7	13.4	0	0	0	117.7
32	W	30.1	Very low	32	Very low	243 Å²	243	148.3 Å²	148.3	92%	0.92	77%	0.767	S	S	*	*			trans	-146.5	135.6	149.6	-81.9	101.7	0	0	0	111.9
33	R	28.2	Very low	31.8	Very low	198 Å²	198	151.9 Å²	151.9	75%	0.747	78%	0.779	S	S	*	*			trans	-80.1	154	-172.5	-73.2	178.3	171.4	-138.3	0.9	114
34	Q	28.4	Very low	31.8	Very low	177 Å²	177	149.2 Å²	149.2	83%	0.827	77%	0.773	S	S	*	*			trans	53.8	119.4	139.9	-73.2	171.7	-20.7	0	0	120.1
35	G	31.4	Very low	31.9	Very low	78 Å²	78	143.4 Å²	143.4	80%	0.804	75%	0.752	S	S	*	*			trans	-169.1	95.1	160.3	0	0	0	0	0	110.1
36	S	28.1	Very low	32.5	Very low	111 Å²	111	144.1 Å²	144.1	78%	0.776	75%	0.754	S	S	*	*			trans	-57.3	139.8	166.2	47.9	0	0	0	0	111.5
37	E	29.1	Very low	32.8	Very low	180 Å²	180	141.5 Å²	141.5	84%	0.841	74%	0.742	S	S	*	*				174.9	134.2	125.2	-109.6	-175.6	132.1	0	0	115.3
38	V	32.4	Very low	33.1	Very low	91 Å²	91	142.2 Å²	142.2	55%	0.552	74%	0.735	S	S	*	*			trans	70.5	95.2	150	-165.1	0	0	0	0	119.4	R40	V38-R40 HydrophobicContact CG1-CG 3.9Å; V38-R40 PolarHBondContact O-N 3.32Å
39	E	27.1	Very low	33.6	Very low	198 Å²	198	139.8 Å²	139.8	93%	0.925	73%	0.726	S	S	*	*			trans	-55.8	118	144	-79	178	132	0	0	110.4
40	R	32	Very low	33.9	Very low	215 Å²	215	139.9 Å²	139.9	81%	0.811	73%	0.726	S	S	*	*			trans	-125.7	107.6	152.4	-85.4	-177	-158.1	141.3	6.6	108.8	V38 V42	V38-R40 HydrophobicContact CG1-CG 3.9Å; V38-R40 PolarHBondContact O-N 3.32Å; R40-V42 PolarHBondContact O-N 3.41Å; R40-V42 VanDerWaalsContact O-N 3.11Å
41	A	29.2	Very low	33.8	Very low	100 Å²	100	135.7 Å²	135.7	83%	0.826	71%	0.713	S	S	*	*			trans	-62	106.4	163.7	0	0	0	0	0	108.5	H43	A41-H43 PolarHBondContact O-N 3.14Å
42	V	38.4	Very low	34.4	Very low	116 Å²	116	134.9 Å²	134.9	70%	0.703	71%	0.708	S	S	*	*			trans	-79.7	103.3	167.8	-178.3	0	0	0	0	106.7	R40 L44	R40-V42 PolarHBondContact O-N 3.41Å; R40-V42 VanDerWaalsContact O-N 3.11Å; V42-L44 PolarHBondContact O-N 2.75Å
43	H	34	Very low	35	Very low	188 Å²	188	128.3 Å²	128.3	87%	0.87	69%	0.694	S	S	*	*			trans	-56.8	105.8	161.9	-115.3	-86.5	0	0	0	107.5	A41 D45	A41-H43 PolarHBondContact O-N 3.14Å; H43-D45 PolarHBondContact O-N 3.47Å
44	L	39.2	Very low	35.5	Very low	119 Å²	119	123.1 Å²	123.1	62%	0.623	69%	0.694	S	S	*	*			trans	-77.3	109.3	172.5	-76.5	162.5	0	0	0	107.9	V42	V42-L44 PolarHBondContact O-N 2.75Å
45	D	37.1	Very low	35.9	Very low	90 Å²	90	118 Å²	118	48%	0.481	69%	0.689	S	S	.	*			trans	-55.1	124.6	169.7	-177	-13.3	0	0	0	109.7	H43 S47 F48	H43-D45 PolarHBondContact O-N 3.47Å; D45-S47 PolarHBondContact O-N 3.41Å; D45-S47 WeakPolarHBondContact OD1-CB 3.48Å; D45-S47 PolarHBondContact OD1-N 2.84Å; D45-S47 PolarHBondContact OD1-OG 2.68Å; D45-F48 WeakPolarHBondContact O-CB 3.24Å; D45-F48 PolarHBondContact O-N 2.75Å
46	P	43.6	Very low	36.1	Very low	102 Å²	102	118.4 Å²	118.4	66%	0.662	68%	0.684	S	S	*	*	H	α-helix	trans	-52.7	-25.6	175.9	-25.7	33.9	0	0	0	113.7	F48 I49 L50	P46-F48 VanDerWaalsContact C-N 3.29Å; P46-F48 PolarHBondContact O-N 3.04Å; P46-I49 PolarHBondContact O-N 3.4Å; P46-L50 PolarHBondContact O-N 3.19Å
47	S	40.1	Very low	36.7	Very low	79 Å²	79	117.9 Å²	117.9	55%	0.552	67%	0.671	S	S	*	*	H	α-helix	trans	-68.8	-26.3	177.9	-39.3	0	0	0	0	112.7	D45 G51	D45-S47 PolarHBondContact O-N 3.41Å; D45-S47 WeakPolarHBondContact OD1-CB 3.48Å; D45-S47 PolarHBondContact OD1-N 2.84Å; D45-S47 PolarHBondContact OD1-OG 2.68Å; S47-G51 PolarHBondContact O-N 3.26Å
48	F	37.2	Very low	37.3	Very low	135 Å²	135	115.5 Å²	115.5	59%	0.592	67%	0.674	S	S	*	*	H	α-helix	trans	-77.7	-26.6	178.5	-148.8	-96.5	0	0	0	112.3	D45 P46 I52	D45-F48 WeakPolarHBondContact O-CB 3.24Å; D45-F48 PolarHBondContact O-N 2.75Å; P46-F48 VanDerWaalsContact C-N 3.29Å; P46-F48 PolarHBondContact O-N 3.04Å; F48-I52 HydrophobicContact CD1-CD1 4.11Å; F48-I52 HydrophobicContact CE1-CD1 3.99Å
49	I	42.5	Very low	37.7	Very low	113 Å²	113	113.2 Å²	113.2	58%	0.579	66%	0.662	S	S	*	*	H	α-helix	trans	-75.3	-31.6	174.7	-60.3	-76.5	0	0	0	110.8	P46	P46-I49 PolarHBondContact O-N 3.4Å
50	L	38.1	Very low	38.7	Very low	134 Å²	134	111.3 Å²	111.3	70%	0.702	66%	0.658	S	S	*	*	H	α-helix	trans	-80.3	-32.4	173	-107.2	86.1	0	0	0	113.2	P46 V53 A54	P46-L50 PolarHBondContact O-N 3.19Å; L50-V53 PolarHBondContact O-N 3.37Å; L50-A54 PolarHBondContact O-N 3.05Å
51	G	33.6	Very low	39.8	Very low	42 Å²	42	109.3 Å²	109.3	43%	0.433	65%	0.651	S	S	.	*	H	α-helix	trans	-69.9	-31.1	-175.9	0	0	0	0	0	115.1	S47 V53 A54 G55	S47-G51 PolarHBondContact O-N 3.26Å; G51-V53 PolarHBondContact O-N 3.44Å; G51-A54 PolarHBondContact O-N 3.23Å; G51-G55 PolarHBondContact O-N 3.4Å
52	I	43	Very low	41.6	Very low	124 Å²	124	108.7 Å²	108.7	64%	0.636	64%	0.641	S	S	*	*	H	α-helix	trans	-71.2	-20.4	176.2	-66.7	175.5	0	0	0	111.6	F48	F48-I52 HydrophobicContact CD1-CD1 4.11Å; F48-I52 HydrophobicContact CE1-CD1 3.99Å
53	V	41.7	Very low	43.6	Very low	105 Å²	105	109.2 Å²	109.2	64%	0.636	64%	0.644	S	S	*	*	H	α-helix	trans	-88.2	-23.4	177.1	-173.3	0	0	0	0	111.9	L50 G51	L50-V53 PolarHBondContact O-N 3.37Å; G51-V53 PolarHBondContact O-N 3.44Å
54	A	40.4	Very low	46.3	Very low	89 Å²	89	100.7 Å²	100.7	74%	0.736	61%	0.605	S	S	*	*	H	α-helix	trans	-99	-14.2	-171.3	0	0	0	0	0	115.6	L50 G51	L50-A54 PolarHBondContact O-N 3.05Å; G51-A54 PolarHBondContact O-N 3.23Å
55	G	35.1	Very low	48.8	Very low	70 Å²	70	100.5 Å²	100.5	72%	0.722	60%	0.601	S	S	*	*	S	Bend	trans	-92.8	-10.5	-167.4	0	0	0	0	0	118.3	G51	G51-G55 PolarHBondContact O-N 3.4Å
56	A	37.5	Very low	51.5	Low	85 Å²	85	100 Å²	100	70%	0.702	60%	0.603	S	S	*	*	S	Bend	trans	-158	17.3	-175.3	0	0	0	0	0	116.1
57	M	39.9	Very low	53.9	Low	101 Å²	101	95.5 Å²	95.5	50%	0.498	57%	0.573	S	S	.	*			trans	-106.8	42.6	-172.4	-69.4	-90.4	96.7	0	0	114	S59	M57-S59 PolarHBondContact O-N 2.81Å
58	S	41	Very low	56.5	Low	130 Å²	130	95.4 Å²	95.4	91%	0.909	57%	0.566	S	S	*	*			trans	-78.1	46.6	159.5	-72.8	0	0	0	0	111.6
59	S	41.5	Very low	59.1	Low	42 Å²	42	91 Å²	91	29%	0.294	55%	0.55	S	S	.	*			trans	-128.3	103.2	175.2	171.4	0	0	0	0	108.7	M57 Y61	M57-S59 PolarHBondContact O-N 2.81Å; S59-Y61 PolarHBondContact O-N 2.9Å
60	N	47.3	Very low	61.5	Low	158 Å²	158	90.3 Å²	90.3	85%	0.845	56%	0.555	S	S	*	*			trans	-76.4	36.3	-173	-73.5	-47.3	0	0	0	114.6
61	Y	56.3	Low	64	Low	173 Å²	173	86.5 Å²	86.5	68%	0.678	54%	0.538	S	S	*	.			trans	-116.5	99.1	-169.6	-68.2	-76.1	0	0	0	114.7	S59	S59-Y61 PolarHBondContact O-N 2.9Å
62	S	66.8	Low	66.6	Low	87 Å²	87	85.5 Å²	85.5	61%	0.608	53%	0.528	S	S	*	.			trans	63.7	128.4	153.2	65	0	0	0	0	119.8	F86	S62-F86 WeakPolarHBondContact O-CE2 3.44Å
63	V	79.1	Confident	68.7	Low	127 Å²	127	80.4 Å²	80.4	77%	0.77	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-71.8	130.5	161.8	175.7	0	0	0	0	108.4
64	L	91	Very high	70.7	Confident	10 Å²	10	75.7 Å²	75.7	5%	0.052	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-79.2	122.4	168.3	179.5	62.9	0	0	0	108.2	W79 R82 F83 F86 Q104	L64-W79 HydrophobicContact CD2-CZ2 3.92Å; L64-R82 HydrophobicContact CD1-CB 3.84Å; L64-F83 HydrophobicContact CD2-CB 4.03Å; L64-F83 HydrophobicContact CD2-CD2 3.82Å; L64-F83 HydrophobicContact CD2-CG 4.44Å; L64-F86 HydrophobicContact CB-CD2 3.96Å; L64-F86 HydrophobicContact CB-CE2 4.31Å; L64-F86 HydrophobicContact CB-CG 4.13Å; L64-F86 HydrophobicContact CD2-CB 4.39Å; L64-F86 HydrophobicContact CD2-CD1 4.44Å; L64-F86 HydrophobicContact CD2-CG 4.36Å; L64-Q104 HydrophobicContact CB-CB 4.36Å; L64-Q104 HydrophobicContact CD2-CB 3.97Å
65	E	92.2	Very high	73	Confident	114 Å²	114	71.9 Å²	71.9	53%	0.533	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-63.3	139.1	176.4	-66.9	172.8	149.2	0	0	110.7	W79 R82	E65-W79 PolarHBondContact O-NE1 2.78Å; E65-W79 VanDerWaalsContact O-NE1 3.1Å; E65-R82 IonicContact OE2-CZ 2.7Å; E65-R82 IonicContact OE2-NH1 3.12Å; E65-R82 PolarHBondContact OE2-NH1 2.78Å; E65-R82 VanDerWaalsContact OE2-NH1 3.14Å; E65-R82 IonicContact OE2-NH2 3.7Å; E65-R82 PolarHBondContact OE2-NH2 2.77Å
66	P	94.1	Very high	75.7	Confident	79 Å²	79	68.9 Å²	68.9	51%	0.513	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-51.2	148.9	171.7	-31.7	38.9	0	0	0	113.1	D68	P66-D68 PolarHBondContact O-N 2.95Å
67	F	94.4	Very high	78.1	Confident	9 Å²	9	67.3 Å²	67.3	4%	0.039	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-71.8	130.1	175.4	177.8	-123.5	0	0	0	111.3	V69 T71 G75 W76 W79 C105 L109 F138	F67-V69 HydrophobicContact CD1-CG1 3.81Å; F67-V69 HydrophobicContact CE1-CB 4.26Å; F67-V69 HydrophobicContact CE1-CG1 3.81Å; F67-T71 VanDerWaalsContact CE2-OG1 3.28Å; F67-T71 WeakPolarHBondContact CE2-OG1 3.4Å; F67-G75 WeakPolarHBondContact CE2-O 3.46Å; F67-W76 HydrophobicContact CD1-CE3 4.32Å; F67-W76 HydrophobicContact CE1-CE3 4.21Å; F67-W76 HydrophobicContact CE2-CB 4.38Å; F67-W76 HydrophobicContact CZ-CB 3.91Å; F67-W76 HydrophobicContact CZ-CE3 4.49Å; F67-W79 HydrophobicContact CB-CB 4.48Å; F67-W79 HydrophobicContact CB-CD2 3.95Å; F67-W79 HydrophobicContact CB-CG 3.77Å; F67-W79 HydrophobicContact CD2-CB 3.56Å; F67-W79 AromaticContact CD2-CG 3.8Å; F67-W79 HydrophobicContact CD2-CG 3.8Å; F67-W79 HydrophobicContact CE2-CB 4.22Å; F67-W79 HydrophobicContact CG-CB 4.28Å; F67-W79 HydrophobicContact CG-CD2 4.46Å; F67-W79 HydrophobicContact CG-CG 4.08Å; F67-C105 PolarHBondContact N-O 2.82Å; F67-C105 VanDerWaalsContact N-O 3.11Å; F67-L109 HydrophobicContact CB-CB 4.12Å; F67-L109 HydrophobicContact CB-CD2 3.44Å; F67-L109 VanDerWaalsContact CB-CD2 3.44Å; F67-L109 HydrophobicContact CB-CG 4.36Å; F67-L109 HydrophobicContact CD1-CB 3.95Å; F67-L109 HydrophobicContact CD1-CD1 3.83Å; F67-L109 HydrophobicContact CD1-CD2 3.61Å; F67-L109 HydrophobicContact CD1-CG 3.98Å; F67-L109 HydrophobicContact CE1-CD1 4.34Å; F67-L109 HydrophobicContact CG-CD2 3.83Å; F67-F138 HydrophobicContact CE1-CE1 4.35Å; F67-F138 AromaticContact CE1-CE2 3.8Å; F67-F138 HydrophobicContact CE1-CE2 3.8Å; F67-F138 AromaticContact CE1-CZ 3.51Å; F67-F138 HydrophobicContact CE1-CZ 3.51Å; F67-F138 HydrophobicContact CZ-CE2 4.3Å; F67-F138 HydrophobicContact CZ-CZ 4.11Å
68	D	94.1	Very high	80.5	Confident	77 Å²	77	66.6 Å²	66.6	41%	0.412	38%	0.383	S	S	.	.			trans	-87.8	102.8	170	179.3	0.2	0	0	0	110.2	P66 S70 T71	P66-D68 PolarHBondContact O-N 2.95Å; D68-S70 PolarHBondContact O-N 3.13Å; D68-S70 VanDerWaalsContact O-N 3.08Å; D68-S70 VanDerWaalsContact OD1-CB 3.25Å; D68-S70 WeakPolarHBondContact OD1-CB 3.42Å; D68-S70 PolarHBondContact OD1-N 3.32Å; D68-S70 PolarHBondContact OD1-OG 3.46Å; D68-S70 PolarHBondContact OD2-OG 3.11Å; D68-T71 HydrophobicContact CB-CG2 4.07Å; D68-T71 WeakPolarHBondContact O-CB 3.46Å; D68-T71 PolarHBondContact O-N 3.41Å; D68-T71 VanDerWaalsContact O-N 3.14Å; D68-T71 PolarHBondContact O-OG1 2.9Å
69	V	92.6	Very high	83	Confident	42 Å²	42	60.9 Å²	60.9	26%	0.255	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-61.5	-17.8	-178.8	-67.2	0	0	0	0	114	F67 T71 G72 Q108 L109 F138	F67-V69 HydrophobicContact CD1-CG1 3.81Å; F67-V69 HydrophobicContact CE1-CB 4.26Å; F67-V69 HydrophobicContact CE1-CG1 3.81Å; V69-T71 PolarHBondContact O-N 2.84Å; V69-G72 PolarHBondContact O-N 3.04Å; V69-Q108 HydrophobicContact CG1-CB 4.02Å; V69-Q108 HydrophobicContact CG2-CB 3.87Å; V69-Q108 HydrophobicContact CG2-CG 4.48Å; V69-L109 HydrophobicContact CG1-CB 4.45Å; V69-F138 HydrophobicContact CB-CZ 4.49Å; V69-F138 HydrophobicContact CG1-CZ 4.29Å
70	S	91.9	Very high	85.5	Confident	99 Å²	99	59.8 Å²	59.8	69%	0.692	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-68.9	-19.8	177.7	75.7	0	0	0	0	113.2	D68 G72	D68-S70 PolarHBondContact O-N 3.13Å; D68-S70 VanDerWaalsContact O-N 3.08Å; D68-S70 VanDerWaalsContact OD1-CB 3.25Å; D68-S70 WeakPolarHBondContact OD1-CB 3.42Å; D68-S70 PolarHBondContact OD1-N 3.32Å; D68-S70 PolarHBondContact OD1-OG 3.46Å; D68-S70 PolarHBondContact OD2-OG 3.11Å; S70-G72 PolarHBondContact O-N 3.14Å
71	T	90.1	Very high	87.6	Confident	53 Å²	53	56.8 Å²	56.8	33%	0.325	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-76.6	-9.4	179.9	62.5	0	0	0	0	113.7	F67 D68 V69 G75	F67-T71 VanDerWaalsContact CE2-OG1 3.28Å; F67-T71 WeakPolarHBondContact CE2-OG1 3.4Å; D68-T71 HydrophobicContact CB-CG2 4.07Å; D68-T71 WeakPolarHBondContact O-CB 3.46Å; D68-T71 PolarHBondContact O-N 3.41Å; D68-T71 VanDerWaalsContact O-N 3.14Å; D68-T71 PolarHBondContact O-OG1 2.9Å; V69-T71 PolarHBondContact O-N 2.84Å; T71-G75 PolarHBondContact O-N 3.3Å; T71-G75 VanDerWaalsContact OG1-CA 3.31Å; T71-G75 WeakPolarHBondContact OG1-CA 3.47Å
72	G	89.3	Confident	89.4	Confident	22 Å²	22	53.5 Å²	53.5	23%	0.227	30%	0.299	C	S	.	.	H	α-helix	trans	63.3	-149.8	174.8	0	0	0	0	0	113.8	V69 S70 D74 G75 W76	V69-G72 PolarHBondContact O-N 3.04Å; S70-G72 PolarHBondContact O-N 3.14Å; G72-D74 VanDerWaalsContact C-N 3.32Å; G72-D74 PolarHBondContact O-N 3.07Å; G72-G75 PolarHBondContact O-N 3.37Å; G72-W76 WeakPolarHBondContact O-CB 3.43Å; G72-W76 PolarHBondContact O-N 3.5Å
73	I	86.9	Confident	90.7	Very high	16 Å²	16	49.4 Å²	49.4	8%	0.082	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-36.7	-175.2	-173.9	60	0	0	0	113.2	W76 M77 Q135 F138 D139	I73-W76 WeakPolarHBondContact O-CB 3.42Å; I73-W76 PolarHBondContact O-N 3.22Å; I73-M77 WeakPolarHBondContact O-CG 3.33Å; I73-M77 PolarHBondContact O-N 3.43Å; I73-Q135 HydrophobicContact CD1-CG 3.76Å; I73-F138 HydrophobicContact CB-CB 3.97Å; I73-F138 HydrophobicContact CD1-CB 4.06Å; I73-D139 HydrophobicContact CB-CB 4.39Å; I73-D139 HydrophobicContact CD1-CB 4Å; I73-D139 HydrophobicContact CG1-CB 4Å
74	D	83.3	Confident	91.3	Very high	7 Å²	7	44.5 Å²	44.5	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-69.3	-45.3	-178.2	-67.5	-62.9	0	0	0	111.6	G72 W76 M77 E78 R171	G72-D74 VanDerWaalsContact C-N 3.32Å; G72-D74 PolarHBondContact O-N 3.07Å; D74-W76 VanDerWaalsContact C-N 3.29Å; D74-W76 PolarHBondContact O-N 3.01Å; D74-M77 HydrophobicContact CB-CE 4.49Å; D74-M77 PolarHBondContact O-N 3.05Å; D74-M77 WeakPolarHBondContact OD1-CE 3.35Å; D74-E78 WeakPolarHBondContact O-CG 3.44Å; D74-E78 PolarHBondContact O-N 3.18Å; D74-R171 VanDerWaalsContact CG-NE 3.29Å; D74-R171 IonicContact OD2-CZ 2.72Å; D74-R171 IonicContact OD2-NE 2.75Å; D74-R171 PolarHBondContact OD2-NE 3.42Å; D74-R171 IonicContact OD2-NH2 3.98Å; D74-R171 PolarHBondContact OD2-NH2 3.33Å
75	G	89.7	Confident	91.4	Very high	8 Å²	8	49.3 Å²	49.3	8%	0.082	27%	0.265	C	S	.	.	H	α-helix	trans	-70.1	-28	175.4	0	0	0	0	0	112.7	F67 T71 G72 E78 W79	F67-G75 WeakPolarHBondContact CE2-O 3.46Å; T71-G75 PolarHBondContact O-N 3.3Å; T71-G75 VanDerWaalsContact OG1-CA 3.31Å; T71-G75 WeakPolarHBondContact OG1-CA 3.47Å; G72-G75 PolarHBondContact O-N 3.37Å; G75-E78 PolarHBondContact O-N 3.44Å; G75-W79 VanDerWaalsContact O-CB 3.28Å; G75-W79 WeakPolarHBondContact O-CB 3.47Å; G75-W79 PolarHBondContact O-N 3.01Å
76	W	91.5	Very high	91.4	Very high	7 Å²	7	45 Å²	45	3%	0.027	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-45.8	171.4	171.4	-112.5	0	0	0	111.3	F67 G72 I73 D74 W79 M80 L109 I131 V134 F138	F67-W76 HydrophobicContact CD1-CE3 4.32Å; F67-W76 HydrophobicContact CE1-CE3 4.21Å; F67-W76 HydrophobicContact CE2-CB 4.38Å; F67-W76 HydrophobicContact CZ-CB 3.91Å; F67-W76 HydrophobicContact CZ-CE3 4.49Å; G72-W76 WeakPolarHBondContact O-CB 3.43Å; G72-W76 PolarHBondContact O-N 3.5Å; I73-W76 WeakPolarHBondContact O-CB 3.42Å; I73-W76 PolarHBondContact O-N 3.22Å; D74-W76 VanDerWaalsContact C-N 3.29Å; D74-W76 PolarHBondContact O-N 3.01Å; W76-W79 HydrophobicContact CE3-CE3 4.2Å; W76-W79 HydrophobicContact CH2-CE3 4.38Å; W76-W79 HydrophobicContact CH2-CZ3 4.24Å; W76-W79 AromaticContact CZ3-CE3 3.67Å; W76-W79 HydrophobicContact CZ3-CE3 3.67Å; W76-W79 AromaticContact CZ3-CZ3 3.85Å; W76-W79 HydrophobicContact CZ3-CZ3 3.85Å; W76-W79 PolarHBondContact O-N 2.9Å; W76-M80 HydrophobicContact CD2-CG 4.09Å; W76-M80 HydrophobicContact CE3-CG 4.32Å; W76-M80 HydrophobicContact CH2-CG 3.98Å; W76-M80 HydrophobicContact CH2-SD 3.57Å; W76-M80 VanDerWaalsContact CH2-SD 3.57Å; W76-M80 HydrophobicContact CZ2-CG 3.73Å; W76-M80 HydrophobicContact CZ2-SD 3.73Å; W76-M80 HydrophobicContact CZ3-CG 4.24Å; W76-M80 HydrophobicContact CZ3-SD 4.11Å; W76-M80 WeakPolarHBondContact O-CB 3.28Å; W76-M80 WeakPolarHBondContact O-CG 3.35Å; W76-M80 PolarHBondContact O-N 3.19Å; W76-L109 HydrophobicContact CE3-CD1 4.32Å; W76-L109 HydrophobicContact CE3-CD2 4.24Å; W76-L109 HydrophobicContact CZ3-CD1 3.89Å; W76-L109 HydrophobicContact CZ3-CD2 3.55Å; W76-L109 HydrophobicContact CZ3-CG 4.36Å; W76-I131 HydrophobicContact CZ2-CB 4.35Å; W76-I131 HydrophobicContact CZ2-CG1 4.37Å; W76-I131 HydrophobicContact CZ2-CG2 4.04Å; W76-V134 HydrophobicContact CD2-CG1 3.75Å; W76-V134 HydrophobicContact CE3-CG1 3.78Å; W76-V134 HydrophobicContact CH2-CB 4Å; W76-V134 HydrophobicContact CH2-CG1 3.58Å; W76-V134 HydrophobicContact CH2-CG2 4.38Å; W76-V134 HydrophobicContact CZ2-CB 3.77Å; W76-V134 HydrophobicContact CZ2-CG1 3.52Å; W76-V134 HydrophobicContact CZ3-CG1 3.73Å; W76-F138 HydrophobicContact CB-CD2 3.91Å; W76-F138 HydrophobicContact CB-CE2 4.15Å; W76-F138 HydrophobicContact CD2-CD2 4.42Å; W76-F138 HydrophobicContact CD2-CE2 4.31Å; W76-F138 HydrophobicContact CE3-CE2 4.4Å; W76-F138 AromaticContact CG-CD2 3.96Å; W76-F138 HydrophobicContact CG-CD2 3.96Å; W76-F138 HydrophobicContact CG-CE2 4.22Å
77	M	87.3	Confident	91.3	Very high	52 Å²	52	41.2 Å²	41.2	26%	0.256	22%	0.221	S	C	.	.	H	α-helix	trans	-60.5	-46.4	174.8	-68.6	-173.8	-68.7	0	0	111.4	I73 D74 W79 M80 E81	I73-M77 WeakPolarHBondContact O-CG 3.33Å; I73-M77 PolarHBondContact O-N 3.43Å; D74-M77 HydrophobicContact CB-CE 4.49Å; D74-M77 PolarHBondContact O-N 3.05Å; D74-M77 WeakPolarHBondContact OD1-CE 3.35Å; M77-W79 PolarHBondContact O-N 2.94Å; M77-M80 PolarHBondContact O-N 3.29Å; M77-E81 WeakPolarHBondContact O-CG 3.4Å; M77-E81 PolarHBondContact O-N 3.44Å
78	E	89.7	Confident	91.2	Very high	87 Å²	87	45.4 Å²	45.4	41%	0.407	24%	0.24	S	C	.	.	H	α-helix	trans	-64.7	-40.1	179.4	-70.1	173.4	-174.4	0	0	112.2	D74 G75 E81 R82 R174	D74-E78 WeakPolarHBondContact O-CG 3.44Å; D74-E78 PolarHBondContact O-N 3.18Å; G75-E78 PolarHBondContact O-N 3.44Å; E78-E81 PolarHBondContact O-N 3.03Å; E78-R82 WeakPolarHBondContact O-CG 3.42Å; E78-R82 PolarHBondContact O-N 3.4Å; E78-R174 IonicContact OE1-CZ 3.91Å; E78-R174 IonicContact OE1-NH1 3.03Å; E78-R174 PolarHBondContact OE1-NH1 3.41Å; E78-R174 IonicContact OE1-NH2 2.68Å; E78-R174 PolarHBondContact OE1-NH2 3.3Å
79	W	94.5	Very high	91.1	Very high	9 Å²	9	44.2 Å²	44.2	3%	0.034	24%	0.241	C	C	.	.	H	α-helix	trans	-66	-39.7	175.7	-174.6	86.4	0	0	0	111.9	L64 E65 F67 G75 W76 M77 R82 F83 C105 L109	L64-W79 HydrophobicContact CD2-CZ2 3.92Å; E65-W79 PolarHBondContact O-NE1 2.78Å; E65-W79 VanDerWaalsContact O-NE1 3.1Å; F67-W79 HydrophobicContact CB-CB 4.48Å; F67-W79 HydrophobicContact CB-CD2 3.95Å; F67-W79 HydrophobicContact CB-CG 3.77Å; F67-W79 HydrophobicContact CD2-CB 3.56Å; F67-W79 AromaticContact CD2-CG 3.8Å; F67-W79 HydrophobicContact CD2-CG 3.8Å; F67-W79 HydrophobicContact CE2-CB 4.22Å; F67-W79 HydrophobicContact CG-CB 4.28Å; F67-W79 HydrophobicContact CG-CD2 4.46Å; F67-W79 HydrophobicContact CG-CG 4.08Å; G75-W79 VanDerWaalsContact O-CB 3.28Å; G75-W79 WeakPolarHBondContact O-CB 3.47Å; G75-W79 PolarHBondContact O-N 3.01Å; W76-W79 HydrophobicContact CE3-CE3 4.2Å; W76-W79 HydrophobicContact CH2-CE3 4.38Å; W76-W79 HydrophobicContact CH2-CZ3 4.24Å; W76-W79 AromaticContact CZ3-CE3 3.67Å; W76-W79 HydrophobicContact CZ3-CE3 3.67Å; W76-W79 AromaticContact CZ3-CZ3 3.85Å; W76-W79 HydrophobicContact CZ3-CZ3 3.85Å; W76-W79 PolarHBondContact O-N 2.9Å; M77-W79 PolarHBondContact O-N 2.94Å; W79-R82 PolarHBondContact O-N 3.5Å; W79-F83 HydrophobicContact CE3-CB 4.44Å; W79-F83 HydrophobicContact CH2-CB 4.35Å; W79-F83 HydrophobicContact CH2-CD2 4.24Å; W79-F83 HydrophobicContact CH2-CG 4.4Å; W79-F83 HydrophobicContact CZ3-CB 4.24Å; W79-F83 WeakPolarHBondContact O-CB 3.27Å; W79-F83 PolarHBondContact O-N 3.26Å; W79-C105 HydrophobicContact CH2-CB 3.98Å; W79-C105 HydrophobicContact CZ2-CB 4.08Å; W79-L109 HydrophobicContact CD2-CD2 4.48Å; W79-L109 HydrophobicContact CE3-CD2 4.22Å; W79-L109 HydrophobicContact CH2-CD2 4.22Å; W79-L109 HydrophobicContact CZ2-CD2 4.48Å; W79-L109 HydrophobicContact CZ3-CD2 4.09Å
80	M	93.5	Very high	91	Very high	19 Å²	19	43.1 Å²	43.1	9%	0.094	23%	0.234	C	C	.	.	H	α-helix	trans	-63.6	-40.5	174.7	-77.8	-58	-52.5	0	0	112.2	W76 M77 F83 V84 F127 I131	W76-M80 HydrophobicContact CD2-CG 4.09Å; W76-M80 HydrophobicContact CE3-CG 4.32Å; W76-M80 HydrophobicContact CH2-CG 3.98Å; W76-M80 HydrophobicContact CH2-SD 3.57Å; W76-M80 VanDerWaalsContact CH2-SD 3.57Å; W76-M80 HydrophobicContact CZ2-CG 3.73Å; W76-M80 HydrophobicContact CZ2-SD 3.73Å; W76-M80 HydrophobicContact CZ3-CG 4.24Å; W76-M80 HydrophobicContact CZ3-SD 4.11Å; W76-M80 WeakPolarHBondContact O-CB 3.28Å; W76-M80 WeakPolarHBondContact O-CG 3.35Å; W76-M80 PolarHBondContact O-N 3.19Å; M77-M80 PolarHBondContact O-N 3.29Å; M80-F83 HydrophobicContact CE-CD1 4.39Å; M80-F83 PolarHBondContact O-N 3.4Å; M80-V84 WeakPolarHBondContact O-CG2 3.42Å; M80-V84 PolarHBondContact O-N 3.18Å; M80-F127 HydrophobicContact CE-CE1 4.43Å; M80-F127 HydrophobicContact CE-CZ 3.82Å; M80-I131 HydrophobicContact CE-CD1 3.41Å; M80-I131 VanDerWaalsContact CE-CD1 3.41Å; M80-I131 HydrophobicContact CE-CG1 3.74Å; M80-I131 HydrophobicContact SD-CD1 4.46Å; M80-I131 HydrophobicContact SD-CG1 4.15Å
81	E	91.7	Very high	91	Very high	95 Å²	95	45.1 Å²	45.1	44%	0.444	24%	0.236	S	C	.	.	H	α-helix	trans	-59.6	-47.3	172.3	-72.3	179.4	178.9	0	0	111.3	M77 E78 F83 V84 I85	M77-E81 WeakPolarHBondContact O-CG 3.4Å; M77-E81 PolarHBondContact O-N 3.44Å; E78-E81 PolarHBondContact O-N 3.03Å; E81-F83 VanDerWaalsContact C-N 3.33Å; E81-F83 PolarHBondContact O-N 3.43Å; E81-V84 PolarHBondContact O-N 2.87Å; E81-I85 WeakPolarHBondContact O-CG1 3.33Å; E81-I85 PolarHBondContact O-N 3.42Å; E81-I85 VanDerWaalsContact O-N 3.1Å
82	R	93.8	Very high	91	Very high	104 Å²	104	43.5 Å²	43.5	39%	0.392	23%	0.227	S	C	.	.	H	α-helix	trans	-60.7	-41.3	175.6	-69.5	172.9	65	176.1	6.2	112.1	L64 E65 E78 W79 I85 F86	L64-R82 HydrophobicContact CD1-CB 3.84Å; E65-R82 IonicContact OE2-CZ 2.7Å; E65-R82 IonicContact OE2-NH1 3.12Å; E65-R82 PolarHBondContact OE2-NH1 2.78Å; E65-R82 VanDerWaalsContact OE2-NH1 3.14Å; E65-R82 IonicContact OE2-NH2 3.7Å; E65-R82 PolarHBondContact OE2-NH2 2.77Å; E78-R82 WeakPolarHBondContact O-CG 3.42Å; E78-R82 PolarHBondContact O-N 3.4Å; W79-R82 PolarHBondContact O-N 3.5Å; R82-I85 PolarHBondContact O-N 3.3Å; R82-F86 WeakPolarHBondContact O-CB 3.48Å; R82-F86 PolarHBondContact O-N 3.39Å
83	F	94.3	Very high	91.2	Very high	1 Å²	1	45.7 Å²	45.7	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-62.8	-41.7	177.7	173.6	-95.7	0	0	0	111.8	L64 W79 M80 E81 F86 A87 R97 V100 F127	L64-F83 HydrophobicContact CD2-CB 4.03Å; L64-F83 HydrophobicContact CD2-CD2 3.82Å; L64-F83 HydrophobicContact CD2-CG 4.44Å; W79-F83 HydrophobicContact CE3-CB 4.44Å; W79-F83 HydrophobicContact CH2-CB 4.35Å; W79-F83 HydrophobicContact CH2-CD2 4.24Å; W79-F83 HydrophobicContact CH2-CG 4.4Å; W79-F83 HydrophobicContact CZ3-CB 4.24Å; W79-F83 WeakPolarHBondContact O-CB 3.27Å; W79-F83 PolarHBondContact O-N 3.26Å; M80-F83 HydrophobicContact CE-CD1 4.39Å; M80-F83 PolarHBondContact O-N 3.4Å; E81-F83 VanDerWaalsContact C-N 3.33Å; E81-F83 PolarHBondContact O-N 3.43Å; F83-F86 WeakPolarHBondContact O-CB 3.46Å; F83-F86 PolarHBondContact O-N 3.41Å; F83-A87 HydrophobicContact CE1-CB 4.32Å; F83-A87 HydrophobicContact CZ-CB 4.34Å; F83-A87 WeakPolarHBondContact O-CB 3.5Å; F83-A87 PolarHBondContact O-N 3.29Å; F83-R97 HydrophobicContact CE1-CB 4.19Å; F83-R97 HydrophobicContact CE1-CG 4.48Å; F83-R97 HydrophobicContact CZ-CB 4.21Å; F83-R97 VanDerWaalsContact CZ-O 3.26Å; F83-R97 WeakPolarHBondContact CZ-O 3.48Å; F83-V100 HydrophobicContact CE2-CB 4.36Å; F83-V100 HydrophobicContact CE2-CG1 4.05Å; F83-V100 HydrophobicContact CZ-CB 4.49Å; F83-F127 HydrophobicContact CD1-CE2 4.46Å; F83-F127 AromaticContact CD1-CZ 3.77Å; F83-F127 HydrophobicContact CD1-CZ 3.77Å; F83-F127 HydrophobicContact CE1-CE1 4.19Å; F83-F127 AromaticContact CE1-CE2 3.87Å; F83-F127 HydrophobicContact CE1-CE2 3.87Å; F83-F127 AromaticContact CE1-CZ 3.32Å; F83-F127 HydrophobicContact CE1-CZ 3.32Å; F83-F127 HydrophobicContact CZ-CE2 4.41Å; F83-F127 HydrophobicContact CZ-CZ 4.26Å
84	V	91.9	Very high	91.4	Very high	25 Å²	25	49.6 Å²	49.6	15%	0.152	26%	0.263	C	S	.	.	H	α-helix	trans	-62.4	-47.2	176.6	170.2	0	0	0	0	110.7	W8 M80 E81 F86 A87 E88	W8-V84 HydrophobicContact CH2-CG1 3.99Å; W8-V84 HydrophobicContact CZ3-CG1 3.68Å; M80-V84 WeakPolarHBondContact O-CG2 3.42Å; M80-V84 PolarHBondContact O-N 3.18Å; E81-V84 PolarHBondContact O-N 2.87Å; V84-F86 VanDerWaalsContact C-N 3.29Å; V84-F86 PolarHBondContact O-N 2.84Å; V84-A87 PolarHBondContact O-N 3.35Å; V84-A87 VanDerWaalsContact O-N 3.16Å; V84-E88 WeakPolarHBondContact O-CG 3.48Å; V84-E88 PolarHBondContact O-N 3.41Å
85	I	92.2	Very high	91.8	Very high	110 Å²	110	53.1 Å²	53.1	56%	0.564	29%	0.293	S	S	*	.	H	α-helix	trans	-58.7	-44.8	176.5	-65.6	164.6	0	0	0	110.4	E81 R82 A87 E88 A89	E81-I85 WeakPolarHBondContact O-CG1 3.33Å; E81-I85 PolarHBondContact O-N 3.42Å; E81-I85 VanDerWaalsContact O-N 3.1Å; R82-I85 PolarHBondContact O-N 3.3Å; I85-A87 PolarHBondContact O-N 3.44Å; I85-E88 PolarHBondContact O-N 2.93Å; I85-A89 WeakPolarHBondContact O-CB 3.4Å; I85-A89 PolarHBondContact O-N 3.34Å
86	F	93.2	Very high	91.9	Very high	24 Å²	24	56.5 Å²	56.5	11%	0.105	31%	0.309	C	S	.	.	H	α-helix	trans	-60	-45.1	176.2	170.5	-91.8	0	0	0	111.9	S62 L64 R82 F83 V84 E88 A89 N90 V100 Q104	S62-F86 WeakPolarHBondContact O-CE2 3.44Å; L64-F86 HydrophobicContact CB-CD2 3.96Å; L64-F86 HydrophobicContact CB-CE2 4.31Å; L64-F86 HydrophobicContact CB-CG 4.13Å; L64-F86 HydrophobicContact CD2-CB 4.39Å; L64-F86 HydrophobicContact CD2-CD1 4.44Å; L64-F86 HydrophobicContact CD2-CG 4.36Å; R82-F86 WeakPolarHBondContact O-CB 3.48Å; R82-F86 PolarHBondContact O-N 3.39Å; F83-F86 WeakPolarHBondContact O-CB 3.46Å; F83-F86 PolarHBondContact O-N 3.41Å; V84-F86 VanDerWaalsContact C-N 3.29Å; V84-F86 PolarHBondContact O-N 2.84Å; F86-E88 VanDerWaalsContact C-N 3.34Å; F86-E88 PolarHBondContact O-N 3.07Å; F86-A89 PolarHBondContact O-N 3.06Å; F86-N90 WeakPolarHBondContact CD2-ND2 3.26Å; F86-N90 VanDerWaalsContact CE2-ND2 3.28Å; F86-N90 WeakPolarHBondContact CE2-ND2 3.03Å; F86-N90 WeakPolarHBondContact O-CB 3.38Å; F86-N90 PolarHBondContact O-N 3.42Å; F86-N90 PolarHBondContact O-ND2 3.12Å; F86-V100 HydrophobicContact CD1-CG1 4.41Å; F86-V100 HydrophobicContact CE1-CG1 3.64Å; F86-Q104 HydrophobicContact CE1-CG 4.19Å; F86-Q104 HydrophobicContact CZ-CG 4.4Å
87	A	92.2	Very high	92	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.5	-38.7	179.2	0	0	0	0	0	111.8	F83 V84 I85 N91 V92	F83-A87 HydrophobicContact CE1-CB 4.32Å; F83-A87 HydrophobicContact CZ-CB 4.34Å; F83-A87 WeakPolarHBondContact O-CB 3.5Å; F83-A87 PolarHBondContact O-N 3.29Å; V84-A87 PolarHBondContact O-N 3.35Å; V84-A87 VanDerWaalsContact O-N 3.16Å; I85-A87 PolarHBondContact O-N 3.44Å; A87-N91 PolarHBondContact O-N 3.49Å; A87-N91 VanDerWaalsContact O-N 3.15Å; A87-V92 HydrophobicContact CB-CB 3.99Å; A87-V92 HydrophobicContact CB-CG2 4.32Å; A87-V92 PolarHBondContact O-N 3.1Å
88	E	91.1	Very high	92.3	Very high	97 Å²	97	59.3 Å²	59.3	45%	0.453	32%	0.317	S	S	.	.	H	α-helix	trans	-67.3	-49.4	175.1	-72.2	176.2	176.8	0	0	111.8	V84 I85 F86 N90 N91	V84-E88 WeakPolarHBondContact O-CG 3.48Å; V84-E88 PolarHBondContact O-N 3.41Å; I85-E88 PolarHBondContact O-N 2.93Å; F86-E88 VanDerWaalsContact C-N 3.34Å; F86-E88 PolarHBondContact O-N 3.07Å; E88-N90 PolarHBondContact O-N 3.42Å; E88-N91 PolarHBondContact O-N 2.9Å
89	A	91.5	Very high	92.4	Very high	52 Å²	52	59.1 Å²	59.1	43%	0.43	32%	0.322	S	S	.	.	H	α-helix	trans	-59	-31.8	178.8	0	0	0	0	0	112.5	I85 F86	I85-A89 WeakPolarHBondContact O-CB 3.4Å; I85-A89 PolarHBondContact O-N 3.34Å; F86-A89 PolarHBondContact O-N 3.06Å
90	N	90.7	Very high	92.3	Very high	19 Å²	19	60.3 Å²	60.3	10%	0.102	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	11.3	179.9	-69.8	-75.9	0	0	0	113.9	F86 E88 V92	F86-N90 WeakPolarHBondContact CD2-ND2 3.26Å; F86-N90 VanDerWaalsContact CE2-ND2 3.28Å; F86-N90 WeakPolarHBondContact CE2-ND2 3.03Å; F86-N90 WeakPolarHBondContact O-CB 3.38Å; F86-N90 PolarHBondContact O-N 3.42Å; F86-N90 PolarHBondContact O-ND2 3.12Å; E88-N90 PolarHBondContact O-N 3.42Å; N90-V92 HydrophobicContact CB-CG2 4Å; N90-V92 PolarHBondContact O-N 2.67Å; N90-V92 VanDerWaalsContact O-N 3.13Å
91	N	92.3	Very high	92.3	Very high	140 Å²	140	59.6 Å²	59.6	75%	0.749	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	36.5	-179.8	-61.8	-67.7	0	0	0	113.7	A87 E88 P93	A87-N91 PolarHBondContact O-N 3.49Å; A87-N91 VanDerWaalsContact O-N 3.15Å; E88-N91 PolarHBondContact O-N 2.9Å; N91-P93 WeakPolarHBondContact O-CD 3.41Å
92	V	90.4	Very high	92.3	Very high	20 Å²	20	56.4 Å²	56.4	12%	0.121	31%	0.313	C	S	.	.			trans	-68.9	116.5	-178.6	178.5	0	0	0	0	109.2	A87 N90 N96 R97 V100	A87-V92 HydrophobicContact CB-CB 3.99Å; A87-V92 HydrophobicContact CB-CG2 4.32Å; A87-V92 PolarHBondContact O-N 3.1Å; N90-V92 HydrophobicContact CB-CG2 4Å; N90-V92 PolarHBondContact O-N 2.67Å; N90-V92 VanDerWaalsContact O-N 3.13Å; V92-N96 HydrophobicContact CG1-CB 4.04Å; V92-R97 HydrophobicContact CG1-CG 4.07Å; V92-V100 HydrophobicContact CG1-CB 4.24Å; V92-V100 HydrophobicContact CG1-CG2 3.76Å; V92-V100 HydrophobicContact CG2-CG1 4.41Å; V92-V100 HydrophobicContact CG2-CG2 4.38Å
93	P	93.5	Very high	92.2	Very high	67 Å²	67	57.2 Å²	57.2	44%	0.435	33%	0.325	S	S	.	.			trans	-60	146	177.8	-23.6	34.7	0	0	0	111.2	N91 A95 N96 R97	N91-P93 WeakPolarHBondContact O-CD 3.41Å; P93-A95 PolarHBondContact O-N 3.47Å; P93-A95 VanDerWaalsContact O-N 3.1Å; P93-N96 PolarHBondContact O-N 3.37Å; P93-R97 PolarHBondContact O-N 3.17Å
94	P	91.1	Very high	92.1	Very high	99 Å²	99	59.2 Å²	59.2	64%	0.643	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-50	-39.7	178.6	-29.9	36	0	0	0	113.9	N96 R97	P94-N96 PolarHBondContact O-N 2.94Å; P94-R97 WeakPolarHBondContact O-CB 3.49Å; P94-R97 PolarHBondContact O-N 3.34Å
95	A	91.6	Very high	92.1	Very high	80 Å²	80	58.2 Å²	58.2	66%	0.661	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-60.4	-26.3	177.2	0	0	0	0	0	114.1	P93	P93-A95 PolarHBondContact O-N 3.47Å; P93-A95 VanDerWaalsContact O-N 3.1Å
96	N	92.7	Very high	92.2	Very high	79 Å²	79	53.8 Å²	53.8	42%	0.422	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-97.1	-11.4	-177.9	-68	-6.6	0	0	0	113	V92 P93 P94 R98 T99 V100	V92-N96 HydrophobicContact CG1-CB 4.04Å; P93-N96 PolarHBondContact O-N 3.37Å; P94-N96 PolarHBondContact O-N 2.94Å; N96-R98 VanDerWaalsContact C-N 3.29Å; N96-R98 PolarHBondContact O-N 2.92Å; N96-T99 PolarHBondContact O-N 3.43Å; N96-V100 WeakPolarHBondContact O-CG2 3.37Å; N96-V100 PolarHBondContact O-N 3.2Å
97	R	92.2	Very high	92.2	Very high	54 Å²	54	57 Å²	57	20%	0.204	33%	0.333	C	S	.	.	H	α-helix	trans	-55.6	-40.9	-175.4	-73	-179	-179.9	-172.8	-6	112.8	F83 V92 P93 P94 T99 V100 S101 F127	F83-R97 HydrophobicContact CE1-CB 4.19Å; F83-R97 HydrophobicContact CE1-CG 4.48Å; F83-R97 HydrophobicContact CZ-CB 4.21Å; F83-R97 VanDerWaalsContact CZ-O 3.26Å; F83-R97 WeakPolarHBondContact CZ-O 3.48Å; V92-R97 HydrophobicContact CG1-CG 4.07Å; P93-R97 PolarHBondContact O-N 3.17Å; P94-R97 WeakPolarHBondContact O-CB 3.49Å; P94-R97 PolarHBondContact O-N 3.34Å; R97-T99 PolarHBondContact O-N 3.41Å; R97-V100 PolarHBondContact O-N 2.68Å; R97-S101 VanDerWaalsContact O-CB 3.26Å; R97-S101 WeakPolarHBondContact O-CB 3.34Å; R97-S101 PolarHBondContact O-N 3.25Å; R97-S101 PolarHBondContact O-OG 2.85Å; R97-F127 HydrophobicContact CB-CD1 4.04Å; R97-F127 HydrophobicContact CB-CD2 4.34Å; R97-F127 HydrophobicContact CB-CE1 4.06Å; R97-F127 HydrophobicContact CB-CE2 4.36Å; R97-F127 HydrophobicContact CB-CG 4.17Å; R97-F127 HydrophobicContact CB-CZ 4.22Å
98	R	93.6	Very high	92.3	Very high	65 Å²	65	61.7 Å²	61.7	25%	0.245	36%	0.355	C	S	.	.	H	α-helix	trans	-58.1	-47.8	173.6	178.1	-168.4	66.7	-156.2	-5.2	112.7	N96 V100 S101 L102 S123 M125 F127	N96-R98 VanDerWaalsContact C-N 3.29Å; N96-R98 PolarHBondContact O-N 2.92Å; R98-V100 VanDerWaalsContact C-N 3.35Å; R98-S101 PolarHBondContact O-N 3.42Å; R98-S101 PolarHBondContact O-OG 2.52Å; R98-L102 HydrophobicContact CG-CD1 4.07Å; R98-L102 WeakPolarHBondContact O-CB 3.29Å; R98-L102 VanDerWaalsContact O-CG 3.24Å; R98-L102 WeakPolarHBondContact O-CG 3.36Å; R98-L102 PolarHBondContact O-N 3.3Å; R98-S123 PolarHBondContact NE-O 3.04Å; R98-S123 PolarHBondContact NH1-O 3.27Å; R98-S123 VanDerWaalsContact NH1-O 3.08Å; R98-S123 PolarHBondContact NH2-O 2.87Å; R98-M125 WeakPolarHBondContact CD-O 3.41Å; R98-M125 PolarHBondContact NH1-O 2.92Å; R98-F127 HydrophobicContact CB-CB 4.06Å; R98-F127 HydrophobicContact CB-CD2 4.13Å
99	T	92.5	Very high	92.4	Very high	83 Å²	83	57.2 Å²	57.2	51%	0.509	33%	0.334	S	S	.	.	H	α-helix	trans	-65.3	-44.9	-177.4	-56.4	0	0	0	0	110.2	N96 R97 L102 N103	N96-T99 PolarHBondContact O-N 3.43Å; R97-T99 PolarHBondContact O-N 3.41Å; T99-L102 PolarHBondContact O-N 3.44Å; T99-N103 WeakPolarHBondContact O-CB 3.27Å; T99-N103 PolarHBondContact O-N 3.5Å
100	V	92.8	Very high	92.5	Very high	33 Å²	33	59.1 Å²	59.1	20%	0.2	33%	0.331	C	S	.	.	H	α-helix	trans	-66.8	-41.4	178.7	-179.4	0	0	0	0	111.1	F83 F86 V92 N96 R97 R98 L102 N103 Q104	F83-V100 HydrophobicContact CE2-CB 4.36Å; F83-V100 HydrophobicContact CE2-CG1 4.05Å; F83-V100 HydrophobicContact CZ-CB 4.49Å; F86-V100 HydrophobicContact CD1-CG1 4.41Å; F86-V100 HydrophobicContact CE1-CG1 3.64Å; V92-V100 HydrophobicContact CG1-CB 4.24Å; V92-V100 HydrophobicContact CG1-CG2 3.76Å; V92-V100 HydrophobicContact CG2-CG1 4.41Å; V92-V100 HydrophobicContact CG2-CG2 4.38Å; N96-V100 WeakPolarHBondContact O-CG2 3.37Å; N96-V100 PolarHBondContact O-N 3.2Å; R97-V100 PolarHBondContact O-N 2.68Å; R98-V100 VanDerWaalsContact C-N 3.35Å; V100-L102 PolarHBondContact O-N 2.75Å; V100-N103 WeakPolarHBondContact O-CB 3.2Å; V100-N103 PolarHBondContact O-N 3.43Å; V100-Q104 HydrophobicContact CG1-CG 4.23Å; V100-Q104 VanDerWaalsContact O-CG 3.29Å; V100-Q104 WeakPolarHBondContact O-CG 3.5Å; V100-Q104 PolarHBondContact O-N 2.99Å
101	S	92.7	Very high	92.6	Very high	5 Å²	5	65.2 Å²	65.2	4%	0.035	35%	0.352	C	S	.	.	H	α-helix	trans	-63.2	-44	177.8	70.7	0	0	0	0	111.6	R97 R98 N103 Q104 C105 F127	R97-S101 VanDerWaalsContact O-CB 3.26Å; R97-S101 WeakPolarHBondContact O-CB 3.34Å; R97-S101 PolarHBondContact O-N 3.25Å; R97-S101 PolarHBondContact O-OG 2.85Å; R98-S101 PolarHBondContact O-N 3.42Å; R98-S101 PolarHBondContact O-OG 2.52Å; S101-N103 VanDerWaalsContact C-N 3.26Å; S101-N103 PolarHBondContact O-N 3.02Å; S101-Q104 PolarHBondContact O-N 2.95Å; S101-C105 WeakPolarHBondContact O-CB 3.36Å; S101-C105 PolarHBondContact O-N 2.91Å; S101-F127 WeakPolarHBondContact OG-CE2 3.46Å
102	L	93	Very high	92.6	Very high	28 Å²	28	59.9 Å²	59.9	15%	0.147	32%	0.324	C	S	.	.	H	α-helix	trans	-65	-30.6	176.5	-70.2	174.8	0	0	0	112.6	R98 T99 V100 C105 Y110 V113 P122 L130	R98-L102 HydrophobicContact CG-CD1 4.07Å; R98-L102 WeakPolarHBondContact O-CB 3.29Å; R98-L102 VanDerWaalsContact O-CG 3.24Å; R98-L102 WeakPolarHBondContact O-CG 3.36Å; R98-L102 PolarHBondContact O-N 3.3Å; T99-L102 PolarHBondContact O-N 3.44Å; V100-L102 PolarHBondContact O-N 2.75Å; L102-C105 PolarHBondContact O-SG 3.02Å; L102-Y110 HydrophobicContact CD2-CD2 4.08Å; L102-Y110 HydrophobicContact CD2-CE2 4.18Å; L102-V113 HydrophobicContact CD2-CG1 3.94Å; L102-V113 HydrophobicContact CD2-CG2 4.42Å; L102-P122 HydrophobicContact CD1-CB 3.94Å; L102-P122 HydrophobicContact CD2-CB 4.22Å; L102-L130 HydrophobicContact CD1-CD1 4.26Å; L102-L130 HydrophobicContact CD2-CD1 3.92Å; L102-L130 HydrophobicContact CD2-CD2 4.21Å; L102-L130 HydrophobicContact CG-CD1 4.39Å
103	N	91.7	Very high	92.6	Very high	121 Å²	121	59.1 Å²	59.1	65%	0.647	32%	0.319	S	S	*	.	H	α-helix	trans	-71.9	-41.4	174.8	-178.8	-95.1	0	0	0	112	T99 V100 S101	T99-N103 WeakPolarHBondContact O-CB 3.27Å; T99-N103 PolarHBondContact O-N 3.5Å; V100-N103 WeakPolarHBondContact O-CB 3.2Å; V100-N103 PolarHBondContact O-N 3.43Å; S101-N103 VanDerWaalsContact C-N 3.26Å; S101-N103 PolarHBondContact O-N 3.02Å
104	Q	92.2	Very high	92.5	Very high	43 Å²	43	62.7 Å²	62.7	20%	0.201	32%	0.324	C	S	.	.	H	α-helix	trans	-88.2	-17	-174.6	-61	-63.9	-48.2	0	0	114	L64 F86 V100 S101 G106	L64-Q104 HydrophobicContact CB-CB 4.36Å; L64-Q104 HydrophobicContact CD2-CB 3.97Å; F86-Q104 HydrophobicContact CE1-CG 4.19Å; F86-Q104 HydrophobicContact CZ-CG 4.4Å; V100-Q104 HydrophobicContact CG1-CG 4.23Å; V100-Q104 VanDerWaalsContact O-CG 3.29Å; V100-Q104 WeakPolarHBondContact O-CG 3.5Å; V100-Q104 PolarHBondContact O-N 2.99Å; S101-Q104 PolarHBondContact O-N 2.95Å; Q104-G106 PolarHBondContact O-N 3.46Å; Q104-G106 VanDerWaalsContact O-N 3.13Å
105	C	91.6	Very high	92.5	Very high	4 Å²	4	63.6 Å²	63.6	3%	0.027	32%	0.319	C	S	.	.	S	Bend	trans	-62.3	-23.8	-173.6	67.9	0	0	0	0	114.9	F67 W79 S101 L102 L109	F67-C105 PolarHBondContact N-O 2.82Å; F67-C105 VanDerWaalsContact N-O 3.11Å; W79-C105 HydrophobicContact CH2-CB 3.98Å; W79-C105 HydrophobicContact CZ2-CB 4.08Å; S101-C105 WeakPolarHBondContact O-CB 3.36Å; S101-C105 PolarHBondContact O-N 2.91Å; L102-C105 PolarHBondContact O-SG 3.02Å; C105-L109 HydrophobicContact CB-CB 3.93Å; C105-L109 HydrophobicContact CB-CD2 3.4Å; C105-L109 VanDerWaalsContact CB-CD2 3.4Å; C105-L109 HydrophobicContact CB-CG 3.7Å; C105-L109 WeakPolarHBondContact O-CB 3.27Å
106	G	93	Very high	92.3	Very high	16 Å²	16	60.7 Å²	60.7	17%	0.165	30%	0.295	C	S	.	.	H	α-helix	trans	78.5	171.8	-174	0	0	0	0	0	114.3	Q104 Q108 Y110	Q104-G106 PolarHBondContact O-N 3.46Å; Q104-G106 VanDerWaalsContact O-N 3.13Å; G106-Q108 PolarHBondContact O-N 3.48Å; G106-Y110 WeakPolarHBondContact O-CB 3.44Å; G106-Y110 PolarHBondContact O-N 2.95Å
107	P	93.9	Very high	92	Very high	91 Å²	91	57.4 Å²	57.4	59%	0.591	28%	0.278	S	S	*	.	H	α-helix	trans	-69.4	-34.9	-167.6	25.5	-34.3	0	0	0	113.9	R111	P107-R111 VanDerWaalsContact O-CG 3.3Å; P107-R111 WeakPolarHBondContact O-CG 3.38Å; P107-R111 PolarHBondContact O-N 2.82Å; P107-R111 VanDerWaalsContact O-N 3.07Å
108	Q	93.9	Very high	91.2	Very high	100 Å²	100	59.9 Å²	59.9	47%	0.467	30%	0.3	S	S	.	.	H	α-helix	trans	-69.9	-48	-177.7	-66.9	177.1	-5.4	0	0	111.1	V69 G106 R111 L112	V69-Q108 HydrophobicContact CG1-CB 4.02Å; V69-Q108 HydrophobicContact CG2-CB 3.87Å; V69-Q108 HydrophobicContact CG2-CG 4.48Å; G106-Q108 PolarHBondContact O-N 3.48Å; Q108-R111 PolarHBondContact O-N 3.27Å; Q108-L112 PolarHBondContact O-N 2.89Å
109	L	93.2	Very high	90.3	Very high	2 Å²	2	64.7 Å²	64.7	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-63.8	-42	174.8	-178.1	48.2	0	0	0	111.5	F67 V69 W76 W79 C105 R111 L112 V113 V134	F67-L109 HydrophobicContact CB-CB 4.12Å; F67-L109 HydrophobicContact CB-CD2 3.44Å; F67-L109 VanDerWaalsContact CB-CD2 3.44Å; F67-L109 HydrophobicContact CB-CG 4.36Å; F67-L109 HydrophobicContact CD1-CB 3.95Å; F67-L109 HydrophobicContact CD1-CD1 3.83Å; F67-L109 HydrophobicContact CD1-CD2 3.61Å; F67-L109 HydrophobicContact CD1-CG 3.98Å; F67-L109 HydrophobicContact CE1-CD1 4.34Å; F67-L109 HydrophobicContact CG-CD2 3.83Å; V69-L109 HydrophobicContact CG1-CB 4.45Å; W76-L109 HydrophobicContact CE3-CD1 4.32Å; W76-L109 HydrophobicContact CE3-CD2 4.24Å; W76-L109 HydrophobicContact CZ3-CD1 3.89Å; W76-L109 HydrophobicContact CZ3-CD2 3.55Å; W76-L109 HydrophobicContact CZ3-CG 4.36Å; W79-L109 HydrophobicContact CD2-CD2 4.48Å; W79-L109 HydrophobicContact CE3-CD2 4.22Å; W79-L109 HydrophobicContact CH2-CD2 4.22Å; W79-L109 HydrophobicContact CZ2-CD2 4.48Å; W79-L109 HydrophobicContact CZ3-CD2 4.09Å; C105-L109 HydrophobicContact CB-CB 3.93Å; C105-L109 HydrophobicContact CB-CD2 3.4Å; C105-L109 VanDerWaalsContact CB-CD2 3.4Å; C105-L109 HydrophobicContact CB-CG 3.7Å; C105-L109 WeakPolarHBondContact O-CB 3.27Å; L109-R111 VanDerWaalsContact C-N 3.29Å; L109-R111 PolarHBondContact O-N 3.23Å; L109-L112 HydrophobicContact CD1-CD2 4.38Å; L109-L112 PolarHBondContact O-N 3.07Å; L109-L112 VanDerWaalsContact O-N 3.14Å; L109-V113 HydrophobicContact CD1-CG2 4.18Å; L109-V113 HydrophobicContact CG-CG2 4.37Å; L109-V113 VanDerWaalsContact O-CG2 3.28Å; L109-V113 WeakPolarHBondContact O-CG2 2.97Å; L109-V113 PolarHBondContact O-N 2.93Å; L109-V134 HydrophobicContact CD1-CG1 3.87Å; L109-V134 HydrophobicContact CD1-CG2 4.44Å
110	Y	93.6	Very high	89.8	Confident	93 Å²	93	67.4 Å²	67.4	37%	0.365	33%	0.334	S	S	.	.	H	α-helix	trans	-59.6	-39	177.1	-171.1	-100.7	0	0	0	112.7	L102 G106 V113 R114	L102-Y110 HydrophobicContact CD2-CD2 4.08Å; L102-Y110 HydrophobicContact CD2-CE2 4.18Å; G106-Y110 WeakPolarHBondContact O-CB 3.44Å; G106-Y110 PolarHBondContact O-N 2.95Å; Y110-V113 WeakPolarHBondContact O-CB 3.12Å; Y110-V113 PolarHBondContact O-N 2.98Å; Y110-R114 HydrophobicContact CD1-CG 4.3Å; Y110-R114 HydrophobicContact CE1-CG 3.98Å; Y110-R114 WeakPolarHBondContact O-CG 3.23Å; Y110-R114 PolarHBondContact O-N 3.29Å
111	R	92.9	Very high	89.6	Confident	147 Å²	147	73.1 Å²	73.1	56%	0.555	36%	0.356	S	S	*	.	H	α-helix	trans	-60	-49.3	173.2	-74	172	-171.5	168.7	2.4	111.3	P107 Q108 L109 V113 R114 E115	P107-R111 VanDerWaalsContact O-CG 3.3Å; P107-R111 WeakPolarHBondContact O-CG 3.38Å; P107-R111 PolarHBondContact O-N 2.82Å; P107-R111 VanDerWaalsContact O-N 3.07Å; Q108-R111 PolarHBondContact O-N 3.27Å; L109-R111 VanDerWaalsContact C-N 3.29Å; L109-R111 PolarHBondContact O-N 3.23Å; R111-V113 VanDerWaalsContact C-N 3.31Å; R111-V113 PolarHBondContact O-N 3.26Å; R111-R114 WeakPolarHBondContact O-CB 3.48Å; R111-R114 PolarHBondContact O-N 3.09Å; R111-R114 VanDerWaalsContact O-N 3.11Å; R111-E115 WeakPolarHBondContact O-CG 3.28Å; R111-E115 PolarHBondContact O-N 2.89Å
112	L	91.7	Very high	89.3	Confident	28 Å²	28	73.4 Å²	73.4	15%	0.147	36%	0.358	C	S	.	.	H	α-helix	trans	-61.2	-39.1	177.8	-176.1	151.3	0	0	0	111.9	Q108 L109 E115 A116 V134 R137 F138	Q108-L112 PolarHBondContact O-N 2.89Å; L109-L112 HydrophobicContact CD1-CD2 4.38Å; L109-L112 PolarHBondContact O-N 3.07Å; L109-L112 VanDerWaalsContact O-N 3.14Å; L112-E115 CarbonylContact O-C 3.59Å; L112-E115 PolarHBondContact O-N 3.05Å; L112-A116 VanDerWaalsContact O-CB 3.31Å; L112-A116 WeakPolarHBondContact O-CB 3.32Å; L112-A116 PolarHBondContact O-N 3.41Å; L112-V134 HydrophobicContact CD2-CB 4.19Å; L112-V134 HydrophobicContact CD2-CG1 3.76Å; L112-V134 HydrophobicContact CD2-CG2 4.07Å; L112-R137 HydrophobicContact CD1-CB 4.41Å; L112-R137 HydrophobicContact CD2-CB 4.02Å; L112-R137 HydrophobicContact CD2-CG 4.09Å; L112-R137 HydrophobicContact CG-CB 4.34Å; L112-R137 HydrophobicContact CG-CG 4.42Å; L112-F138 HydrophobicContact CD1-CE1 3.72Å; L112-F138 HydrophobicContact CD1-CE2 4.11Å; L112-F138 HydrophobicContact CD1-CZ 3.36Å; L112-F138 HydrophobicContact CD2-CE2 4.19Å; L112-F138 HydrophobicContact CD2-CZ 4.24Å; L112-F138 HydrophobicContact CG-CZ 4.45Å
113	V	91.9	Very high	88.9	Confident	3 Å²	3	75.6 Å²	75.6	2%	0.018	38%	0.375	C	S	.	.	H	α-helix	trans	-58.5	-48.2	172.9	169.5	0	0	0	0	110.7	L102 L109 Y110 R111 E115 A116 V117 P122 L130 V134	L102-V113 HydrophobicContact CD2-CG1 3.94Å; L102-V113 HydrophobicContact CD2-CG2 4.42Å; L109-V113 HydrophobicContact CD1-CG2 4.18Å; L109-V113 HydrophobicContact CG-CG2 4.37Å; L109-V113 VanDerWaalsContact O-CG2 3.28Å; L109-V113 WeakPolarHBondContact O-CG2 2.97Å; L109-V113 PolarHBondContact O-N 2.93Å; Y110-V113 WeakPolarHBondContact O-CB 3.12Å; Y110-V113 PolarHBondContact O-N 2.98Å; R111-V113 VanDerWaalsContact C-N 3.31Å; R111-V113 PolarHBondContact O-N 3.26Å; V113-E115 VanDerWaalsContact C-N 3.31Å; V113-E115 PolarHBondContact O-N 3.19Å; V113-A116 PolarHBondContact O-N 3.07Å; V113-V117 HydrophobicContact CG1-CG2 4.43Å; V113-V117 WeakPolarHBondContact O-CB 3.44Å; V113-V117 VanDerWaalsContact O-CG2 3.24Å; V113-V117 WeakPolarHBondContact O-CG2 3.47Å; V113-V117 PolarHBondContact O-N 2.89Å; V113-P122 HydrophobicContact CG1-CB 3.77Å; V113-P122 HydrophobicContact CG1-CG 3.89Å; V113-L130 HydrophobicContact CG1-CD1 3.79Å; V113-L130 HydrophobicContact CG1-CD2 4.32Å; V113-L130 HydrophobicContact CG1-CG 4.09Å; V113-L130 HydrophobicContact CG2-CD2 4.25Å; V113-V134 HydrophobicContact CB-CG2 4.36Å; V113-V134 HydrophobicContact CG2-CG2 3.46Å; V113-V134 VanDerWaalsContact CG2-CG2 3.46Å
114	R	91.3	Very high	88.7	Confident	142 Å²	142	73.4 Å²	73.4	54%	0.536	37%	0.369	S	S	.	.	H	α-helix	trans	-61.7	-41.8	177.6	-64.5	-163.9	-32.6	-149	3.7	111.9	Y110 R111 A116 V117 T118 P122	Y110-R114 HydrophobicContact CD1-CG 4.3Å; Y110-R114 HydrophobicContact CE1-CG 3.98Å; Y110-R114 WeakPolarHBondContact O-CG 3.23Å; Y110-R114 PolarHBondContact O-N 3.29Å; R111-R114 WeakPolarHBondContact O-CB 3.48Å; R111-R114 PolarHBondContact O-N 3.09Å; R111-R114 VanDerWaalsContact O-N 3.11Å; R114-A116 VanDerWaalsContact C-N 3.3Å; R114-A116 PolarHBondContact O-N 3.5Å; R114-V117 PolarHBondContact O-N 3.38Å; R114-T118 PolarHBondContact O-N 3.43Å; R114-P122 HydrophobicContact CG-CG 4.18Å
115	E	89.9	Confident	88.6	Confident	118 Å²	118	73 Å²	73	55%	0.551	37%	0.368	S	S	*	.	H	α-helix	trans	-65.7	-33.3	176.7	-71.1	168.5	-163.3	0	0	111.9	R111 L112 V113 T118 R137	R111-E115 WeakPolarHBondContact O-CG 3.28Å; R111-E115 PolarHBondContact O-N 2.89Å; L112-E115 CarbonylContact O-C 3.59Å; L112-E115 PolarHBondContact O-N 3.05Å; V113-E115 VanDerWaalsContact C-N 3.31Å; V113-E115 PolarHBondContact O-N 3.19Å; E115-T118 WeakPolarHBondContact O-CG2 3.43Å; E115-R137 PolarHBondContact O-NH2 2.94Å
116	A	88	Confident	88.5	Confident	19 Å²	19	75.6 Å²	75.6	16%	0.157	39%	0.386	C	S	.	.	H	α-helix	trans	-71.9	-30.8	175.9	0	0	0	0	0	113	L112 V113 R114 A133 R137	L112-A116 VanDerWaalsContact O-CB 3.31Å; L112-A116 WeakPolarHBondContact O-CB 3.32Å; L112-A116 PolarHBondContact O-N 3.41Å; V113-A116 PolarHBondContact O-N 3.07Å; R114-A116 VanDerWaalsContact C-N 3.3Å; R114-A116 PolarHBondContact O-N 3.5Å; A116-A133 HydrophobicContact CB-CB 4.01Å; A116-R137 HydrophobicContact CB-CG 3.84Å
117	V	86.7	Confident	88.5	Confident	11 Å²	11	75.8 Å²	75.8	7%	0.067	38%	0.382	C	S	.	.	H	α-helix	trans	-98.6	-8	-170.1	176.1	0	0	0	0	113.8	V113 R114 L119 K120 M125 A133	V113-V117 HydrophobicContact CG1-CG2 4.43Å; V113-V117 WeakPolarHBondContact O-CB 3.44Å; V113-V117 VanDerWaalsContact O-CG2 3.24Å; V113-V117 WeakPolarHBondContact O-CG2 3.47Å; V113-V117 PolarHBondContact O-N 2.89Å; R114-V117 PolarHBondContact O-N 3.38Å; V117-L119 PolarHBondContact O-N 3.04Å; V117-K120 HydrophobicContact CG1-CB 3.68Å; V117-K120 WeakPolarHBondContact CG1-O 3.15Å; V117-K120 PolarHBondContact O-N 2.95Å; V117-M125 HydrophobicContact CB-SD 3.94Å; V117-M125 HydrophobicContact CG1-CG 4.13Å; V117-M125 HydrophobicContact CG1-SD 3.2Å; V117-M125 WeakPolarHBondContact CG1-SD 3.26Å; V117-M125 HydrophobicContact CG2-SD 3.46Å; V117-M125 WeakPolarHBondContact CG2-SD 3.48Å; V117-A133 HydrophobicContact CG2-CB 4.3Å
118	T	74.8	Confident	88.3	Confident	106 Å²	106	76.8 Å²	76.8	65%	0.65	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	20.1	-46.2	177	61	0	0	0	0	120.7	R114 E115	R114-T118 PolarHBondContact O-N 3.43Å; E115-T118 WeakPolarHBondContact O-CG2 3.43Å
119	L	75.8	Confident	88.2	Confident	165 Å²	165	73.3 Å²	73.3	86%	0.864	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-8.3	-178	-60.6	177.5	0	0	0	114.4	V117	V117-L119 PolarHBondContact O-N 3.04Å
120	K	82.1	Confident	88.1	Confident	140 Å²	140	73.5 Å²	73.5	61%	0.609	37%	0.369	S	S	*	.	S	Bend	trans	-126.4	162.5	-176.6	-64.3	180	-177.7	178.2	0	111.7	V117 M125	V117-K120 HydrophobicContact CG1-CB 3.68Å; V117-K120 WeakPolarHBondContact CG1-O 3.15Å; V117-K120 PolarHBondContact O-N 2.95Å; K120-M125 HydrophobicContact CB-CG 4.38Å; K120-M125 HydrophobicContact CD-CG 4.3Å
121	K	87.3	Confident	88	Confident	153 Å²	153	70.1 Å²	70.1	67%	0.665	36%	0.357	S	S	*	.			trans	-78.1	137.8	168.1	-68.8	-178.8	-179.5	175.5	0	107.8	S123 S124	K121-S123 PolarHBondContact O-N 3.33Å; K121-S123 VanDerWaalsContact O-N 3.09Å; K121-S124 PolarHBondContact N-OG 3Å; K121-S124 PolarHBondContact O-N 3.44Å; K121-S124 PolarHBondContact O-OG 3.26Å
122	P	86.1	Confident	87.8	Confident	12 Å²	12	66.4 Å²	66.4	8%	0.078	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-53.3	-33.4	174	-29.8	36.7	0	0	0	113	L102 V113 R114 S124 L130	L102-P122 HydrophobicContact CD1-CB 3.94Å; L102-P122 HydrophobicContact CD2-CB 4.22Å; V113-P122 HydrophobicContact CG1-CB 3.77Å; V113-P122 HydrophobicContact CG1-CG 3.89Å; R114-P122 HydrophobicContact CG-CG 4.18Å; P122-S124 VanDerWaalsContact C-N 3.27Å; P122-S124 PolarHBondContact O-N 3.05Å; P122-L130 HydrophobicContact CB-CD1 4.07Å
123	S	86.1	Confident	87.7	Confident	73 Å²	73	66.3 Å²	66.3	51%	0.51	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-70.5	-14	176	55.7	0	0	0	0	115	R98 K121	R98-S123 PolarHBondContact NE-O 3.04Å; R98-S123 PolarHBondContact NH1-O 3.27Å; R98-S123 VanDerWaalsContact NH1-O 3.08Å; R98-S123 PolarHBondContact NH2-O 2.87Å; K121-S123 PolarHBondContact O-N 3.33Å; K121-S123 VanDerWaalsContact O-N 3.09Å
124	S	87.4	Confident	87.7	Confident	75 Å²	75	66.2 Å²	66.2	52%	0.524	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-97.2	-5.1	-179.7	69.3	0	0	0	0	114	K121 P122	K121-S124 PolarHBondContact N-OG 3Å; K121-S124 PolarHBondContact O-N 3.44Å; K121-S124 PolarHBondContact O-OG 3.26Å; P122-S124 VanDerWaalsContact C-N 3.27Å; P122-S124 PolarHBondContact O-N 3.05Å
125	M	88.3	Confident	87.6	Confident	35 Å²	35	60.8 Å²	60.8	17%	0.172	33%	0.329	C	S	.	.	S	Bend	trans	-92.9	160.3	177.4	-67.2	-170.7	68.1	0	0	112	R98 V117 K120 A129	R98-M125 WeakPolarHBondContact CD-O 3.41Å; R98-M125 PolarHBondContact NH1-O 2.92Å; V117-M125 HydrophobicContact CB-SD 3.94Å; V117-M125 HydrophobicContact CG1-CG 4.13Å; V117-M125 HydrophobicContact CG1-SD 3.2Å; V117-M125 WeakPolarHBondContact CG1-SD 3.26Å; V117-M125 HydrophobicContact CG2-SD 3.46Å; V117-M125 WeakPolarHBondContact CG2-SD 3.48Å; K120-M125 HydrophobicContact CB-CG 4.38Å; K120-M125 HydrophobicContact CD-CG 4.3Å; M125-A129 HydrophobicContact CE-CB 3.58Å
126	S	90.9	Very high	87.5	Confident	58 Å²	58	56.9 Å²	56.9	41%	0.406	32%	0.32	S	S	.	.			trans	-68	161.9	166.8	67.2	0	0	0	0	110.7	E128 A129 L130	S126-E128 VanDerWaalsContact C-N 3.29Å; S126-E128 PolarHBondContact O-N 3.12Å; S126-A129 VanDerWaalsContact OG-CB 3.24Å; S126-A129 WeakPolarHBondContact OG-CB 3.07Å; S126-A129 PolarHBondContact OG-N 3.32Å; S126-A129 VanDerWaalsContact OG-N 3.14Å; S126-L130 WeakPolarHBondContact O-CB 3.4Å; S126-L130 PolarHBondContact O-N 3.49Å; S126-L130 VanDerWaalsContact O-N 3.13Å
127	F	91.8	Very high	87.6	Confident	20 Å²	20	62.4 Å²	62.4	9%	0.088	34%	0.337	C	S	.	.	H	α-helix	trans	-61.6	-42.6	177.1	-179.5	-126	0	0	0	111	M80 F83 R97 R98 S101 L130 I131	M80-F127 HydrophobicContact CE-CE1 4.43Å; M80-F127 HydrophobicContact CE-CZ 3.82Å; F83-F127 HydrophobicContact CD1-CE2 4.46Å; F83-F127 AromaticContact CD1-CZ 3.77Å; F83-F127 HydrophobicContact CD1-CZ 3.77Å; F83-F127 HydrophobicContact CE1-CE1 4.19Å; F83-F127 AromaticContact CE1-CE2 3.87Å; F83-F127 HydrophobicContact CE1-CE2 3.87Å; F83-F127 AromaticContact CE1-CZ 3.32Å; F83-F127 HydrophobicContact CE1-CZ 3.32Å; F83-F127 HydrophobicContact CZ-CE2 4.41Å; F83-F127 HydrophobicContact CZ-CZ 4.26Å; R97-F127 HydrophobicContact CB-CD1 4.04Å; R97-F127 HydrophobicContact CB-CD2 4.34Å; R97-F127 HydrophobicContact CB-CE1 4.06Å; R97-F127 HydrophobicContact CB-CE2 4.36Å; R97-F127 HydrophobicContact CB-CG 4.17Å; R97-F127 HydrophobicContact CB-CZ 4.22Å; R98-F127 HydrophobicContact CB-CB 4.06Å; R98-F127 HydrophobicContact CB-CD2 4.13Å; S101-F127 WeakPolarHBondContact OG-CE2 3.46Å; F127-L130 WeakPolarHBondContact O-CB 3.4Å; F127-L130 PolarHBondContact O-N 3.39Å; F127-I131 HydrophobicContact CD1-CD1 3.84Å; F127-I131 HydrophobicContact CD2-CD1 4.25Å; F127-I131 HydrophobicContact CE1-CD1 3.55Å; F127-I131 HydrophobicContact CE2-CD1 3.99Å; F127-I131 HydrophobicContact CE2-CG1 4.29Å; F127-I131 HydrophobicContact CG-CD1 4.2Å; F127-I131 HydrophobicContact CZ-CD1 3.64Å; F127-I131 HydrophobicContact CZ-CG1 4.36Å; F127-I131 WeakPolarHBondContact O-CG1 3.46Å; F127-I131 PolarHBondContact O-N 3.06Å
128	E	91.4	Very high	87.6	Confident	113 Å²	113	63.8 Å²	63.8	53%	0.528	34%	0.342	S	S	.	.	H	α-helix	trans	-63.7	-47.5	-179.8	-60.6	70.3	-152.3	0	0	111.1	S126 L130 I131 E132	S126-E128 VanDerWaalsContact C-N 3.29Å; S126-E128 PolarHBondContact O-N 3.12Å; E128-L130 PolarHBondContact O-N 2.75Å; E128-I131 PolarHBondContact O-N 2.96Å; E128-E132 WeakPolarHBondContact O-CG 3.32Å; E128-E132 PolarHBondContact O-N 3.34Å
129	A	91	Very high	88	Confident	27 Å²	27	59.6 Å²	59.6	22%	0.223	32%	0.316	C	S	.	.	H	α-helix	trans	-66.1	-29.7	179.6	0	0	0	0	0	112.2	M125 S126 A133	M125-A129 HydrophobicContact CE-CB 3.58Å; S126-A129 VanDerWaalsContact OG-CB 3.24Å; S126-A129 WeakPolarHBondContact OG-CB 3.07Å; S126-A129 PolarHBondContact OG-N 3.32Å; S126-A129 VanDerWaalsContact OG-N 3.14Å; A129-A133 WeakPolarHBondContact O-CB 3.16Å; A129-A133 PolarHBondContact O-N 3.05Å
130	L	90.7	Very high	88	Confident	5 Å²	5	56.4 Å²	56.4	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-70.6	-42.4	174.5	-168.5	134.9	0	0	0	111.6	L102 V113 P122 S126 F127 E128 A133 V134	L102-L130 HydrophobicContact CD1-CD1 4.26Å; L102-L130 HydrophobicContact CD2-CD1 3.92Å; L102-L130 HydrophobicContact CD2-CD2 4.21Å; L102-L130 HydrophobicContact CG-CD1 4.39Å; V113-L130 HydrophobicContact CG1-CD1 3.79Å; V113-L130 HydrophobicContact CG1-CD2 4.32Å; V113-L130 HydrophobicContact CG1-CG 4.09Å; V113-L130 HydrophobicContact CG2-CD2 4.25Å; P122-L130 HydrophobicContact CB-CD1 4.07Å; S126-L130 WeakPolarHBondContact O-CB 3.4Å; S126-L130 PolarHBondContact O-N 3.49Å; S126-L130 VanDerWaalsContact O-N 3.13Å; F127-L130 WeakPolarHBondContact O-CB 3.4Å; F127-L130 PolarHBondContact O-N 3.39Å; E128-L130 PolarHBondContact O-N 2.75Å; L130-A133 PolarHBondContact O-N 3.34Å; L130-V134 WeakPolarHBondContact O-CG2 3.47Å; L130-V134 PolarHBondContact O-N 2.98Å
131	I	91.1	Very high	87.6	Confident	22 Å²	22	56 Å²	56	11%	0.113	31%	0.308	C	S	.	.	H	α-helix	trans	-60.5	-48.2	174.4	-68.1	162	0	0	0	110.4	W76 M80 F127 E128 A133 V134 Q135	W76-I131 HydrophobicContact CZ2-CB 4.35Å; W76-I131 HydrophobicContact CZ2-CG1 4.37Å; W76-I131 HydrophobicContact CZ2-CG2 4.04Å; M80-I131 HydrophobicContact CE-CD1 3.41Å; M80-I131 VanDerWaalsContact CE-CD1 3.41Å; M80-I131 HydrophobicContact CE-CG1 3.74Å; M80-I131 HydrophobicContact SD-CD1 4.46Å; M80-I131 HydrophobicContact SD-CG1 4.15Å; F127-I131 HydrophobicContact CD1-CD1 3.84Å; F127-I131 HydrophobicContact CD2-CD1 4.25Å; F127-I131 HydrophobicContact CE1-CD1 3.55Å; F127-I131 HydrophobicContact CE2-CD1 3.99Å; F127-I131 HydrophobicContact CE2-CG1 4.29Å; F127-I131 HydrophobicContact CG-CD1 4.2Å; F127-I131 HydrophobicContact CZ-CD1 3.64Å; F127-I131 HydrophobicContact CZ-CG1 4.36Å; F127-I131 WeakPolarHBondContact O-CG1 3.46Å; F127-I131 PolarHBondContact O-N 3.06Å; E128-I131 PolarHBondContact O-N 2.96Å; I131-A133 VanDerWaalsContact C-N 3.33Å; I131-A133 PolarHBondContact O-N 3.41Å; I131-V134 PolarHBondContact O-N 3.02Å; I131-Q135 VanDerWaalsContact O-CB 3.26Å; I131-Q135 WeakPolarHBondContact O-CB 3.39Å; I131-Q135 PolarHBondContact O-N 3.25Å
132	E	89.1	Confident	86.7	Confident	70 Å²	70	49.6 Å²	49.6	33%	0.327	28%	0.282	S	S	.	.	H	α-helix	trans	-57.5	-45.6	177.7	-74.9	178.1	-153	0	0	111.9	I19 E128 V134 Q135 G136	I19-E132 HydrophobicContact CD1-CG 3.75Å; I19-E132 WeakPolarHBondContact CD1-OE1 3.22Å; I19-E132 WeakPolarHBondContact CG1-OE1 3.42Å; I19-E132 HydrophobicContact CG2-CG 4.03Å; I19-E132 WeakPolarHBondContact CG2-OE1 3.01Å; I19-E132 WeakPolarHBondContact CG2-OE2 3.28Å; E128-E132 WeakPolarHBondContact O-CG 3.32Å; E128-E132 PolarHBondContact O-N 3.34Å; E132-V134 PolarHBondContact O-N 2.76Å; E132-Q135 PolarHBondContact O-N 3.41Å; E132-G136 PolarHBondContact O-N 3.47Å
133	A	89.8	Confident	86.2	Confident	26 Å²	26	50 Å²	50	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-42.9	-179.9	0	0	0	0	0	112	A116 V117 A129 L130 I131	A116-A133 HydrophobicContact CB-CB 4.01Å; V117-A133 HydrophobicContact CG2-CB 4.3Å; A129-A133 WeakPolarHBondContact O-CB 3.16Å; A129-A133 PolarHBondContact O-N 3.05Å; L130-A133 PolarHBondContact O-N 3.34Å; I131-A133 VanDerWaalsContact C-N 3.33Å; I131-A133 PolarHBondContact O-N 3.41Å
134	V	91.3	Very high	85.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.8	-46.2	175.7	170.5	0	0	0	0	111.1	W76 L109 L112 V113 L130 I131 E132 G136 R137 F138	W76-V134 HydrophobicContact CD2-CG1 3.75Å; W76-V134 HydrophobicContact CE3-CG1 3.78Å; W76-V134 HydrophobicContact CH2-CB 4Å; W76-V134 HydrophobicContact CH2-CG1 3.58Å; W76-V134 HydrophobicContact CH2-CG2 4.38Å; W76-V134 HydrophobicContact CZ2-CB 3.77Å; W76-V134 HydrophobicContact CZ2-CG1 3.52Å; W76-V134 HydrophobicContact CZ3-CG1 3.73Å; L109-V134 HydrophobicContact CD1-CG1 3.87Å; L109-V134 HydrophobicContact CD1-CG2 4.44Å; L112-V134 HydrophobicContact CD2-CB 4.19Å; L112-V134 HydrophobicContact CD2-CG1 3.76Å; L112-V134 HydrophobicContact CD2-CG2 4.07Å; V113-V134 HydrophobicContact CB-CG2 4.36Å; V113-V134 HydrophobicContact CG2-CG2 3.46Å; V113-V134 VanDerWaalsContact CG2-CG2 3.46Å; L130-V134 WeakPolarHBondContact O-CG2 3.47Å; L130-V134 PolarHBondContact O-N 2.98Å; I131-V134 PolarHBondContact O-N 3.02Å; E132-V134 PolarHBondContact O-N 2.76Å; V134-G136 VanDerWaalsContact C-N 3.3Å; V134-G136 PolarHBondContact O-N 3.48Å; V134-R137 WeakPolarHBondContact O-CB 3.47Å; V134-R137 PolarHBondContact O-N 3.27Å; V134-F138 HydrophobicContact CG1-CD2 3.97Å; V134-F138 HydrophobicContact CG1-CE2 3.52Å; V134-F138 WeakPolarHBondContact O-CD2 3.25Å; V134-F138 PolarHBondContact O-N 3.03Å
135	Q	89.2	Confident	85.7	Confident	29 Å²	29	54.2 Å²	54.2	14%	0.136	29%	0.286	C	S	.	.	H	α-helix	trans	-59.2	-42.5	-180	-173.5	174.1	-11.9	0	0	111.4	I73 I131 E132 R137 F138 D139	I73-Q135 HydrophobicContact CD1-CG 3.76Å; I131-Q135 VanDerWaalsContact O-CB 3.26Å; I131-Q135 WeakPolarHBondContact O-CB 3.39Å; I131-Q135 PolarHBondContact O-N 3.25Å; E132-Q135 PolarHBondContact O-N 3.41Å; Q135-R137 PolarHBondContact O-N 2.97Å; Q135-F138 PolarHBondContact O-N 3.19Å; Q135-D139 PolarHBondContact O-N 2.97Å
136	G	87.8	Confident	85.6	Confident	36 Å²	36	55.6 Å²	55.6	37%	0.371	30%	0.297	S	S	.	.	H	α-helix	trans	-63.7	-17.8	175.9	0	0	0	0	0	114.6	E132 V134 P140	E132-G136 PolarHBondContact O-N 3.47Å; V134-G136 VanDerWaalsContact C-N 3.3Å; V134-G136 PolarHBondContact O-N 3.48Å; G136-P140 VanDerWaalsContact O-CA 3.29Å; G136-P140 WeakPolarHBondContact O-CA 3.44Å
137	R	90	Very high	85.3	Confident	135 Å²	135	53 Å²	53	51%	0.509	28%	0.278	S	S	.	.	H	α-helix	trans	-78.2	-34.2	170.7	-67	-62.5	-170.3	-171.9	-2.1	112.5	L112 E115 A116 V134 Q135	L112-R137 HydrophobicContact CD1-CB 4.41Å; L112-R137 HydrophobicContact CD2-CB 4.02Å; L112-R137 HydrophobicContact CD2-CG 4.09Å; L112-R137 HydrophobicContact CG-CB 4.34Å; L112-R137 HydrophobicContact CG-CG 4.42Å; E115-R137 PolarHBondContact O-NH2 2.94Å; A116-R137 HydrophobicContact CB-CG 3.84Å; V134-R137 WeakPolarHBondContact O-CB 3.47Å; V134-R137 PolarHBondContact O-N 3.27Å; Q135-R137 PolarHBondContact O-N 2.97Å
138	F	87.6	Confident	85.1	Confident	39 Å²	39	55.6 Å²	55.6	17%	0.171	29%	0.288	C	S	.	.	H	α-helix	trans	-84.3	-30.9	179.3	-67.2	-59.8	0	0	0	113.3	F67 V69 I73 W76 L112 V134 Q135	F67-F138 HydrophobicContact CE1-CE1 4.35Å; F67-F138 AromaticContact CE1-CE2 3.8Å; F67-F138 HydrophobicContact CE1-CE2 3.8Å; F67-F138 AromaticContact CE1-CZ 3.51Å; F67-F138 HydrophobicContact CE1-CZ 3.51Å; F67-F138 HydrophobicContact CZ-CE2 4.3Å; F67-F138 HydrophobicContact CZ-CZ 4.11Å; V69-F138 HydrophobicContact CB-CZ 4.49Å; V69-F138 HydrophobicContact CG1-CZ 4.29Å; I73-F138 HydrophobicContact CB-CB 3.97Å; I73-F138 HydrophobicContact CD1-CB 4.06Å; W76-F138 HydrophobicContact CB-CD2 3.91Å; W76-F138 HydrophobicContact CB-CE2 4.15Å; W76-F138 HydrophobicContact CD2-CD2 4.42Å; W76-F138 HydrophobicContact CD2-CE2 4.31Å; W76-F138 HydrophobicContact CE3-CE2 4.4Å; W76-F138 AromaticContact CG-CD2 3.96Å; W76-F138 HydrophobicContact CG-CD2 3.96Å; W76-F138 HydrophobicContact CG-CE2 4.22Å; L112-F138 HydrophobicContact CD1-CE1 3.72Å; L112-F138 HydrophobicContact CD1-CE2 4.11Å; L112-F138 HydrophobicContact CD1-CZ 3.36Å; L112-F138 HydrophobicContact CD2-CE2 4.19Å; L112-F138 HydrophobicContact CD2-CZ 4.24Å; L112-F138 HydrophobicContact CG-CZ 4.45Å; V134-F138 HydrophobicContact CG1-CD2 3.97Å; V134-F138 HydrophobicContact CG1-CE2 3.52Å; V134-F138 WeakPolarHBondContact O-CD2 3.25Å; V134-F138 PolarHBondContact O-N 3.03Å; Q135-F138 PolarHBondContact O-N 3.19Å
139	D	82.6	Confident	85	Confident	19 Å²	19	53.1 Å²	53.1	10%	0.102	29%	0.286	C	S	.	.			trans	-135	78.6	179.4	-162	3.7	0	0	0	109.1	I73 Q135 I141 P142	I73-D139 HydrophobicContact CB-CB 4.39Å; I73-D139 HydrophobicContact CD1-CB 4Å; I73-D139 HydrophobicContact CG1-CB 4Å; Q135-D139 PolarHBondContact O-N 2.97Å; D139-I141 VanDerWaalsContact C-N 3.26Å; D139-I141 PolarHBondContact O-N 2.8Å; D139-P142 HydrophobicContact CB-CB 4.33Å; D139-P142 VanDerWaalsContact O-CD 3.29Å; D139-P142 WeakPolarHBondContact O-CD 3.41Å; D139-P142 WeakPolarHBondContact OD1-CA 3.46Å; D139-P142 WeakPolarHBondContact OD2-CA 3.4Å; D139-P142 WeakPolarHBondContact OD2-CB 3.3Å
140	P	76.9	Confident	85	Confident	98 Å²	98	55.6 Å²	55.6	64%	0.636	29%	0.293	S	S	*	.	S	Bend	trans	-68.8	-25.3	-174.9	26.5	-34.5	0	0	0	112.9	G136	G136-P140 VanDerWaalsContact O-CA 3.29Å; G136-P140 WeakPolarHBondContact O-CA 3.44Å
141	I	72.5	Confident	85.1	Confident	132 Å²	132	55.3 Å²	55.3	68%	0.677	29%	0.292	S	S	*	.	S	Bend	trans	-127.2	74.2	174.9	-50.2	176.4	0	0	0	107.5	D139 G143	D139-I141 VanDerWaalsContact C-N 3.26Å; D139-I141 PolarHBondContact O-N 2.8Å; I141-G143 PolarHBondContact O-N 3.37Å
142	P	69.1	Low	85.2	Confident	17 Å²	17	59.2 Å²	59.2	11%	0.11	31%	0.306	C	S	.	.			trans	-70.9	97.5	-179.7	29.6	-29.9	0	0	0	108.3	Y17 F20 D139	Y17-P142 HydrophobicContact CE1-CB 4.4Å; F20-P142 HydrophobicContact CD1-CG 3.82Å; F20-P142 HydrophobicContact CD2-CG 3.59Å; F20-P142 HydrophobicContact CE1-CG 3.48Å; F20-P142 VanDerWaalsContact CE1-CG 3.48Å; F20-P142 HydrophobicContact CE2-CG 3.24Å; F20-P142 HydrophobicContact CG-CG 3.88Å; F20-P142 HydrophobicContact CZ-CG 3.2Å; D139-P142 HydrophobicContact CB-CB 4.33Å; D139-P142 VanDerWaalsContact O-CD 3.29Å; D139-P142 WeakPolarHBondContact O-CD 3.41Å; D139-P142 WeakPolarHBondContact OD1-CA 3.46Å; D139-P142 WeakPolarHBondContact OD2-CA 3.4Å; D139-P142 WeakPolarHBondContact OD2-CB 3.3Å
143	G	74.9	Confident	85.5	Confident	20 Å²	20	59.3 Å²	59.3	21%	0.206	32%	0.319	C	S	.	.			trans	-119.4	123	-177.4	0	0	0	0	0	110.9	I141 Y145 T146 A147	I141-G143 PolarHBondContact O-N 3.37Å; G143-Y145 PolarHBondContact O-N 3.14Å; G143-T146 PolarHBondContact O-N 3.07Å; G143-T146 VanDerWaalsContact O-N 3.07Å; G143-A147 PolarHBondContact O-N 3.43Å
144	I	80.1	Confident	85.8	Confident	50 Å²	50	60 Å²	60	26%	0.256	32%	0.316	S	S	.	.	H	α-helix	trans	-53	-37.9	169.4	-64.8	173.5	0	0	0	110.1	R148 C176 Q177	I144-R148 HydrophobicContact CG2-CG 4.4Å; I144-R148 WeakPolarHBondContact O-CB 3.42Å; I144-R148 VanDerWaalsContact O-CG 3.24Å; I144-R148 WeakPolarHBondContact O-CG 3.37Å; I144-R148 PolarHBondContact O-N 3.03Å; I144-C176 WeakPolarHBondContact CG2-O 3.44Å; I144-Q177 HydrophobicContact CD1-CB 4.11Å; I144-Q177 HydrophobicContact CD1-CG 4.46Å; I144-Q177 HydrophobicContact CG1-CB 4.17Å; I144-Q177 HydrophobicContact CG1-CG 4.25Å; I144-Q177 HydrophobicContact CG2-CB 4.5Å
145	Y	84.4	Confident	86.1	Confident	187 Å²	187	64.4 Å²	64.4	73%	0.733	34%	0.335	S	S	*	.	H	α-helix	trans	-69.1	-38.6	178.4	-63	-64.9	0	0	0	113.2	G143 R148 A149	G143-Y145 PolarHBondContact O-N 3.14Å; Y145-R148 PolarHBondContact O-N 3.14Å; Y145-A149 VanDerWaalsContact O-CB 3.31Å; Y145-A149 WeakPolarHBondContact O-CB 3.24Å; Y145-A149 PolarHBondContact O-N 2.97Å
146	T	85.4	Confident	86.5	Confident	65 Å²	65	63.6 Å²	63.6	40%	0.399	33%	0.331	S	S	.	.	H	α-helix	trans	-62.4	-48.4	174.3	-48	0	0	0	0	110.4	G143 R148 A149 E150	G143-T146 PolarHBondContact O-N 3.07Å; G143-T146 VanDerWaalsContact O-N 3.07Å; T146-R148 VanDerWaalsContact C-N 3.33Å; T146-R148 PolarHBondContact O-N 3.44Å; T146-A149 PolarHBondContact O-N 3.47Å; T146-E150 WeakPolarHBondContact O-CG 3.42Å; T146-E150 PolarHBondContact O-N 3.48Å
147	A	84.3	Confident	86.9	Confident	2 Å²	2	67.5 Å²	67.5	2%	0.017	34%	0.34	C	S	.	.	H	α-helix	trans	-60.3	-42.1	176.9	0	0	0	0	0	112.5	G143 E150 F151 R175 C176	G143-A147 PolarHBondContact O-N 3.43Å; A147-E150 PolarHBondContact O-N 3.29Å; A147-F151 WeakPolarHBondContact O-CB 3.45Å; A147-F151 PolarHBondContact O-N 2.96Å; A147-R175 HydrophobicContact CB-CB 3.63Å; A147-R175 WeakPolarHBondContact CB-O 3.47Å; A147-C176 PolarHBondContact O-SG 3.06Å
148	R	87.8	Confident	87.1	Confident	76 Å²	76	66 Å²	66	29%	0.287	35%	0.348	S	S	.	.	H	α-helix	trans	-64	-44.6	174.5	-75.4	175.7	-177.7	-176.9	2.4	111.6	I144 Y145 T146 E150 F151 Y152 C176	I144-R148 HydrophobicContact CG2-CG 4.4Å; I144-R148 WeakPolarHBondContact O-CB 3.42Å; I144-R148 VanDerWaalsContact O-CG 3.24Å; I144-R148 WeakPolarHBondContact O-CG 3.37Å; I144-R148 PolarHBondContact O-N 3.03Å; Y145-R148 PolarHBondContact O-N 3.14Å; T146-R148 VanDerWaalsContact C-N 3.33Å; T146-R148 PolarHBondContact O-N 3.44Å; R148-E150 VanDerWaalsContact C-N 3.34Å; R148-E150 PolarHBondContact O-N 2.86Å; R148-F151 WeakPolarHBondContact O-CB 3.4Å; R148-F151 PolarHBondContact O-N 2.81Å; R148-Y152 HydrophobicContact CB-CD2 4.26Å; R148-Y152 HydrophobicContact CB-CE2 4.24Å; R148-Y152 WeakPolarHBondContact O-CD2 3.39Å; R148-Y152 PolarHBondContact O-N 3.26Å; R148-C176 HydrophobicContact CG-CB 3.83Å; R148-C176 PolarHBondContact NE-O 3.19Å; R148-C176 PolarHBondContact NH2-O 3.41Å
149	A	90.5	Very high	87.5	Confident	60 Å²	60	71.9 Å²	71.9	50%	0.496	38%	0.38	S	S	.	.	H	α-helix	trans	-59.1	-46	177.8	0	0	0	0	0	111.1	Y145 T146 F151 Y152 A153	Y145-A149 VanDerWaalsContact O-CB 3.31Å; Y145-A149 WeakPolarHBondContact O-CB 3.24Å; Y145-A149 PolarHBondContact O-N 2.97Å; T146-A149 PolarHBondContact O-N 3.47Å; A149-F151 VanDerWaalsContact C-N 3.35Å; A149-F151 PolarHBondContact O-N 2.93Å; A149-Y152 PolarHBondContact O-N 3.49Å; A149-A153 WeakPolarHBondContact O-CB 3.5Å; A149-A153 PolarHBondContact O-N 3.49Å
150	E	90.4	Very high	88.2	Confident	79 Å²	79	72 Å²	72	37%	0.369	38%	0.38	S	S	.	.	H	α-helix	trans	-58.9	-44.2	173.8	-71.9	174.5	-167	0	0	112.1	T146 A147 R148 A153 R154 L172 R175	T146-E150 WeakPolarHBondContact O-CG 3.42Å; T146-E150 PolarHBondContact O-N 3.48Å; A147-E150 PolarHBondContact O-N 3.29Å; R148-E150 VanDerWaalsContact C-N 3.34Å; R148-E150 PolarHBondContact O-N 2.86Å; E150-A153 PolarHBondContact O-N 2.83Å; E150-R154 PolarHBondContact O-N 2.91Å; E150-L172 HydrophobicContact CB-CD2 4.07Å; E150-R175 IonicContact OE1-NH1 2.82Å; E150-R175 IonicContact OE2-CZ 3.51Å; E150-R175 IonicContact OE2-NH1 3.29Å; E150-R175 PolarHBondContact OE2-NH1 2.91Å
151	F	92	Very high	89.2	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-61.3	-52.6	177.4	178.4	-120.6	0	0	0	112.3	A147 R148 A149 A153 R154 L169 L172 A173 C176 Y178 Q191 L192 L195	A147-F151 WeakPolarHBondContact O-CB 3.45Å; A147-F151 PolarHBondContact O-N 2.96Å; R148-F151 WeakPolarHBondContact O-CB 3.4Å; R148-F151 PolarHBondContact O-N 2.81Å; A149-F151 VanDerWaalsContact C-N 3.35Å; A149-F151 PolarHBondContact O-N 2.93Å; F151-A153 VanDerWaalsContact C-N 3.31Å; F151-A153 PolarHBondContact O-N 3.44Å; F151-R154 WeakPolarHBondContact O-CB 3.34Å; F151-R154 PolarHBondContact O-N 2.98Å; F151-L169 HydrophobicContact CD2-CD2 4.21Å; F151-L169 HydrophobicContact CE2-CD2 4.16Å; F151-L172 HydrophobicContact CB-CB 4.12Å; F151-L172 HydrophobicContact CD2-CB 3.91Å; F151-L172 HydrophobicContact CG-CB 4.49Å; F151-A173 HydrophobicContact CD2-CB 4.23Å; F151-A173 HydrophobicContact CE2-CB 3.69Å; F151-A173 HydrophobicContact CZ-CB 3.99Å; F151-C176 WeakPolarHBondContact CB-SG 3.49Å; F151-Y178 HydrophobicContact CD1-CE2 4.19Å; F151-Y178 VanDerWaalsContact CD1-OH 3.24Å; F151-Y178 WeakPolarHBondContact CD1-OH 3.46Å; F151-Y178 AromaticContact CE1-CE2 3.89Å; F151-Y178 HydrophobicContact CE1-CE2 3.89Å; F151-Y178 WeakPolarHBondContact CE1-OH 3.42Å; F151-Q191 HydrophobicContact CE1-CB 4.32Å; F151-L192 HydrophobicContact CE2-CD1 4.19Å; F151-L195 HydrophobicContact CD1-CD1 3.38Å; F151-L195 HydrophobicContact CD2-CD1 3.98Å; F151-L195 HydrophobicContact CE1-CD1 3.24Å; F151-L195 HydrophobicContact CE1-CG 4.45Å; F151-L195 HydrophobicContact CE2-CD1 3.83Å; F151-L195 HydrophobicContact CG-CD1 3.78Å; F151-L195 HydrophobicContact CZ-CD1 3.49Å; F151-L195 VanDerWaalsContact CZ-CD1 3.49Å
152	Y	93.2	Very high	90.4	Very high	103 Å²	103	64.1 Å²	64.1	40%	0.404	34%	0.338	S	S	.	.	H	α-helix	trans	-68.1	-28.3	-179.9	-73.6	-73.9	0	0	0	113.2	R148 A149 R154 Y178 Q191 L195	R148-Y152 HydrophobicContact CB-CD2 4.26Å; R148-Y152 HydrophobicContact CB-CE2 4.24Å; R148-Y152 WeakPolarHBondContact O-CD2 3.39Å; R148-Y152 PolarHBondContact O-N 3.26Å; A149-Y152 PolarHBondContact O-N 3.49Å; Y152-R154 VanDerWaalsContact C-N 3.32Å; Y152-Y178 WeakPolarHBondContact CE2-OH 3.24Å; Y152-Y178 PolarHBondContact OH-OH 2.83Å; Y152-Q191 PolarHBondContact OH-NE2 2.98Å; Y152-L195 HydrophobicContact CD1-CD1 3.82Å; Y152-L195 HydrophobicContact CD1-CD2 3.86Å; Y152-L195 HydrophobicContact CD1-CG 4.2Å; Y152-L195 HydrophobicContact CE1-CD1 4.14Å; Y152-L195 HydrophobicContact CE1-CG 4.48Å; Y152-L195 HydrophobicContact CG-CD1 4.33Å
153	A	95.1	Very high	91.7	Very high	72 Å²	72	65 Å²	65	60%	0.595	35%	0.346	S	S	*	.	H	α-helix	trans	-77.8	-16	177	0	0	0	0	0	113.3	A149 E150 F151 K155	A149-A153 WeakPolarHBondContact O-CB 3.5Å; A149-A153 PolarHBondContact O-N 3.49Å; E150-A153 PolarHBondContact O-N 2.83Å; F151-A153 VanDerWaalsContact C-N 3.31Å; F151-A153 PolarHBondContact O-N 3.44Å; A153-K155 PolarHBondContact O-N 2.96Å
154	R	96.3	Very high	92.8	Very high	42 Å²	42	67.1 Å²	67.1	16%	0.158	36%	0.356	C	S	.	.			trans	-68	123.8	-172.5	-171.1	52.6	168.8	83.5	2.7	112.1	E150 F151 Y152 E160 F165 N168 L169 L172	E150-R154 PolarHBondContact O-N 2.91Å; F151-R154 WeakPolarHBondContact O-CB 3.34Å; F151-R154 PolarHBondContact O-N 2.98Å; Y152-R154 VanDerWaalsContact C-N 3.32Å; R154-E160 IonicContact CZ-OE1 3.58Å; R154-E160 IonicContact CZ-OE2 3.2Å; R154-E160 VanDerWaalsContact CZ-OE2 3.29Å; R154-E160 IonicContact NH1-OE1 2.9Å; R154-E160 IonicContact NH1-OE2 2.7Å; R154-E160 PolarHBondContact NH1-OE2 3.29Å; R154-E160 IonicContact NH2-OE1 3.83Å; R154-E160 PolarHBondContact NH2-OE1 3.35Å; R154-E160 IonicContact NH2-OE2 3.45Å; R154-E160 PolarHBondContact NH2-OE2 2.9Å; R154-F165 HydrophobicContact CG-CE2 4.13Å; R154-N168 PolarHBondContact NH2-ND2 3.44Å; R154-N168 VanDerWaalsContact NH2-ND2 3.19Å; R154-L169 HydrophobicContact CB-CD2 3.82Å; R154-L169 HydrophobicContact CG-CD2 3.82Å; R154-L169 HydrophobicContact CG-CG 4.36Å; R154-L172 HydrophobicContact CB-CD1 3.89Å; R154-L172 HydrophobicContact CG-CD1 3.91Å
155	K	97.7	Very high	93.6	Very high	91 Å²	91	64.8 Å²	64.8	40%	0.396	34%	0.343	S	S	.	.			trans	-124.7	141	172.6	-57.9	-60.8	176.2	-164.3	0	110	A153 Q157 I198	A153-K155 PolarHBondContact O-N 2.96Å; K155-Q157 PolarHBondContact O-N 2.86Å; K155-I198 VanDerWaalsContact NZ-CG2 3.27Å
156	Q	98.1	Very high	94.2	Very high	13 Å²	13	55.9 Å²	55.9	6%	0.061	31%	0.309	C	S	.	.			trans	-56.9	129.6	175.3	-173.8	175.2	9.9	0	0	109.5	E160 F165 G199 C201	Q156-E160 HydrophobicContact CG-CB 4.26Å; Q156-E160 HydrophobicContact CG-CG 4.49Å; Q156-E160 PolarHBondContact NE2-O 2.92Å; Q156-F165 HydrophobicContact CB-CB 4.29Å; Q156-F165 HydrophobicContact CB-CD1 3.68Å; Q156-F165 HydrophobicContact CB-CD2 3.87Å; Q156-F165 HydrophobicContact CB-CE1 3.89Å; Q156-F165 HydrophobicContact CB-CE2 4.07Å; Q156-F165 HydrophobicContact CB-CG 3.67Å; Q156-F165 HydrophobicContact CB-CZ 4.08Å; Q156-F165 HydrophobicContact CG-CB 3.92Å; Q156-F165 HydrophobicContact CG-CD1 3.99Å; Q156-F165 HydrophobicContact CG-CD2 4.42Å; Q156-F165 HydrophobicContact CG-CG 3.86Å; Q156-G199 VanDerWaalsContact CB-O 3.25Å; Q156-G199 WeakPolarHBondContact CB-O 3.49Å; Q156-G199 PolarHBondContact N-O 3.48Å; Q156-C201 HydrophobicContact CB-CB 4.07Å; Q156-C201 HydrophobicContact CG-CB 4.02Å; Q156-C201 PolarHBondContact OE1-SG 3.17Å; Q156-C201 VanDerWaalsContact OE1-SG 3.37Å
157	Q	97.2	Very high	94.5	Very high	118 Å²	118	56.9 Å²	56.9	55%	0.551	32%	0.315	S	S	*	.			trans	-72.2	153	174.6	-60.2	-61.8	-30.6	0	0	110.3	K155 D159 E160	K155-Q157 PolarHBondContact O-N 2.86Å; Q157-D159 PolarHBondContact O-N 3.28Å; Q157-D159 VanDerWaalsContact O-N 3.14Å; Q157-E160 HydrophobicContact CB-CB 3.82Å; Q157-E160 PolarHBondContact N-OE2 2.74Å; Q157-E160 VanDerWaalsContact N-OE2 3.14Å; Q157-E160 PolarHBondContact O-N 2.89Å
158	P	94.2	Very high	95	Very high	104 Å²	104	59 Å²	59	68%	0.675	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-38.2	-177.9	-29	36.1	0	0	0	114.3
159	D	94.2	Very high	95.3	Very high	161 Å²	161	55.3 Å²	55.3	86%	0.861	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	9.6	-178.5	-54.6	-55.6	0	0	0	113.4	Q157 P161	Q157-D159 PolarHBondContact O-N 3.28Å; Q157-D159 VanDerWaalsContact O-N 3.14Å; D159-P161 WeakPolarHBondContact O-CD 3.44Å
160	E	97.4	Very high	95.3	Very high	21 Å²	21	57.9 Å²	57.9	10%	0.098	31%	0.309	C	S	.	.			trans	-86.9	122.9	179.8	175.3	177.8	-150.2	0	0	111	R154 Q156 Q157 V164 F165 N168	R154-E160 IonicContact CZ-OE1 3.58Å; R154-E160 IonicContact CZ-OE2 3.2Å; R154-E160 VanDerWaalsContact CZ-OE2 3.29Å; R154-E160 IonicContact NH1-OE1 2.9Å; R154-E160 IonicContact NH1-OE2 2.7Å; R154-E160 PolarHBondContact NH1-OE2 3.29Å; R154-E160 IonicContact NH2-OE1 3.83Å; R154-E160 PolarHBondContact NH2-OE1 3.35Å; R154-E160 IonicContact NH2-OE2 3.45Å; R154-E160 PolarHBondContact NH2-OE2 2.9Å; Q156-E160 HydrophobicContact CG-CB 4.26Å; Q156-E160 HydrophobicContact CG-CG 4.49Å; Q156-E160 PolarHBondContact NE2-O 2.92Å; Q157-E160 HydrophobicContact CB-CB 3.82Å; Q157-E160 PolarHBondContact N-OE2 2.74Å; Q157-E160 VanDerWaalsContact N-OE2 3.14Å; Q157-E160 PolarHBondContact O-N 2.89Å; E160-V164 HydrophobicContact CG-CB 4.04Å; E160-V164 HydrophobicContact CG-CG1 4.09Å; E160-F165 HydrophobicContact CG-CB 4.08Å; E160-F165 VanDerWaalsContact OE1-CA 3.26Å; E160-F165 WeakPolarHBondContact OE1-CA 3.45Å; E160-F165 PolarHBondContact OE1-N 3.4Å; E160-N168 PolarHBondContact OE1-ND2 3.06Å
161	P	97.5	Very high	95	Very high	60 Å²	60	58.9 Å²	58.9	39%	0.39	31%	0.309	S	S	.	.			trans	-61.4	145	174.8	-22.1	32.7	0	0	0	112.2	D159 A163 V164 F165 E228	D159-P161 WeakPolarHBondContact O-CD 3.44Å; P161-A163 PolarHBondContact O-N 3.14Å; P161-A163 VanDerWaalsContact O-N 3.12Å; P161-V164 HydrophobicContact CB-CG2 4.16Å; P161-V164 HydrophobicContact CG-CG2 4.15Å; P161-V164 WeakPolarHBondContact O-CB 3.41Å; P161-V164 PolarHBondContact O-N 2.64Å; P161-F165 PolarHBondContact O-N 2.87Å; P161-E228 VanDerWaalsContact CA-OE2 3.27Å; P161-E228 WeakPolarHBondContact CA-OE2 3.43Å
162	V	97.9	Very high	94.8	Very high	5 Å²	5	60 Å²	60	3%	0.03	32%	0.315	C	S	.	.	H	α-helix	trans	-52.7	-38.5	180	167	0	0	0	0	112.1	F165 M166 F196 Y221 A224 L225 E228	V162-F165 PolarHBondContact O-N 3.02Å; V162-M166 WeakPolarHBondContact O-CB 3.28Å; V162-M166 PolarHBondContact O-N 3.14Å; V162-F196 HydrophobicContact CG1-CE2 4.11Å; V162-F196 HydrophobicContact CG1-CZ 3.74Å; V162-Y221 HydrophobicContact CG1-CD2 4.15Å; V162-Y221 HydrophobicContact CG1-CE2 3.89Å; V162-A224 HydrophobicContact CG1-CB 3.67Å; V162-A224 HydrophobicContact CG2-CB 4.33Å; V162-L225 HydrophobicContact CB-CD2 4.17Å; V162-L225 HydrophobicContact CG1-CD2 4.04Å; V162-L225 HydrophobicContact CG1-CG 4.31Å; V162-E228 HydrophobicContact CG2-CB 4.13Å; V162-E228 WeakPolarHBondContact CG2-OE2 3.34Å; V162-E228 PolarHBondContact N-OE2 3.05Å
163	A	97.4	Very high	94.6	Very high	35 Å²	35	55.5 Å²	55.5	29%	0.289	30%	0.299	S	S	.	.	H	α-helix	trans	-65.9	-39.7	177.5	0	0	0	0	0	113.2	P161 T167 Y221	P161-A163 PolarHBondContact O-N 3.14Å; P161-A163 VanDerWaalsContact O-N 3.12Å; A163-T167 WeakPolarHBondContact O-CB 3.4Å; A163-T167 PolarHBondContact O-N 2.75Å; A163-T167 PolarHBondContact O-OG1 3.48Å; A163-Y221 WeakPolarHBondContact CA-OH 3.26Å; A163-Y221 WeakPolarHBondContact CB-OH 3.44Å
164	V	97.1	Very high	93.9	Very high	66 Å²	66	57.8 Å²	57.8	40%	0.4	29%	0.292	S	S	.	.	H	α-helix	trans	-69.3	-43	177.3	179.5	0	0	0	0	109.7	E160 P161 M166 T167 N168	E160-V164 HydrophobicContact CG-CB 4.04Å; E160-V164 HydrophobicContact CG-CG1 4.09Å; P161-V164 HydrophobicContact CB-CG2 4.16Å; P161-V164 HydrophobicContact CG-CG2 4.15Å; P161-V164 WeakPolarHBondContact O-CB 3.41Å; P161-V164 PolarHBondContact O-N 2.64Å; V164-M166 PolarHBondContact O-N 2.79Å; V164-T167 WeakPolarHBondContact O-CB 3.38Å; V164-T167 PolarHBondContact O-N 2.68Å; V164-N168 WeakPolarHBondContact O-CB 3.32Å; V164-N168 PolarHBondContact O-N 3.5Å; V164-N168 PolarHBondContact O-ND2 3.19Å
165	F	97.9	Very high	93.1	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-57.9	-49.4	175.2	174.9	-132.3	0	0	0	112.5	R154 Q156 E160 P161 V162 T167 N168 L169 F196	R154-F165 HydrophobicContact CG-CE2 4.13Å; Q156-F165 HydrophobicContact CB-CB 4.29Å; Q156-F165 HydrophobicContact CB-CD1 3.68Å; Q156-F165 HydrophobicContact CB-CD2 3.87Å; Q156-F165 HydrophobicContact CB-CE1 3.89Å; Q156-F165 HydrophobicContact CB-CE2 4.07Å; Q156-F165 HydrophobicContact CB-CG 3.67Å; Q156-F165 HydrophobicContact CB-CZ 4.08Å; Q156-F165 HydrophobicContact CG-CB 3.92Å; Q156-F165 HydrophobicContact CG-CD1 3.99Å; Q156-F165 HydrophobicContact CG-CD2 4.42Å; Q156-F165 HydrophobicContact CG-CG 3.86Å; E160-F165 HydrophobicContact CG-CB 4.08Å; E160-F165 VanDerWaalsContact OE1-CA 3.26Å; E160-F165 WeakPolarHBondContact OE1-CA 3.45Å; E160-F165 PolarHBondContact OE1-N 3.4Å; P161-F165 PolarHBondContact O-N 2.87Å; V162-F165 PolarHBondContact O-N 3.02Å; F165-T167 VanDerWaalsContact C-N 3.31Å; F165-T167 PolarHBondContact O-N 3.09Å; F165-N168 PolarHBondContact O-N 3.47Å; F165-L169 HydrophobicContact CD1-CD1 4.41Å; F165-L169 HydrophobicContact CD2-CD1 4.16Å; F165-L169 HydrophobicContact CD2-CG 4.16Å; F165-L169 HydrophobicContact CE1-CD1 3.84Å; F165-L169 HydrophobicContact CE2-CD1 3.56Å; F165-L169 HydrophobicContact CE2-CD2 4.22Å; F165-L169 HydrophobicContact CE2-CG 3.7Å; F165-L169 HydrophobicContact CZ-CD1 3.38Å; F165-L169 HydrophobicContact CZ-CG 4.05Å; F165-L169 PolarHBondContact O-N 3.31Å; F165-F196 AromaticContact CD1-CD2 3.69Å; F165-F196 HydrophobicContact CD1-CD2 3.69Å; F165-F196 AromaticContact CD1-CE2 3.66Å; F165-F196 HydrophobicContact CD1-CE2 3.66Å; F165-F196 AromaticContact CE1-CD2 3.53Å; F165-F196 HydrophobicContact CE1-CD2 3.53Å; F165-F196 AromaticContact CE1-CE2 3.94Å; F165-F196 HydrophobicContact CE1-CE2 3.94Å; F165-F196 HydrophobicContact CE1-CG 4.42Å; F165-F196 HydrophobicContact CZ-CD2 4.49Å
166	M	96.1	Very high	92.3	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-60.4	-40.7	176.1	178.2	58.5	75.2	0	0	112	V162 V164 L169 R170 L192 F196 L217 Y221	V162-M166 WeakPolarHBondContact O-CB 3.28Å; V162-M166 PolarHBondContact O-N 3.14Å; V164-M166 PolarHBondContact O-N 2.79Å; M166-L169 PolarHBondContact O-N 3.17Å; M166-R170 WeakPolarHBondContact O-CG 3.35Å; M166-R170 PolarHBondContact O-N 3.34Å; M166-R170 HydrophobicContact SD-CG 4.33Å; M166-L192 HydrophobicContact SD-CD1 4.37Å; M166-L192 HydrophobicContact SD-CD2 4.26Å; M166-L192 HydrophobicContact SD-CG 4.35Å; M166-F196 HydrophobicContact CB-CD2 4.49Å; M166-F196 HydrophobicContact CB-CE2 4.15Å; M166-F196 HydrophobicContact CE-CB 4.1Å; M166-F196 HydrophobicContact CE-CD1 3.79Å; M166-F196 HydrophobicContact CE-CD2 3.36Å; M166-F196 HydrophobicContact CE-CE1 3.98Å; M166-F196 HydrophobicContact CE-CE2 3.57Å; M166-F196 HydrophobicContact CE-CG 3.47Å; M166-F196 VanDerWaalsContact CE-CG 3.47Å; M166-F196 HydrophobicContact CE-CZ 3.87Å; M166-F196 HydrophobicContact SD-CD2 4.35Å; M166-L217 HydrophobicContact CE-CD1 3.81Å; M166-Y221 HydrophobicContact CB-CD2 4.08Å; M166-Y221 HydrophobicContact CB-CE2 3.72Å; M166-Y221 HydrophobicContact CE-CD2 3.78Å; M166-Y221 HydrophobicContact CE-CG 4.31Å; M166-Y221 HydrophobicContact CG-CD2 4.02Å; M166-Y221 HydrophobicContact CG-CE2 3.93Å
167	T	93.3	Very high	91	Very high	86 Å²	86	53.8 Å²	53.8	53%	0.528	28%	0.275	S	S	.	.	H	α-helix	trans	-63.1	-45.2	177.6	-59.7	0	0	0	0	111.2	A163 V164 F165 R170 R171	A163-T167 WeakPolarHBondContact O-CB 3.4Å; A163-T167 PolarHBondContact O-N 2.75Å; A163-T167 PolarHBondContact O-OG1 3.48Å; V164-T167 WeakPolarHBondContact O-CB 3.38Å; V164-T167 PolarHBondContact O-N 2.68Å; F165-T167 VanDerWaalsContact C-N 3.31Å; F165-T167 PolarHBondContact O-N 3.09Å; T167-R170 PolarHBondContact O-N 3.37Å; T167-R171 WeakPolarHBondContact O-CB 3.47Å; T167-R171 PolarHBondContact O-N 3.29Å
168	N	93.2	Very high	89.6	Confident	45 Å²	45	49.5 Å²	49.5	24%	0.241	25%	0.254	C	S	.	.	H	α-helix	trans	-64.4	-41.7	177.3	-74.9	-32.8	0	0	0	112.4	R154 E160 V164 F165 R171 L172	R154-N168 PolarHBondContact NH2-ND2 3.44Å; R154-N168 VanDerWaalsContact NH2-ND2 3.19Å; E160-N168 PolarHBondContact OE1-ND2 3.06Å; V164-N168 WeakPolarHBondContact O-CB 3.32Å; V164-N168 PolarHBondContact O-N 3.5Å; V164-N168 PolarHBondContact O-ND2 3.19Å; F165-N168 PolarHBondContact O-N 3.47Å; N168-R171 WeakPolarHBondContact O-CB 3.33Å; N168-R171 PolarHBondContact O-N 2.92Å; N168-L172 WeakPolarHBondContact O-CG 3.47Å; N168-L172 PolarHBondContact O-N 3.33Å
169	L	93.7	Very high	87.8	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62	-45.4	174.2	-81.3	175.3	0	0	0	112.2	F151 R154 F165 M166 R171 L172 A173 L192 L195 F196	F151-L169 HydrophobicContact CD2-CD2 4.21Å; F151-L169 HydrophobicContact CE2-CD2 4.16Å; R154-L169 HydrophobicContact CB-CD2 3.82Å; R154-L169 HydrophobicContact CG-CD2 3.82Å; R154-L169 HydrophobicContact CG-CG 4.36Å; F165-L169 HydrophobicContact CD1-CD1 4.41Å; F165-L169 HydrophobicContact CD2-CD1 4.16Å; F165-L169 HydrophobicContact CD2-CG 4.16Å; F165-L169 HydrophobicContact CE1-CD1 3.84Å; F165-L169 HydrophobicContact CE2-CD1 3.56Å; F165-L169 HydrophobicContact CE2-CD2 4.22Å; F165-L169 HydrophobicContact CE2-CG 3.7Å; F165-L169 HydrophobicContact CZ-CD1 3.38Å; F165-L169 HydrophobicContact CZ-CG 4.05Å; F165-L169 PolarHBondContact O-N 3.31Å; M166-L169 PolarHBondContact O-N 3.17Å; L169-R171 VanDerWaalsContact C-N 3.29Å; L169-R171 PolarHBondContact O-N 3.29Å; L169-L172 PolarHBondContact O-N 2.88Å; L169-A173 WeakPolarHBondContact O-CB 2.83Å; L169-A173 PolarHBondContact O-N 3.27Å; L169-L192 HydrophobicContact CB-CD1 3.59Å; L169-L192 HydrophobicContact CD1-CD1 4.43Å; L169-L195 HydrophobicContact CD2-CB 4.45Å; L169-F196 HydrophobicContact CD1-CB 4.02Å; L169-F196 HydrophobicContact CD1-CD2 4.06Å
170	R	90.4	Very high	85.8	Confident	114 Å²	114	47 Å²	47	43%	0.43	25%	0.245	S	C	.	.	H	α-helix	trans	-60	-41.3	175	-75.3	178.7	-178.3	141.3	3.2	111.7	M166 T167 A173 R174 L192	M166-R170 WeakPolarHBondContact O-CG 3.35Å; M166-R170 PolarHBondContact O-N 3.34Å; M166-R170 HydrophobicContact SD-CG 4.33Å; T167-R170 PolarHBondContact O-N 3.37Å; R170-A173 PolarHBondContact O-N 3.19Å; R170-R174 WeakPolarHBondContact O-CG 3.37Å; R170-R174 PolarHBondContact O-N 3.2Å; R170-L192 HydrophobicContact CG-CD1 4.33Å; R170-L192 HydrophobicContact CG-CD2 3.7Å
171	R	85.7	Confident	83.4	Confident	99 Å²	99	48 Å²	48	37%	0.374	25%	0.254	S	S	.	.	H	α-helix	trans	-58.5	-48.9	175.7	174.8	-179.8	168.6	-175.7	1.9	111.4	D74 T167 N168 L169 R174	D74-R171 VanDerWaalsContact CG-NE 3.29Å; D74-R171 IonicContact OD2-CZ 2.72Å; D74-R171 IonicContact OD2-NE 2.75Å; D74-R171 PolarHBondContact OD2-NE 3.42Å; D74-R171 IonicContact OD2-NH2 3.98Å; D74-R171 PolarHBondContact OD2-NH2 3.33Å; T167-R171 WeakPolarHBondContact O-CB 3.47Å; T167-R171 PolarHBondContact O-N 3.29Å; N168-R171 WeakPolarHBondContact O-CB 3.33Å; N168-R171 PolarHBondContact O-N 2.92Å; L169-R171 VanDerWaalsContact C-N 3.29Å; L169-R171 PolarHBondContact O-N 3.29Å; R171-R174 WeakPolarHBondContact O-CB 3.35Å; R171-R174 PolarHBondContact O-N 3.46Å
172	L	88.2	Confident	81.2	Confident	24 Å²	24	51.6 Å²	51.6	13%	0.126	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-38.8	177.1	-69.3	172.2	0	0	0	112.6	E150 F151 R154 N168 L169 R174 R175 C176	E150-L172 HydrophobicContact CB-CD2 4.07Å; F151-L172 HydrophobicContact CB-CB 4.12Å; F151-L172 HydrophobicContact CD2-CB 3.91Å; F151-L172 HydrophobicContact CG-CB 4.49Å; R154-L172 HydrophobicContact CB-CD1 3.89Å; R154-L172 HydrophobicContact CG-CD1 3.91Å; N168-L172 WeakPolarHBondContact O-CG 3.47Å; N168-L172 PolarHBondContact O-N 3.33Å; L169-L172 PolarHBondContact O-N 2.88Å; L172-R174 VanDerWaalsContact C-N 3.26Å; L172-R174 PolarHBondContact O-N 2.86Å; L172-R175 PolarHBondContact O-N 3.49Å; L172-C176 PolarHBondContact O-N 3.46Å; L172-C176 PolarHBondContact O-SG 3.49Å
173	A	87.1	Confident	79.2	Confident	8 Å²	8	55.6 Å²	55.6	7%	0.066	30%	0.302	C	S	.	.	H	α-helix	trans	-58.7	-36.4	177.8	0	0	0	0	0	112.4	F151 L169 R170 R175 C176 V188	F151-A173 HydrophobicContact CD2-CB 4.23Å; F151-A173 HydrophobicContact CE2-CB 3.69Å; F151-A173 HydrophobicContact CZ-CB 3.99Å; L169-A173 WeakPolarHBondContact O-CB 2.83Å; L169-A173 PolarHBondContact O-N 3.27Å; R170-A173 PolarHBondContact O-N 3.19Å; A173-R175 VanDerWaalsContact C-N 3.27Å; A173-R175 PolarHBondContact O-N 2.99Å; A173-C176 WeakPolarHBondContact O-CB 3.49Å; A173-C176 PolarHBondContact O-N 3.24Å; A173-V188 HydrophobicContact CB-CG1 4.3Å
174	R	80.4	Confident	77.4	Confident	121 Å²	121	55.3 Å²	55.3	46%	0.457	30%	0.296	S	S	.	.	H	α-helix	trans	-55.5	-43.2	174.5	-67.4	-173.2	-67.9	178.8	-2.2	111.4	Y13 E78 R170 R171 L172 C176	Y13-R174 PolarHBondContact OH-O 3.19Å; E78-R174 IonicContact OE1-CZ 3.91Å; E78-R174 IonicContact OE1-NH1 3.03Å; E78-R174 PolarHBondContact OE1-NH1 3.41Å; E78-R174 IonicContact OE1-NH2 2.68Å; E78-R174 PolarHBondContact OE1-NH2 3.3Å; R170-R174 WeakPolarHBondContact O-CG 3.37Å; R170-R174 PolarHBondContact O-N 3.2Å; R171-R174 WeakPolarHBondContact O-CB 3.35Å; R171-R174 PolarHBondContact O-N 3.46Å; L172-R174 VanDerWaalsContact C-N 3.26Å; L172-R174 PolarHBondContact O-N 2.86Å; R174-C176 VanDerWaalsContact C-N 3.26Å; R174-C176 PolarHBondContact O-N 2.9Å
175	R	79.6	Confident	75.7	Confident	30 Å²	30	55.7 Å²	55.7	11%	0.113	31%	0.306	C	S	.	.	H	α-helix	trans	-70.3	-18.8	-177.6	-65.4	179	65.2	-150.3	-2	113.9	Y13 A147 E150 L172 A173 Q177	Y13-R175 WeakPolarHBondContact OH-CA 3.32Å; A147-R175 HydrophobicContact CB-CB 3.63Å; A147-R175 WeakPolarHBondContact CB-O 3.47Å; E150-R175 IonicContact OE1-NH1 2.82Å; E150-R175 IonicContact OE2-CZ 3.51Å; E150-R175 IonicContact OE2-NH1 3.29Å; E150-R175 PolarHBondContact OE2-NH1 2.91Å; L172-R175 PolarHBondContact O-N 3.49Å; A173-R175 VanDerWaalsContact C-N 3.27Å; A173-R175 PolarHBondContact O-N 2.99Å; R175-Q177 VanDerWaalsContact C-N 3.3Å; R175-Q177 PolarHBondContact O-N 3.35Å
176	C	81.9	Confident	74.1	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-7.2	-173.3	-66.5	0	0	0	0	115.4	I144 A147 R148 F151 L172 A173 R174 Y178	I144-C176 WeakPolarHBondContact CG2-O 3.44Å; A147-C176 PolarHBondContact O-SG 3.06Å; R148-C176 HydrophobicContact CG-CB 3.83Å; R148-C176 PolarHBondContact NE-O 3.19Å; R148-C176 PolarHBondContact NH2-O 3.41Å; F151-C176 WeakPolarHBondContact CB-SG 3.49Å; L172-C176 PolarHBondContact O-N 3.46Å; L172-C176 PolarHBondContact O-SG 3.49Å; A173-C176 WeakPolarHBondContact O-CB 3.49Å; A173-C176 PolarHBondContact O-N 3.24Å; R174-C176 VanDerWaalsContact C-N 3.26Å; R174-C176 PolarHBondContact O-N 2.9Å; C176-Y178 VanDerWaalsContact C-N 3.29Å; C176-Y178 HydrophobicContact CB-CD2 3.54Å; C176-Y178 HydrophobicContact CB-CE1 4.26Å; C176-Y178 HydrophobicContact CB-CE2 3.11Å; C176-Y178 HydrophobicContact CB-CG 4.3Å; C176-Y178 PolarHBondContact O-N 3.1Å
177	Q	70	Confident	72.7	Confident	32 Å²	32	67.7 Å²	67.7	15%	0.15	36%	0.358	C	S	.	.			trans	50.5	44.4	177.3	-67.3	-177.4	44	0	0	114.2	Y13 Y17 I144 R175 E179	Y13-Q177 HydrophobicContact CD1-CG 4.07Å; Y13-Q177 HydrophobicContact CE1-CG 3.33Å; Y17-Q177 VanDerWaalsContact CD1-NE2 3.26Å; Y17-Q177 PolarHBondContact OH-NE2 3.38Å; I144-Q177 HydrophobicContact CD1-CB 4.11Å; I144-Q177 HydrophobicContact CD1-CG 4.46Å; I144-Q177 HydrophobicContact CG1-CB 4.17Å; I144-Q177 HydrophobicContact CG1-CG 4.25Å; I144-Q177 HydrophobicContact CG2-CB 4.5Å; R175-Q177 VanDerWaalsContact C-N 3.3Å; R175-Q177 PolarHBondContact O-N 3.35Å; Q177-E179 PolarHBondContact O-N 3.43Å; Q177-E179 VanDerWaalsContact O-N 3.14Å
178	Y	67.7	Low	71.9	Confident	27 Å²	27	65.2 Å²	65.2	11%	0.106	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-64.6	-13.8	172.5	-63.2	-62.2	0	0	0	112.4	F151 Y152 C176 A180 V184 V188	F151-Y178 HydrophobicContact CD1-CE2 4.19Å; F151-Y178 VanDerWaalsContact CD1-OH 3.24Å; F151-Y178 WeakPolarHBondContact CD1-OH 3.46Å; F151-Y178 AromaticContact CE1-CE2 3.89Å; F151-Y178 HydrophobicContact CE1-CE2 3.89Å; F151-Y178 WeakPolarHBondContact CE1-OH 3.42Å; Y152-Y178 WeakPolarHBondContact CE2-OH 3.24Å; Y152-Y178 PolarHBondContact OH-OH 2.83Å; C176-Y178 VanDerWaalsContact C-N 3.29Å; C176-Y178 HydrophobicContact CB-CD2 3.54Å; C176-Y178 HydrophobicContact CB-CE1 4.26Å; C176-Y178 HydrophobicContact CB-CE2 3.11Å; C176-Y178 HydrophobicContact CB-CG 4.3Å; C176-Y178 PolarHBondContact O-N 3.1Å; Y178-A180 PolarHBondContact O-N 3.27Å; Y178-V184 WeakPolarHBondContact O-CG1 3.09Å; Y178-V188 HydrophobicContact CD2-CG2 3.9Å; Y178-V188 HydrophobicContact CG-CG2 4.05Å
179	E	56.4	Low	71.2	Confident	119 Å²	119	67.1 Å²	67.1	56%	0.556	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-59.9	-7.9	178.7	-68	-168.8	-179.6	0	0	116.4	Q177 S181 V184	Q177-E179 PolarHBondContact O-N 3.43Å; Q177-E179 VanDerWaalsContact O-N 3.14Å; E179-S181 PolarHBondContact O-N 3.2Å; E179-V184 VanDerWaalsContact CA-CG2 3.5Å; E179-V184 HydrophobicContact CB-CG1 4.38Å; E179-V184 HydrophobicContact CB-CG2 4.48Å; E179-V184 HydrophobicContact CG-CG1 4Å
180	A	52.6	Low	70.7	Confident	95 Å²	95	69.5 Å²	69.5	79%	0.785	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-75.5	4.7	177.9	0	0	0	0	0	114.9	Y178	Y178-A180 PolarHBondContact O-N 3.27Å
181	S	47.4	Very low	70.6	Confident	40 Å²	40	66.4 Å²	66.4	28%	0.28	36%	0.363	S	S	.	.	S	Bend	trans	-137.4	118.2	-171.7	-160.2	0	0	0	0	113	E179 T183 V184 R187	E179-S181 PolarHBondContact O-N 3.2Å; S181-T183 CarbonylContact O-C 3.58Å; S181-T183 PolarHBondContact O-N 3.45Å; S181-V184 WeakPolarHBondContact O-CG2 3.38Å; S181-V184 PolarHBondContact O-N 2.9Å; S181-V184 VanDerWaalsContact O-N 3.09Å; S181-R187 VanDerWaalsContact CB-CZ 3.47Å; S181-R187 VanDerWaalsContact CB-NH1 3.34Å; S181-R187 PolarHBondContact O-NH2 3.1Å; S181-R187 PolarHBondContact OG-NH1 3.03Å; S181-R187 PolarHBondContact OG-NH2 3.02Å
182	P	51.9	Low	70.9	Confident	137 Å²	137	61.9 Å²	61.9	89%	0.89	35%	0.346	S	S	*	.	S	Bend	trans	-57.3	6.2	-159.9	16.3	-30	0	0	0	119.7
183	T	55.6	Low	71.2	Confident	89 Å²	89	62.1 Å²	62.1	55%	0.546	35%	0.347	S	S	.	.	S	Bend	trans	-122.4	40	171.6	42.5	0	0	0	0	111.3	S181 R187	S181-T183 CarbonylContact O-C 3.58Å; S181-T183 PolarHBondContact O-N 3.45Å; T183-R187 PolarHBondContact OG1-NH2 2.7Å
184	V	60	Low	71.5	Confident	29 Å²	29	66 Å²	66	18%	0.176	37%	0.366	C	S	.	.	H	α-helix	trans	-64	-47.7	-162.4	-174.7	0	0	0	0	113.9	Y178 E179 S181 E186 R187 V188	Y178-V184 WeakPolarHBondContact O-CG1 3.09Å; E179-V184 VanDerWaalsContact CA-CG2 3.5Å; E179-V184 HydrophobicContact CB-CG1 4.38Å; E179-V184 HydrophobicContact CB-CG2 4.48Å; E179-V184 HydrophobicContact CG-CG1 4Å; S181-V184 WeakPolarHBondContact O-CG2 3.38Å; S181-V184 PolarHBondContact O-N 2.9Å; S181-V184 VanDerWaalsContact O-N 3.09Å; V184-E186 VanDerWaalsContact C-N 3.32Å; V184-E186 PolarHBondContact O-N 3.33Å; V184-R187 PolarHBondContact O-N 3.27Å; V184-R187 VanDerWaalsContact O-N 3.07Å; V184-V188 HydrophobicContact CG1-CG2 3.87Å; V184-V188 PolarHBondContact O-N 2.68Å
185	A	60.9	Low	72.1	Confident	73 Å²	73	60.8 Å²	60.8	60%	0.603	35%	0.347	S	S	*	.	H	α-helix	trans	-60.3	-44.2	-164.8	0	0	0	0	0	111.6	R187 V188 D189	A185-R187 VanDerWaalsContact C-N 3.34Å; A185-R187 PolarHBondContact O-N 3Å; A185-V188 PolarHBondContact O-N 3.04Å; A185-D189 PolarHBondContact O-N 3.23Å; A185-D189 VanDerWaalsContact O-N 3.14Å
186	E	63.3	Low	73	Confident	155 Å²	155	59.3 Å²	59.3	72%	0.724	34%	0.342	S	S	*	.	H	α-helix	trans	-68	-32.1	179	-63.7	179.4	168.9	0	0	112.9	V184 A190	V184-E186 VanDerWaalsContact C-N 3.32Å; V184-E186 PolarHBondContact O-N 3.33Å; E186-A190 VanDerWaalsContact O-CB 3.32Å; E186-A190 WeakPolarHBondContact O-CB 3.36Å; E186-A190 PolarHBondContact O-N 2.88Å
187	R	67.9	Low	73.7	Confident	99 Å²	99	60.2 Å²	60.2	37%	0.374	35%	0.346	S	S	.	.	H	α-helix	trans	-72	-39.7	177.9	-91.1	-173.6	-76.6	-178.8	-10	112.6	S181 T183 V184 A185 D189 A190 Q191	S181-R187 VanDerWaalsContact CB-CZ 3.47Å; S181-R187 VanDerWaalsContact CB-NH1 3.34Å; S181-R187 PolarHBondContact O-NH2 3.1Å; S181-R187 PolarHBondContact OG-NH1 3.03Å; S181-R187 PolarHBondContact OG-NH2 3.02Å; T183-R187 PolarHBondContact OG1-NH2 2.7Å; V184-R187 PolarHBondContact O-N 3.27Å; V184-R187 VanDerWaalsContact O-N 3.07Å; A185-R187 VanDerWaalsContact C-N 3.34Å; A185-R187 PolarHBondContact O-N 3Å; R187-D189 VanDerWaalsContact C-N 3.34Å; R187-A190 PolarHBondContact O-N 3.19Å; R187-Q191 WeakPolarHBondContact O-CB 3.13Å; R187-Q191 VanDerWaalsContact O-CG 3.3Å; R187-Q191 WeakPolarHBondContact O-CG 3.37Å; R187-Q191 PolarHBondContact O-N 3.23Å
188	V	75.1	Confident	74.9	Confident	33 Å²	33	63.1 Å²	63.1	20%	0.2	36%	0.362	C	S	.	.	H	α-helix	trans	-63.5	-45.7	175	177.5	0	0	0	0	109.7	A173 Y178 V184 A185 A190 Q191 L192	A173-V188 HydrophobicContact CB-CG1 4.3Å; Y178-V188 HydrophobicContact CD2-CG2 3.9Å; Y178-V188 HydrophobicContact CG-CG2 4.05Å; V184-V188 HydrophobicContact CG1-CG2 3.87Å; V184-V188 PolarHBondContact O-N 2.68Å; A185-V188 PolarHBondContact O-N 3.04Å; V188-A190 PolarHBondContact O-N 3.02Å; V188-Q191 PolarHBondContact O-N 3.12Å; V188-L192 WeakPolarHBondContact O-CB 3.39Å; V188-L192 PolarHBondContact O-N 2.68Å
189	D	80	Confident	76.3	Confident	86 Å²	86	62 Å²	62	46%	0.46	36%	0.358	S	S	.	.	H	α-helix	trans	-64.5	-39.8	179.2	-77.9	-11.9	0	0	0	112.4	A185 R187 Q193	A185-D189 PolarHBondContact O-N 3.23Å; A185-D189 VanDerWaalsContact O-N 3.14Å; R187-D189 VanDerWaalsContact C-N 3.34Å; D189-Q193 VanDerWaalsContact O-CB 3.23Å; D189-Q193 WeakPolarHBondContact O-CB 3.46Å; D189-Q193 PolarHBondContact O-N 2.92Å
190	A	82.9	Confident	78.2	Confident	49 Å²	49	56.5 Å²	56.5	41%	0.405	33%	0.332	S	S	.	.	H	α-helix	trans	-64.4	-48.1	175.6	0	0	0	0	0	112.2	E186 R187 V188 L192 Q193 D194	E186-A190 VanDerWaalsContact O-CB 3.32Å; E186-A190 WeakPolarHBondContact O-CB 3.36Å; E186-A190 PolarHBondContact O-N 2.88Å; R187-A190 PolarHBondContact O-N 3.19Å; V188-A190 PolarHBondContact O-N 3.02Å; A190-L192 PolarHBondContact O-N 3.14Å; A190-Q193 WeakPolarHBondContact O-CB 3.44Å; A190-Q193 PolarHBondContact O-N 3.23Å; A190-D194 VanDerWaalsContact O-CG 3.31Å; A190-D194 PolarHBondContact O-N 3.46Å
191	Q	88.3	Confident	80.3	Confident	49 Å²	49	54.7 Å²	54.7	23%	0.229	31%	0.313	C	S	.	.	H	α-helix	trans	-65.8	-39.2	178	-71.6	176	-22.9	0	0	112.2	F151 Y152 R187 V188 Q193 D194 L195	F151-Q191 HydrophobicContact CE1-CB 4.32Å; Y152-Q191 PolarHBondContact OH-NE2 2.98Å; R187-Q191 WeakPolarHBondContact O-CB 3.13Å; R187-Q191 VanDerWaalsContact O-CG 3.3Å; R187-Q191 WeakPolarHBondContact O-CG 3.37Å; R187-Q191 PolarHBondContact O-N 3.23Å; V188-Q191 PolarHBondContact O-N 3.12Å; Q191-Q193 VanDerWaalsContact C-N 3.34Å; Q191-D194 PolarHBondContact O-N 3.13Å; Q191-L195 WeakPolarHBondContact O-CB 3.4Å; Q191-L195 WeakPolarHBondContact O-CG 3.4Å; Q191-L195 PolarHBondContact O-N 3.34Å
192	L	92.1	Very high	82.7	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-62.7	-42.5	174.6	-179.9	64.4	0	0	0	110.7	F151 M166 L169 R170 V188 A190 F196 L217	F151-L192 HydrophobicContact CE2-CD1 4.19Å; M166-L192 HydrophobicContact SD-CD1 4.37Å; M166-L192 HydrophobicContact SD-CD2 4.26Å; M166-L192 HydrophobicContact SD-CG 4.35Å; L169-L192 HydrophobicContact CB-CD1 3.59Å; L169-L192 HydrophobicContact CD1-CD1 4.43Å; R170-L192 HydrophobicContact CG-CD1 4.33Å; R170-L192 HydrophobicContact CG-CD2 3.7Å; V188-L192 WeakPolarHBondContact O-CB 3.39Å; V188-L192 PolarHBondContact O-N 2.68Å; A190-L192 PolarHBondContact O-N 3.14Å; L192-F196 WeakPolarHBondContact O-CB 3.2Å; L192-F196 PolarHBondContact O-N 3.3Å; L192-L217 HydrophobicContact CD2-CD2 3.75Å; L192-L217 HydrophobicContact CG-CD2 4.2Å
193	Q	93.6	Very high	84.8	Confident	30 Å²	30	50.2 Å²	50.2	14%	0.14	28%	0.284	C	S	.	.	H	α-helix	trans	-62.1	-48.8	175.3	-179.9	171.3	-38.4	0	0	111.8	D189 A190 Q191 L195 F196 I197 L215 L217 V220	D189-Q193 VanDerWaalsContact O-CB 3.23Å; D189-Q193 WeakPolarHBondContact O-CB 3.46Å; D189-Q193 PolarHBondContact O-N 2.92Å; A190-Q193 WeakPolarHBondContact O-CB 3.44Å; A190-Q193 PolarHBondContact O-N 3.23Å; Q191-Q193 VanDerWaalsContact C-N 3.34Å; Q193-L195 PolarHBondContact O-N 3.48Å; Q193-F196 PolarHBondContact O-N 2.78Å; Q193-I197 HydrophobicContact CG-CD1 3.94Å; Q193-I197 VanDerWaalsContact O-CG1 3.32Å; Q193-I197 WeakPolarHBondContact O-CG1 3.35Å; Q193-I197 PolarHBondContact O-N 2.9Å; Q193-L215 PolarHBondContact NE2-O 3.06Å; Q193-L215 PolarHBondContact OE1-O 3.45Å; Q193-L217 HydrophobicContact CB-CB 4.41Å; Q193-L217 HydrophobicContact CB-CD1 3.91Å; Q193-L217 HydrophobicContact CG-CD1 4.32Å; Q193-V220 HydrophobicContact CG-CG2 4.37Å
194	D	93.4	Very high	86.6	Confident	90 Å²	90	50.7 Å²	50.7	48%	0.481	28%	0.281	S	S	.	.	H	α-helix	trans	-59.9	-49	179.7	-69.9	-17.1	0	0	0	110.8	A190 Q191 F196 I197 I198	A190-D194 VanDerWaalsContact O-CG 3.31Å; A190-D194 PolarHBondContact O-N 3.46Å; Q191-D194 PolarHBondContact O-N 3.13Å; D194-F196 PolarHBondContact O-N 3.47Å; D194-I197 PolarHBondContact O-N 3.04Å; D194-I198 WeakPolarHBondContact O-CB 3.34Å; D194-I198 WeakPolarHBondContact O-CD1 3.49Å; D194-I198 WeakPolarHBondContact O-CG1 3.31Å; D194-I198 PolarHBondContact O-N 2.97Å
195	L	94.4	Very high	88.4	Confident	10 Å²	10	50.1 Å²	50.1	5%	0.052	28%	0.277	C	S	.	.	H	α-helix	trans	-67.8	-35.7	178.8	-75.4	-176.5	0	0	0	113.4	F151 Y152 L169 Q191 Q193 G199	F151-L195 HydrophobicContact CD1-CD1 3.38Å; F151-L195 HydrophobicContact CD2-CD1 3.98Å; F151-L195 HydrophobicContact CE1-CD1 3.24Å; F151-L195 HydrophobicContact CE1-CG 4.45Å; F151-L195 HydrophobicContact CE2-CD1 3.83Å; F151-L195 HydrophobicContact CG-CD1 3.78Å; F151-L195 HydrophobicContact CZ-CD1 3.49Å; F151-L195 VanDerWaalsContact CZ-CD1 3.49Å; Y152-L195 HydrophobicContact CD1-CD1 3.82Å; Y152-L195 HydrophobicContact CD1-CD2 3.86Å; Y152-L195 HydrophobicContact CD1-CG 4.2Å; Y152-L195 HydrophobicContact CE1-CD1 4.14Å; Y152-L195 HydrophobicContact CE1-CG 4.48Å; Y152-L195 HydrophobicContact CG-CD1 4.33Å; L169-L195 HydrophobicContact CD2-CB 4.45Å; Q191-L195 WeakPolarHBondContact O-CB 3.4Å; Q191-L195 WeakPolarHBondContact O-CG 3.4Å; Q191-L195 PolarHBondContact O-N 3.34Å; Q193-L195 PolarHBondContact O-N 3.48Å; L195-G199 WeakPolarHBondContact O-CA 3.42Å; L195-G199 PolarHBondContact O-N 3.19Å
196	F	97	Very high	90.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-58.2	-53.8	172.6	-179.4	-110.5	0	0	0	109.8	V162 F165 M166 L169 L192 Q193 D194 G199 M200 V220 Y221 A224	V162-F196 HydrophobicContact CG1-CE2 4.11Å; V162-F196 HydrophobicContact CG1-CZ 3.74Å; F165-F196 AromaticContact CD1-CD2 3.69Å; F165-F196 HydrophobicContact CD1-CD2 3.69Å; F165-F196 AromaticContact CD1-CE2 3.66Å; F165-F196 HydrophobicContact CD1-CE2 3.66Å; F165-F196 AromaticContact CE1-CD2 3.53Å; F165-F196 HydrophobicContact CE1-CD2 3.53Å; F165-F196 AromaticContact CE1-CE2 3.94Å; F165-F196 HydrophobicContact CE1-CE2 3.94Å; F165-F196 HydrophobicContact CE1-CG 4.42Å; F165-F196 HydrophobicContact CZ-CD2 4.49Å; M166-F196 HydrophobicContact CB-CD2 4.49Å; M166-F196 HydrophobicContact CB-CE2 4.15Å; M166-F196 HydrophobicContact CE-CB 4.1Å; M166-F196 HydrophobicContact CE-CD1 3.79Å; M166-F196 HydrophobicContact CE-CD2 3.36Å; M166-F196 HydrophobicContact CE-CE1 3.98Å; M166-F196 HydrophobicContact CE-CE2 3.57Å; M166-F196 HydrophobicContact CE-CG 3.47Å; M166-F196 VanDerWaalsContact CE-CG 3.47Å; M166-F196 HydrophobicContact CE-CZ 3.87Å; M166-F196 HydrophobicContact SD-CD2 4.35Å; L169-F196 HydrophobicContact CD1-CB 4.02Å; L169-F196 HydrophobicContact CD1-CD2 4.06Å; L192-F196 WeakPolarHBondContact O-CB 3.2Å; L192-F196 PolarHBondContact O-N 3.3Å; Q193-F196 PolarHBondContact O-N 2.78Å; D194-F196 PolarHBondContact O-N 3.47Å; F196-G199 PolarHBondContact O-N 3.28Å; F196-M200 HydrophobicContact CE1-SD 4.35Å; F196-M200 WeakPolarHBondContact O-CG 3.32Å; F196-M200 PolarHBondContact O-N 3.47Å; F196-V220 HydrophobicContact CD1-CG1 3.87Å; F196-V220 HydrophobicContact CE1-CG1 4.03Å; F196-Y221 HydrophobicContact CE2-CD2 4.4Å; F196-Y221 AromaticContact CZ-CD2 3.91Å; F196-Y221 HydrophobicContact CZ-CD2 3.91Å; F196-A224 HydrophobicContact CE1-CB 3.74Å; F196-A224 HydrophobicContact CZ-CB 3.57Å
197	I	96.8	Very high	91.7	Very high	18 Å²	18	48 Å²	48	9%	0.092	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-50.7	-179.8	-64.6	166.8	0	0	0	111.4	Q193 D194 G199 M200 R206 I209 L210 V220	Q193-I197 HydrophobicContact CG-CD1 3.94Å; Q193-I197 VanDerWaalsContact O-CG1 3.32Å; Q193-I197 WeakPolarHBondContact O-CG1 3.35Å; Q193-I197 PolarHBondContact O-N 2.9Å; D194-I197 PolarHBondContact O-N 3.04Å; I197-G199 PolarHBondContact O-N 3.4Å; I197-M200 PolarHBondContact O-N 3.39Å; I197-R206 HydrophobicContact CG2-CG 4.25Å; I197-R206 WeakPolarHBondContact O-CD 3.28Å; I197-R206 WeakPolarHBondContact O-CG 3.41Å; I197-I209 HydrophobicContact CD1-CG2 4.01Å; I197-I209 HydrophobicContact CG1-CG2 4.2Å; I197-L210 HydrophobicContact CG2-CD2 3.76Å; I197-L210 HydrophobicContact CG2-CG 4.09Å; I197-V220 HydrophobicContact CD1-CG1 4.04Å; I197-V220 HydrophobicContact CG1-CG1 3.7Å
198	I	95.9	Very high	93	Very high	94 Å²	94	51.9 Å²	51.9	48%	0.482	26%	0.261	S	S	.	.	H	α-helix	trans	-63.9	-35.2	-178.4	-60.5	165.1	0	0	0	110.1	K155 D194 R206	K155-I198 VanDerWaalsContact NZ-CG2 3.27Å; D194-I198 WeakPolarHBondContact O-CB 3.34Å; D194-I198 WeakPolarHBondContact O-CD1 3.49Å; D194-I198 WeakPolarHBondContact O-CG1 3.31Å; D194-I198 PolarHBondContact O-N 2.97Å; I198-R206 PolarHBondContact O-NH1 3.36Å
199	G	96.9	Very high	94	Very high	2 Å²	2	51 Å²	51	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-83.5	-10.3	-176.7	0	0	0	0	0	116.3	Q156 L195 F196 I197	Q156-G199 VanDerWaalsContact CB-O 3.25Å; Q156-G199 WeakPolarHBondContact CB-O 3.49Å; Q156-G199 PolarHBondContact N-O 3.48Å; L195-G199 WeakPolarHBondContact O-CA 3.42Å; L195-G199 PolarHBondContact O-N 3.19Å; F196-G199 PolarHBondContact O-N 3.28Å; I197-G199 PolarHBondContact O-N 3.4Å
200	M	97.2	Very high	94.7	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.02	26%	0.263	C	S	.	.			trans	-56.7	135.8	179.2	-64.2	-178.1	63.7	0	0	112.2	F196 I197 T205 R206 I209 A224	F196-M200 HydrophobicContact CE1-SD 4.35Å; F196-M200 WeakPolarHBondContact O-CG 3.32Å; F196-M200 PolarHBondContact O-N 3.47Å; I197-M200 PolarHBondContact O-N 3.39Å; M200-T205 HydrophobicContact CE-CG2 3.76Å; M200-R206 HydrophobicContact CB-CB 4.28Å; M200-R206 PolarHBondContact O-NH1 3.46Å; M200-R206 HydrophobicContact SD-CB 4.44Å; M200-I209 HydrophobicContact CE-CD1 4.17Å; M200-I209 HydrophobicContact SD-CD1 3.81Å; M200-A224 HydrophobicContact CE-CB 3.54Å; M200-A224 HydrophobicContact SD-CB 4.34Å
201	C	96.9	Very high	95.4	Very high	57 Å²	57	59.7 Å²	59.7	39%	0.385	28%	0.28	S	S	.	.	S	Bend	trans	-78.1	-35.8	176.1	68	0	0	0	0	112	Q156 A203	Q156-C201 HydrophobicContact CB-CB 4.07Å; Q156-C201 HydrophobicContact CG-CB 4.02Å; Q156-C201 PolarHBondContact OE1-SG 3.17Å; Q156-C201 VanDerWaalsContact OE1-SG 3.37Å; C201-A203 PolarHBondContact O-N 2.94Å
202	D	96.1	Very high	95.5	Very high	45 Å²	45	59.6 Å²	59.6	24%	0.241	29%	0.292	C	S	.	.			trans	-72.6	102.1	177	178.1	13	0	0	0	111.4	E204 T205 R206	D202-E204 VanDerWaalsContact C-N 3.3Å; D202-E204 PolarHBondContact O-N 3.19Å; D202-E204 PolarHBondContact OD1-N 2.81Å; D202-T205 PolarHBondContact OD1-N 3.15Å; D202-T205 WeakPolarHBondContact OD2-CB 3.29Å; D202-T205 PolarHBondContact OD2-N 3.45Å; D202-T205 PolarHBondContact OD2-OG1 3.4Å; D202-R206 VanDerWaalsContact O-CB 3.27Å; D202-R206 WeakPolarHBondContact O-CB 3.28Å; D202-R206 PolarHBondContact O-N 2.97Å
203	A	95.7	Very high	95.4	Very high	39 Å²	39	66.8 Å²	66.8	32%	0.322	33%	0.329	S	S	.	.	H	α-helix	trans	-66.4	-27.6	-179.9	0	0	0	0	0	113.5	C201 R207	C201-A203 PolarHBondContact O-N 2.94Å; A203-R207 VanDerWaalsContact O-CB 3.29Å; A203-R207 WeakPolarHBondContact O-CB 3.25Å; A203-R207 WeakPolarHBondContact O-CG 3.25Å; A203-R207 PolarHBondContact O-N 2.99Å; A203-R207 PolarHBondContact O-NE 3.3Å
204	E	95.3	Very high	95.4	Very high	99 Å²	99	75 Å²	75	46%	0.463	37%	0.365	S	S	.	.	H	α-helix	trans	-74.2	-51.2	-180	-174.4	58.7	-137.9	0	0	110.5	D202 R206 R207 R208	D202-E204 VanDerWaalsContact C-N 3.3Å; D202-E204 PolarHBondContact O-N 3.19Å; D202-E204 PolarHBondContact OD1-N 2.81Å; E204-R206 VanDerWaalsContact C-N 3.33Å; E204-R206 PolarHBondContact O-N 3.49Å; E204-R207 PolarHBondContact O-N 2.91Å; E204-R207 VanDerWaalsContact O-N 3.17Å; E204-R207 IonicContact OE1-NH1 2.64Å; E204-R207 IonicContact OE2-CZ 3.84Å; E204-R207 IonicContact OE2-NH1 2.81Å; E204-R207 PolarHBondContact OE2-NH1 3.37Å; E204-R207 IonicContact OE2-NH2 3.14Å; E204-R207 PolarHBondContact OE2-NH2 2.81Å; E204-R208 PolarHBondContact O-N 3.05Å
205	T	96.3	Very high	95.3	Very high	17 Å²	17	72.7 Å²	72.7	10%	0.104	35%	0.352	C	S	.	.	H	α-helix	trans	-62.4	-41.5	176.8	-61.3	0	0	0	0	111.5	M200 D202 R207 R208 I209 G227	M200-T205 HydrophobicContact CE-CG2 3.76Å; D202-T205 PolarHBondContact OD1-N 3.15Å; D202-T205 WeakPolarHBondContact OD2-CB 3.29Å; D202-T205 PolarHBondContact OD2-N 3.45Å; D202-T205 PolarHBondContact OD2-OG1 3.4Å; T205-R207 PolarHBondContact O-N 3.16Å; T205-R208 PolarHBondContact O-N 3.3Å; T205-I209 HydrophobicContact CG2-CD1 3.87Å; T205-I209 HydrophobicContact CG2-CG1 4.44Å; T205-I209 WeakPolarHBondContact O-CG1 3.03Å; T205-I209 PolarHBondContact O-N 2.72Å; T205-G227 VanDerWaalsContact OG1-CA 3.26Å; T205-G227 WeakPolarHBondContact OG1-CA 3.15Å
206	R	96.9	Very high	95.2	Very high	76 Å²	76	75.4 Å²	75.4	29%	0.287	37%	0.371	S	S	.	.	H	α-helix	trans	-57.8	-46.8	173.4	-177.4	172.4	62.9	-161.8	-9.8	111.9	I197 I198 M200 D202 E204 R208 I209 L210	I197-R206 HydrophobicContact CG2-CG 4.25Å; I197-R206 WeakPolarHBondContact O-CD 3.28Å; I197-R206 WeakPolarHBondContact O-CG 3.41Å; I198-R206 PolarHBondContact O-NH1 3.36Å; M200-R206 HydrophobicContact CB-CB 4.28Å; M200-R206 PolarHBondContact O-NH1 3.46Å; M200-R206 HydrophobicContact SD-CB 4.44Å; D202-R206 VanDerWaalsContact O-CB 3.27Å; D202-R206 WeakPolarHBondContact O-CB 3.28Å; D202-R206 PolarHBondContact O-N 2.97Å; E204-R206 VanDerWaalsContact C-N 3.33Å; E204-R206 PolarHBondContact O-N 3.49Å; R206-R208 VanDerWaalsContact C-N 3.32Å; R206-R208 PolarHBondContact O-N 3.5Å; R206-I209 PolarHBondContact O-N 3.13Å; R206-L210 HydrophobicContact CG-CD1 3.94Å; R206-L210 HydrophobicContact CG-CG 4.45Å; R206-L210 WeakPolarHBondContact O-CB 3.43Å; R206-L210 VanDerWaalsContact O-CG 3.28Å; R206-L210 WeakPolarHBondContact O-CG 3.25Å; R206-L210 PolarHBondContact O-N 2.8Å
207	R	96.8	Very high	94.9	Very high	108 Å²	108	76.5 Å²	76.5	41%	0.408	38%	0.376	S	S	.	.	H	α-helix	trans	-61.5	-39.1	177	-82.3	-179.8	-77.5	125.3	-2.2	112	A203 E204 T205 R211	A203-R207 VanDerWaalsContact O-CB 3.29Å; A203-R207 WeakPolarHBondContact O-CB 3.25Å; A203-R207 WeakPolarHBondContact O-CG 3.25Å; A203-R207 PolarHBondContact O-N 2.99Å; A203-R207 PolarHBondContact O-NE 3.3Å; E204-R207 PolarHBondContact O-N 2.91Å; E204-R207 VanDerWaalsContact O-N 3.17Å; E204-R207 IonicContact OE1-NH1 2.64Å; E204-R207 IonicContact OE2-CZ 3.84Å; E204-R207 IonicContact OE2-NH1 2.81Å; E204-R207 PolarHBondContact OE2-NH1 3.37Å; E204-R207 IonicContact OE2-NH2 3.14Å; E204-R207 PolarHBondContact OE2-NH2 2.81Å; T205-R207 PolarHBondContact O-N 3.16Å; R207-R211 WeakPolarHBondContact O-CG 3.39Å; R207-R211 PolarHBondContact O-N 2.96Å
208	R	95.6	Very high	94.8	Very high	179 Å²	179	84 Å²	84	68%	0.675	41%	0.408	S	S	*	.	H	α-helix	trans	-64.9	-44.4	176.8	-175.1	175.8	178.8	169.4	-0.6	112.1	E204 T205 R206 R211 G212	E204-R208 PolarHBondContact O-N 3.05Å; T205-R208 PolarHBondContact O-N 3.3Å; R206-R208 VanDerWaalsContact C-N 3.32Å; R206-R208 PolarHBondContact O-N 3.5Å; R208-R211 PolarHBondContact O-N 2.7Å; R208-G212 PolarHBondContact O-N 3.43Å
209	I	96.2	Very high	94.8	Very high	16 Å²	16	84 Å²	84	8%	0.082	41%	0.406	C	S	.	.	H	α-helix	trans	-62	-47.1	176.7	-67.8	163.1	0	0	0	110.3	I197 M200 T205 R206 R211 G212 V220 L223	I197-I209 HydrophobicContact CD1-CG2 4.01Å; I197-I209 HydrophobicContact CG1-CG2 4.2Å; M200-I209 HydrophobicContact CE-CD1 4.17Å; M200-I209 HydrophobicContact SD-CD1 3.81Å; T205-I209 HydrophobicContact CG2-CD1 3.87Å; T205-I209 HydrophobicContact CG2-CG1 4.44Å; T205-I209 WeakPolarHBondContact O-CG1 3.03Å; T205-I209 PolarHBondContact O-N 2.72Å; R206-I209 PolarHBondContact O-N 3.13Å; I209-R211 VanDerWaalsContact C-N 3.26Å; I209-R211 PolarHBondContact O-N 2.81Å; I209-G212 PolarHBondContact O-N 2.8Å; I209-V220 HydrophobicContact CD1-CG1 4.18Å; I209-V220 HydrophobicContact CG2-CG1 4.31Å; I209-L223 HydrophobicContact CD1-CB 4.31Å; I209-L223 HydrophobicContact CG1-CB 4.33Å; I209-L223 HydrophobicContact CG1-CD1 4.13Å
210	L	95.5	Very high	94.7	Very high	119 Å²	119	83.9 Å²	83.9	62%	0.623	41%	0.405	S	S	*	.	H	α-helix	trans	-64.5	-25.1	-178.4	-71.7	172.3	0	0	0	114.3	I197 R206	I197-L210 HydrophobicContact CG2-CD2 3.76Å; I197-L210 HydrophobicContact CG2-CG 4.09Å; R206-L210 HydrophobicContact CG-CD1 3.94Å; R206-L210 HydrophobicContact CG-CG 4.45Å; R206-L210 WeakPolarHBondContact O-CB 3.43Å; R206-L210 VanDerWaalsContact O-CG 3.28Å; R206-L210 WeakPolarHBondContact O-CG 3.25Å; R206-L210 PolarHBondContact O-N 2.8Å
211	R	95.6	Very high	94.7	Very high	197 Å²	197	86.2 Å²	86.2	74%	0.743	41%	0.414	S	S	*	.	H	α-helix	trans	-85.1	-15.6	174.9	-71.6	176.6	-175.3	166.2	1.2	113.5	R207 R208 I209	R207-R211 WeakPolarHBondContact O-CG 3.39Å; R207-R211 PolarHBondContact O-N 2.96Å; R208-R211 PolarHBondContact O-N 2.7Å; I209-R211 VanDerWaalsContact C-N 3.26Å; I209-R211 PolarHBondContact O-N 2.81Å
212	G	91.7	Very high	94.7	Very high	47 Å²	47	86.3 Å²	86.3	49%	0.485	42%	0.416	S	S	.	.	S	Bend	trans	-79.2	-175.7	-174.4	0	0	0	0	0	113.8	R208 I209	R208-G212 PolarHBondContact O-N 3.43Å; I209-G212 PolarHBondContact O-N 2.8Å
213	L	90.6	Very high	94.8	Very high	155 Å²	155	86.6 Å²	86.6	81%	0.812	42%	0.417	S	S	*	.			trans	-71.8	165.9	168.8	-62.5	173.4	0	0	0	110.5	L215	L213-L215 WeakPolarHBondContact O-CG 3.02Å; L213-L215 PolarHBondContact O-N 3.29Å
214	K	91.9	Very high	94.8	Very high	202 Å²	202	84.8 Å²	84.8	88%	0.878	40%	0.402	S	S	*	.			trans	-62.8	120.9	170.1	-176.6	179	-179.3	-179.9	0	109.4
215	L	92.2	Very high	95	Very high	43 Å²	43	82.8 Å²	82.8	23%	0.225	39%	0.394	C	S	.	.			trans	-112.6	150.1	177.2	-56.8	177.3	0	0	0	110.3	Q193 L213 E219 V220 L223	Q193-L215 PolarHBondContact NE2-O 3.06Å; Q193-L215 PolarHBondContact OE1-O 3.45Å; L213-L215 WeakPolarHBondContact O-CG 3.02Å; L213-L215 PolarHBondContact O-N 3.29Å; L215-E219 HydrophobicContact CB-CB 4.13Å; L215-E219 WeakPolarHBondContact CD2-OE2 3.47Å; L215-V220 HydrophobicContact CB-CG2 3.86Å; L215-L223 HydrophobicContact CD1-CD1 3.37Å
216	P	91.5	Very high	95	Very high	67 Å²	67	86.5 Å²	86.5	44%	0.435	41%	0.413	S	S	.	.			trans	-68.3	153.3	169	30.2	-34.9	0	0	0	111.1	K218 E219 V220	P216-K218 PolarHBondContact O-N 3.37Å; P216-E219 HydrophobicContact CG-CB 4.02Å; P216-E219 HydrophobicContact CG-CG 3.76Å; P216-E219 WeakPolarHBondContact CG-OE1 3.31Å; P216-E219 PolarHBondContact O-N 2.99Å; P216-V220 PolarHBondContact O-N 3.43Å; P216-V220 VanDerWaalsContact O-N 3.09Å
217	L	92.2	Very high	95	Very high	22 Å²	22	83.3 Å²	83.3	12%	0.115	40%	0.403	C	S	.	.	H	α-helix	trans	-49.1	-39.5	-178.1	175.9	60.3	0	0	0	113.5	M166 L192 Q193 E219 V220 Y221	M166-L217 HydrophobicContact CE-CD1 3.81Å; L192-L217 HydrophobicContact CD2-CD2 3.75Å; L192-L217 HydrophobicContact CG-CD2 4.2Å; Q193-L217 HydrophobicContact CB-CB 4.41Å; Q193-L217 HydrophobicContact CB-CD1 3.91Å; Q193-L217 HydrophobicContact CG-CD1 4.32Å; L217-E219 VanDerWaalsContact C-N 3.33Å; L217-E219 PolarHBondContact O-N 3.45Å; L217-V220 PolarHBondContact O-N 2.62Å; L217-Y221 WeakPolarHBondContact O-CB 3.44Å; L217-Y221 PolarHBondContact O-N 3.08Å
218	K	93.5	Very high	95	Very high	177 Å²	177	81 Å²	81	77%	0.77	40%	0.397	S	S	*	.	H	α-helix	trans	-59.2	-42.7	177.7	-174.7	-178.4	177.9	-175.6	0	112.2	P216 S222	P216-K218 PolarHBondContact O-N 3.37Å; K218-S222 PolarHBondContact O-N 3.38Å; K218-S222 VanDerWaalsContact O-N 3.07Å
219	E	95.3	Very high	95	Very high	92 Å²	92	75.6 Å²	75.6	43%	0.43	38%	0.384	S	S	.	.	H	α-helix	trans	-73.3	-41.6	179.2	-73.1	176.6	-148.4	0	0	111.2	L215 P216 L217 Y221 S222 L223	L215-E219 HydrophobicContact CB-CB 4.13Å; L215-E219 WeakPolarHBondContact CD2-OE2 3.47Å; P216-E219 HydrophobicContact CG-CB 4.02Å; P216-E219 HydrophobicContact CG-CG 3.76Å; P216-E219 WeakPolarHBondContact CG-OE1 3.31Å; P216-E219 PolarHBondContact O-N 2.99Å; L217-E219 VanDerWaalsContact C-N 3.33Å; L217-E219 PolarHBondContact O-N 3.45Å; E219-Y221 VanDerWaalsContact C-N 3.29Å; E219-Y221 PolarHBondContact O-N 3.34Å; E219-S222 WeakPolarHBondContact CA-OG 3.39Å; E219-S222 PolarHBondContact O-N 3.47Å; E219-S222 VanDerWaalsContact O-N 3.12Å; E219-S222 PolarHBondContact O-OG 2.96Å; E219-L223 WeakPolarHBondContact O-CG 3.15Å; E219-L223 PolarHBondContact O-N 3.11Å
220	V	96.3	Very high	95	Very high	1 Å²	1	78.7 Å²	78.7	1%	0.006	40%	0.403	C	S	.	.	H	α-helix	trans	-56.2	-45.8	173.2	179.1	0	0	0	0	110.9	Q193 F196 I197 I209 L215 P216 L217 S222 L223 A224	Q193-V220 HydrophobicContact CG-CG2 4.37Å; F196-V220 HydrophobicContact CD1-CG1 3.87Å; F196-V220 HydrophobicContact CE1-CG1 4.03Å; I197-V220 HydrophobicContact CD1-CG1 4.04Å; I197-V220 HydrophobicContact CG1-CG1 3.7Å; I209-V220 HydrophobicContact CD1-CG1 4.18Å; I209-V220 HydrophobicContact CG2-CG1 4.31Å; L215-V220 HydrophobicContact CB-CG2 3.86Å; P216-V220 PolarHBondContact O-N 3.43Å; P216-V220 VanDerWaalsContact O-N 3.09Å; L217-V220 PolarHBondContact O-N 2.62Å; V220-S222 PolarHBondContact O-N 3.32Å; V220-L223 PolarHBondContact O-N 3.45Å; V220-A224 PolarHBondContact O-N 3.14Å
221	Y	97	Very high	95	Very high	52 Å²	52	75.4 Å²	75.4	20%	0.204	39%	0.394	C	S	.	.	H	α-helix	trans	-62.2	-42	176.3	179.4	-114.6	0	0	0	112.2	V162 A163 M166 F196 L217 E219 L223 A224 L225	V162-Y221 HydrophobicContact CG1-CD2 4.15Å; V162-Y221 HydrophobicContact CG1-CE2 3.89Å; A163-Y221 WeakPolarHBondContact CA-OH 3.26Å; A163-Y221 WeakPolarHBondContact CB-OH 3.44Å; M166-Y221 HydrophobicContact CB-CD2 4.08Å; M166-Y221 HydrophobicContact CB-CE2 3.72Å; M166-Y221 HydrophobicContact CE-CD2 3.78Å; M166-Y221 HydrophobicContact CE-CG 4.31Å; M166-Y221 HydrophobicContact CG-CD2 4.02Å; M166-Y221 HydrophobicContact CG-CE2 3.93Å; F196-Y221 HydrophobicContact CE2-CD2 4.4Å; F196-Y221 AromaticContact CZ-CD2 3.91Å; F196-Y221 HydrophobicContact CZ-CD2 3.91Å; L217-Y221 WeakPolarHBondContact O-CB 3.44Å; L217-Y221 PolarHBondContact O-N 3.08Å; E219-Y221 VanDerWaalsContact C-N 3.29Å; E219-Y221 PolarHBondContact O-N 3.34Å; Y221-L223 PolarHBondContact O-N 3.35Å; Y221-A224 WeakPolarHBondContact O-CB 3.26Å; Y221-A224 PolarHBondContact O-N 3.37Å; Y221-L225 HydrophobicContact CD1-CD1 4.07Å; Y221-L225 HydrophobicContact CE1-CD1 3.55Å; Y221-L225 HydrophobicContact CE1-CG 4.27Å; Y221-L225 HydrophobicContact CE2-CD1 4.41Å; Y221-L225 HydrophobicContact CE2-CD2 4.41Å; Y221-L225 HydrophobicContact CE2-CG 4.27Å; Y221-L225 PolarHBondContact O-N 3.13Å
222	S	97.1	Very high	94.9	Very high	60 Å²	60	69.8 Å²	69.8	42%	0.42	38%	0.381	S	S	.	.	H	α-helix	trans	-63.8	-38.5	176.7	73.7	0	0	0	0	113.1	K218 E219 V220 A224 L225 L226	K218-S222 PolarHBondContact O-N 3.38Å; K218-S222 VanDerWaalsContact O-N 3.07Å; E219-S222 WeakPolarHBondContact CA-OG 3.39Å; E219-S222 PolarHBondContact O-N 3.47Å; E219-S222 VanDerWaalsContact O-N 3.12Å; E219-S222 PolarHBondContact O-OG 2.96Å; V220-S222 PolarHBondContact O-N 3.32Å; S222-A224 VanDerWaalsContact C-N 3.34Å; S222-L225 PolarHBondContact O-N 3.49Å; S222-L226 WeakPolarHBondContact O-CB 3.47Å; S222-L226 PolarHBondContact O-N 3.13Å
223	L	97	Very high	95	Very high	51 Å²	51	73 Å²	73	27%	0.267	38%	0.383	S	S	.	.	H	α-helix	trans	-66.3	-37.8	175.1	-72.3	175.3	0	0	0	111.7	I209 L215 E219 V220 Y221 L226 G227	I209-L223 HydrophobicContact CD1-CB 4.31Å; I209-L223 HydrophobicContact CG1-CB 4.33Å; I209-L223 HydrophobicContact CG1-CD1 4.13Å; L215-L223 HydrophobicContact CD1-CD1 3.37Å; E219-L223 WeakPolarHBondContact O-CG 3.15Å; E219-L223 PolarHBondContact O-N 3.11Å; V220-L223 PolarHBondContact O-N 3.45Å; Y221-L223 PolarHBondContact O-N 3.35Å; L223-L226 PolarHBondContact O-N 2.71Å; L223-G227 PolarHBondContact O-N 3.42Å
224	A	97.4	Very high	95.2	Very high	1 Å²	1	68 Å²	68	1%	0.008	36%	0.362	C	S	.	.	H	α-helix	trans	-64.5	-44.3	175.2	0	0	0	0	0	112.2	V162 F196 M200 V220 Y221 S222 L226 G227 E228	V162-A224 HydrophobicContact CG1-CB 3.67Å; V162-A224 HydrophobicContact CG2-CB 4.33Å; F196-A224 HydrophobicContact CE1-CB 3.74Å; F196-A224 HydrophobicContact CZ-CB 3.57Å; M200-A224 HydrophobicContact CE-CB 3.54Å; M200-A224 HydrophobicContact SD-CB 4.34Å; V220-A224 PolarHBondContact O-N 3.14Å; Y221-A224 WeakPolarHBondContact O-CB 3.26Å; Y221-A224 PolarHBondContact O-N 3.37Å; S222-A224 VanDerWaalsContact C-N 3.34Å; A224-L226 VanDerWaalsContact C-N 3.35Å; A224-L226 PolarHBondContact O-N 2.73Å; A224-G227 PolarHBondContact O-N 3.19Å; A224-E228 PolarHBondContact O-N 3.37Å
225	L	97.8	Very high	95.2	Very high	56 Å²	56	66.3 Å²	66.3	29%	0.293	35%	0.35	S	S	.	.	H	α-helix	trans	-62	-41.4	174.3	-71.6	174.7	0	0	0	112.4	V162 Y221 S222 G227 E228 T229	V162-L225 HydrophobicContact CB-CD2 4.17Å; V162-L225 HydrophobicContact CG1-CD2 4.04Å; V162-L225 HydrophobicContact CG1-CG 4.31Å; Y221-L225 HydrophobicContact CD1-CD1 4.07Å; Y221-L225 HydrophobicContact CE1-CD1 3.55Å; Y221-L225 HydrophobicContact CE1-CG 4.27Å; Y221-L225 HydrophobicContact CE2-CD1 4.41Å; Y221-L225 HydrophobicContact CE2-CD2 4.41Å; Y221-L225 HydrophobicContact CE2-CG 4.27Å; Y221-L225 PolarHBondContact O-N 3.13Å; S222-L225 PolarHBondContact O-N 3.49Å; L225-G227 VanDerWaalsContact C-N 3.35Å; L225-E228 PolarHBondContact O-N 2.93Å; L225-T229 PolarHBondContact O-N 3.07Å; L225-T229 PolarHBondContact O-OG1 2.97Å
226	L	97.1	Very high	95.3	Very high	96 Å²	96	69 Å²	69	50%	0.503	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-42.4	174.9	-179.7	61.9	0	0	0	111.1	S222 L223 A224 T229 V230	S222-L226 WeakPolarHBondContact O-CB 3.47Å; S222-L226 PolarHBondContact O-N 3.13Å; L223-L226 PolarHBondContact O-N 2.71Å; A224-L226 VanDerWaalsContact C-N 3.35Å; A224-L226 PolarHBondContact O-N 2.73Å; L226-T229 PolarHBondContact O-N 2.76Å; L226-V230 HydrophobicContact CD1-CG2 4.23Å; L226-V230 HydrophobicContact CG-CG2 4.4Å; L226-V230 WeakPolarHBondContact O-CB 3.44Å; L226-V230 VanDerWaalsContact O-CG2 3.28Å; L226-V230 WeakPolarHBondContact O-CG2 3.45Å; L226-V230 PolarHBondContact O-N 2.97Å
227	G	96.8	Very high	95.3	Very high	8 Å²	8	71.5 Å²	71.5	8%	0.082	37%	0.373	C	S	.	.	H	α-helix	trans	-57.4	-48.5	175.3	0	0	0	0	0	112.8	T205 L223 A224 L225 T229 V230 A231	T205-G227 VanDerWaalsContact OG1-CA 3.26Å; T205-G227 WeakPolarHBondContact OG1-CA 3.15Å; L223-G227 PolarHBondContact O-N 3.42Å; A224-G227 PolarHBondContact O-N 3.19Å; L225-G227 VanDerWaalsContact C-N 3.35Å; G227-T229 PolarHBondContact O-N 3.31Å; G227-V230 PolarHBondContact O-N 2.85Å; G227-A231 WeakPolarHBondContact O-CB 3.49Å; G227-A231 PolarHBondContact O-N 3.23Å
228	E	96.7	Very high	95.4	Very high	61 Å²	61	76.5 Å²	76.5	29%	0.285	40%	0.396	S	S	.	.	H	α-helix	trans	-56.8	-48.6	174	-178.9	177.7	90.5	0	0	111.3	P161 V162 A224 L225 V230 A231 T232	P161-E228 VanDerWaalsContact CA-OE2 3.27Å; P161-E228 WeakPolarHBondContact CA-OE2 3.43Å; V162-E228 HydrophobicContact CG2-CB 4.13Å; V162-E228 WeakPolarHBondContact CG2-OE2 3.34Å; V162-E228 PolarHBondContact N-OE2 3.05Å; A224-E228 PolarHBondContact O-N 3.37Å; L225-E228 PolarHBondContact O-N 2.93Å; E228-V230 PolarHBondContact O-N 3.48Å; E228-A231 PolarHBondContact O-N 3.47Å; E228-T232 PolarHBondContact O-N 3.29Å; E228-T232 PolarHBondContact O-OG1 3.11Å; E228-T232 VanDerWaalsContact O-OG1 3.07Å
229	T	96.5	Very high	95.2	Very high	65 Å²	65	72.7 Å²	72.7	40%	0.399	38%	0.381	S	S	.	.	H	α-helix	trans	-59.7	-45.3	178.5	-56.8	0	0	0	0	111.8	L225 L226 G227 T232 Q233	L225-T229 PolarHBondContact O-N 3.07Å; L225-T229 PolarHBondContact O-OG1 2.97Å; L226-T229 PolarHBondContact O-N 2.76Å; G227-T229 PolarHBondContact O-N 3.31Å; T229-T232 PolarHBondContact O-N 3.22Å; T229-Q233 HydrophobicContact CG2-CG 4.48Å; T229-Q233 WeakPolarHBondContact O-CB 3.3Å; T229-Q233 VanDerWaalsContact O-CG 3.27Å; T229-Q233 WeakPolarHBondContact O-CG 3.21Å; T229-Q233 PolarHBondContact O-N 2.98Å
230	V	96.3	Very high	94.9	Very high	80 Å²	80	78 Å²	78	49%	0.485	40%	0.397	S	S	.	.	H	α-helix	trans	-64.9	-42.1	178.9	169.4	0	0	0	0	110.9	L226 G227 E228 Q233 S234	L226-V230 HydrophobicContact CD1-CG2 4.23Å; L226-V230 HydrophobicContact CG-CG2 4.4Å; L226-V230 WeakPolarHBondContact O-CB 3.44Å; L226-V230 VanDerWaalsContact O-CG2 3.28Å; L226-V230 WeakPolarHBondContact O-CG2 3.45Å; L226-V230 PolarHBondContact O-N 2.97Å; G227-V230 PolarHBondContact O-N 2.85Å; E228-V230 PolarHBondContact O-N 3.48Å; V230-Q233 PolarHBondContact O-N 2.78Å; V230-S234 WeakPolarHBondContact O-CB 3.03Å; V230-S234 PolarHBondContact O-N 3.43Å
231	A	94.2	Very high	94.5	Very high	51 Å²	51	81.1 Å²	81.1	42%	0.421	42%	0.423	S	S	.	.	H	α-helix	trans	-62.7	-45.4	177.3	0	0	0	0	0	111.6	G227 E228 S234 R235	G227-A231 WeakPolarHBondContact O-CB 3.49Å; G227-A231 PolarHBondContact O-N 3.23Å; E228-A231 PolarHBondContact O-N 3.47Å; A231-S234 PolarHBondContact O-N 3.19Å; A231-R235 PolarHBondContact O-N 2.93Å; A231-R235 VanDerWaalsContact O-N 3.07Å
232	T	94	Very high	93.9	Very high	79 Å²	79	82.9 Å²	82.9	49%	0.485	45%	0.448	S	S	.	.	H	α-helix	trans	-60.8	-45.7	174.8	-55.3	0	0	0	0	111.6	E228 T229 R235 L236	E228-T232 PolarHBondContact O-N 3.29Å; E228-T232 PolarHBondContact O-OG1 3.11Å; E228-T232 VanDerWaalsContact O-OG1 3.07Å; T229-T232 PolarHBondContact O-N 3.22Å; T232-R235 PolarHBondContact O-N 3.48Å; T232-L236 HydrophobicContact CG2-CD1 4.45Å; T232-L236 WeakPolarHBondContact O-CG 3.2Å; T232-L236 PolarHBondContact O-N 3.02Å; T232-L236 VanDerWaalsContact O-N 3.1Å
233	Q	94.9	Very high	92.9	Very high	113 Å²	113	83.4 Å²	83.4	53%	0.528	46%	0.463	S	S	.	.	H	α-helix	trans	-64.8	-41	178.6	-73.7	178	-5	0	0	112.5	T229 V230 R235 L236 L237	T229-Q233 HydrophobicContact CG2-CG 4.48Å; T229-Q233 WeakPolarHBondContact O-CB 3.3Å; T229-Q233 VanDerWaalsContact O-CG 3.27Å; T229-Q233 WeakPolarHBondContact O-CG 3.21Å; T229-Q233 PolarHBondContact O-N 2.98Å; V230-Q233 PolarHBondContact O-N 2.78Å; Q233-R235 VanDerWaalsContact C-N 3.35Å; Q233-R235 PolarHBondContact O-N 3.48Å; Q233-L236 PolarHBondContact O-N 2.96Å; Q233-L237 WeakPolarHBondContact O-CG 3.44Å; Q233-L237 PolarHBondContact O-N 3.27Å
234	S	93.9	Very high	91.5	Very high	52 Å²	52	84 Å²	84	36%	0.364	47%	0.472	S	S	.	.	H	α-helix	trans	-59.7	-46.2	176.4	-164.9	0	0	0	0	111.1	V230 A231 L236 L237 E238	V230-S234 WeakPolarHBondContact O-CB 3.03Å; V230-S234 PolarHBondContact O-N 3.43Å; A231-S234 PolarHBondContact O-N 3.19Å; S234-L236 PolarHBondContact O-N 3.06Å; S234-L237 PolarHBondContact O-N 3.38Å; S234-E238 WeakPolarHBondContact O-CG 2.99Å; S234-E238 PolarHBondContact O-N 3.27Å; S234-E238 PolarHBondContact OG-OE1 2.86Å
235	R	92.8	Very high	89.8	Confident	165 Å²	165	89.3 Å²	89.3	62%	0.623	51%	0.506	S	S	*	.	H	α-helix	trans	-59.2	-44.5	176.7	179.5	180	162.5	178.5	-3.3	112.1	A231 T232 Q233 L237 E238 E239	A231-R235 PolarHBondContact O-N 2.93Å; A231-R235 VanDerWaalsContact O-N 3.07Å; T232-R235 PolarHBondContact O-N 3.48Å; Q233-R235 VanDerWaalsContact C-N 3.35Å; Q233-R235 PolarHBondContact O-N 3.48Å; R235-L237 VanDerWaalsContact C-N 3.33Å; R235-L237 PolarHBondContact O-N 3.37Å; R235-E238 PolarHBondContact O-N 3.07Å; R235-E239 HydrophobicContact CG-CG 4.46Å; R235-E239 IonicContact CZ-OE1 3.45Å; R235-E239 IonicContact NE-OE1 3.85Å; R235-E239 PolarHBondContact NE-OE1 3.17Å; R235-E239 IonicContact NH2-OE1 2.79Å; R235-E239 PolarHBondContact NH2-OE1 3.31Å; R235-E239 WeakPolarHBondContact O-CB 3.49Å; R235-E239 WeakPolarHBondContact O-CG 3.44Å; R235-E239 PolarHBondContact O-N 3.02Å
236	L	93.2	Very high	88.2	Confident	101 Å²	101	92.3 Å²	92.3	53%	0.529	53%	0.526	S	S	.	.	H	α-helix	trans	-63.6	-37.1	177	-70.3	173.9	0	0	0	112.6	T232 Q233 S234 R240	T232-L236 HydrophobicContact CG2-CD1 4.45Å; T232-L236 WeakPolarHBondContact O-CG 3.2Å; T232-L236 PolarHBondContact O-N 3.02Å; T232-L236 VanDerWaalsContact O-N 3.1Å; Q233-L236 PolarHBondContact O-N 2.96Å; S234-L236 PolarHBondContact O-N 3.06Å; L236-R240 WeakPolarHBondContact O-CB 3.26Å; L236-R240 PolarHBondContact O-N 3.01Å
237	L	92.6	Very high	86.5	Confident	119 Å²	119	92.7 Å²	92.7	62%	0.623	54%	0.535	S	S	*	.	H	α-helix	trans	-67.4	-40.6	175.7	-70.2	172.1	0	0	0	111.7	Q233 S234 R235 R240 A241	Q233-L237 WeakPolarHBondContact O-CG 3.44Å; Q233-L237 PolarHBondContact O-N 3.27Å; S234-L237 PolarHBondContact O-N 3.38Å; R235-L237 VanDerWaalsContact C-N 3.33Å; R235-L237 PolarHBondContact O-N 3.37Å; L237-R240 PolarHBondContact O-N 3.45Å; L237-A241 WeakPolarHBondContact O-CB 3.36Å; L237-A241 PolarHBondContact O-N 2.91Å
238	E	92.6	Very high	84.8	Confident	127 Å²	127	97.5 Å²	97.5	59%	0.593	56%	0.562	S	S	*	*	H	α-helix	trans	-65.6	-45	175.8	-72.5	170.1	-161.9	0	0	112	S234 R235 R240 A241 A242	S234-E238 WeakPolarHBondContact O-CG 2.99Å; S234-E238 PolarHBondContact O-N 3.27Å; S234-E238 PolarHBondContact OG-OE1 2.86Å; R235-E238 PolarHBondContact O-N 3.07Å; E238-R240 VanDerWaalsContact C-N 3.31Å; E238-R240 PolarHBondContact O-N 2.81Å; E238-A241 PolarHBondContact O-N 3.22Å; E238-A242 WeakPolarHBondContact O-CB 3.43Å; E238-A242 PolarHBondContact O-N 3.1Å
239	E	90.6	Very high	83.3	Confident	96 Å²	96	100.6 Å²	100.6	45%	0.449	59%	0.585	S	S	.	*	H	α-helix	trans	-59.7	-42.2	174.7	-73.8	172.5	-179.3	0	0	111.2	R235 A242 G243	R235-E239 HydrophobicContact CG-CG 4.46Å; R235-E239 IonicContact CZ-OE1 3.45Å; R235-E239 IonicContact NE-OE1 3.85Å; R235-E239 PolarHBondContact NE-OE1 3.17Å; R235-E239 IonicContact NH2-OE1 2.79Å; R235-E239 PolarHBondContact NH2-OE1 3.31Å; R235-E239 WeakPolarHBondContact O-CB 3.49Å; R235-E239 WeakPolarHBondContact O-CG 3.44Å; R235-E239 PolarHBondContact O-N 3.02Å; E239-A242 PolarHBondContact O-N 3.2Å; E239-G243 PolarHBondContact O-N 3.44Å
240	R	88.9	Confident	81.5	Confident	204 Å²	204	105 Å²	105	77%	0.77	60%	0.601	S	S	*	*	H	α-helix	trans	-67	-37.5	175.7	-172.2	175.9	-176.2	171.3	2.2	112.6	L236 L237 E238 S244	L236-R240 WeakPolarHBondContact O-CB 3.26Å; L236-R240 PolarHBondContact O-N 3.01Å; L237-R240 PolarHBondContact O-N 3.45Å; E238-R240 VanDerWaalsContact C-N 3.31Å; E238-R240 PolarHBondContact O-N 2.81Å; R240-S244 PolarHBondContact O-N 3.42Å
241	A	87.1	Confident	79.7	Confident	67 Å²	67	105.1 Å²	105.1	55%	0.554	61%	0.61	S	S	*	*	H	α-helix	trans	-68.8	-37	176.3	0	0	0	0	0	111.9	L237 E238 G243 S244	L237-A241 WeakPolarHBondContact O-CB 3.36Å; L237-A241 PolarHBondContact O-N 2.91Å; E238-A241 PolarHBondContact O-N 3.22Å; A241-G243 VanDerWaalsContact C-N 3.33Å; A241-G243 PolarHBondContact O-N 3.44Å; A241-S244 PolarHBondContact O-N 2.88Å
242	A	84	Confident	77.9	Confident	88 Å²	88	110.7 Å²	110.7	73%	0.727	63%	0.632	S	S	*	*	H	α-helix	trans	-67.9	-30.7	176.9	0	0	0	0	0	113.2	E238 E239 S244	E238-A242 WeakPolarHBondContact O-CB 3.43Å; E238-A242 PolarHBondContact O-N 3.1Å; E239-A242 PolarHBondContact O-N 3.2Å; A242-S244 VanDerWaalsContact C-N 3.35Å
243	G	75.8	Confident	75.9	Confident	71 Å²	71	110.8 Å²	110.8	73%	0.732	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-13.3	174.1	0	0	0	0	0	114.7	E239 A241	E239-G243 PolarHBondContact O-N 3.44Å; A241-G243 VanDerWaalsContact C-N 3.33Å; A241-G243 PolarHBondContact O-N 3.44Å
244	S	68.3	Low	73.9	Confident	65 Å²	65	111.3 Å²	111.3	46%	0.455	65%	0.647	S	S	.	*	S	Bend	trans	-85.4	136.6	172.7	-173.3	0	0	0	0	109	R240 A241 A242 V246	R240-S244 PolarHBondContact O-N 3.42Å; A241-S244 PolarHBondContact O-N 2.88Å; A242-S244 VanDerWaalsContact C-N 3.35Å; S244-V246 PolarHBondContact O-N 3.21Å
245	P	62.1	Low	71.9	Confident	111 Å²	111	118 Å²	118	72%	0.721	67%	0.67	S	S	*	*			trans	-52.7	121.9	171.2	22	-31.3	0	0	0	107.7	P247	P245-P247 WeakPolarHBondContact O-CD 3.29Å
246	V	64.2	Low	69.8	Low	120 Å²	120	115.7 Å²	115.7	73%	0.727	67%	0.67	S	S	*	*			trans	-45.9	118.8	176.7	177	0	0	0	0	106	S244 T248	S244-V246 PolarHBondContact O-N 3.21Å; V246-T248 PolarHBondContact O-N 3.3Å
247	P	62	Low	67.5	Low	104 Å²	104	120.4 Å²	120.4	68%	0.675	69%	0.686	S	S	*	*			trans	-55.6	114.1	176.7	20.2	-29	0	0	0	105.4	P245 V249	P245-P247 WeakPolarHBondContact O-CD 3.29Å; P247-V249 PolarHBondContact O-N 3.18Å
248	T	60.6	Low	65.3	Low	109 Å²	109	120.4 Å²	120.4	67%	0.669	70%	0.696	S	S	*	*			trans	-63.9	100.8	177.2	-57.8	0	0	0	0	104	V246 H250	V246-T248 PolarHBondContact O-N 3.3Å; T248-H250 PolarHBondContact O-N 2.94Å
249	V	64.5	Low	62.8	Low	125 Å²	125	118.3 Å²	118.3	76%	0.758	71%	0.709	S	S	*	*			trans	-64.3	96.1	168	-176.9	0	0	0	0	103.2	P247 A251	P247-V249 PolarHBondContact O-N 3.18Å; V249-A251 PolarHBondContact O-N 3.48Å
250	H	58.4	Low	60.8	Low	158 Å²	158	123.4 Å²	123.4	73%	0.731	72%	0.724	S	S	*	*			trans	-56.7	101.7	161	-74.5	-65.2	0	0	0	103.9	T248 L252	T248-H250 PolarHBondContact O-N 2.94Å; H250-L252 VanDerWaalsContact C-N 3.31Å; H250-L252 PolarHBondContact O-N 3.29Å
251	A	59.2	Low	59.1	Low	83 Å²	83	118.8 Å²	118.8	69%	0.686	72%	0.723	S	S	*	*			trans	-49.5	112	163.2	0	0	0	0	0	103.8	V249 A253	V249-A251 PolarHBondContact O-N 3.48Å; A251-A253 PolarHBondContact O-N 3.39Å
252	L	55.6	Low	57	Low	168 Å²	168	123.1 Å²	123.1	88%	0.88	74%	0.737	S	S	*	*			trans	-61.9	89.8	161.3	-72.4	172.6	0	0	0	102.9	H250 N254	H250-L252 VanDerWaalsContact C-N 3.31Å; H250-L252 PolarHBondContact O-N 3.29Å; L252-N254 PolarHBondContact O-N 3.03Å
253	A	52.8	Low	55.4	Low	80 Å²	80	126.4 Å²	126.4	66%	0.661	74%	0.737	S	S	*	*			trans	-52.6	102.7	166.1	0	0	0	0	0	102.8	A251 K255	A251-A253 PolarHBondContact O-N 3.39Å; A253-K255 PolarHBondContact O-N 3.31Å
254	N	52.6	Low	53.8	Low	125 Å²	125	129.3 Å²	129.3	67%	0.668	74%	0.74	S	S	*	*			trans	-57	103.2	176.3	-169.2	11.9	0	0	0	103.3	L252 N256	L252-N254 PolarHBondContact O-N 3.03Å; N254-N256 PolarHBondContact ND2-ND2 3.43Å; N254-N256 PolarHBondContact O-N 3.06Å; N254-N256 PolarHBondContact OD1-ND2 2.82Å
255	K	51.4	Low	52.7	Low	193 Å²	193	131 Å²	131	84%	0.839	75%	0.752	S	S	*	*			trans	-71.1	49	178.1	-83.9	-174.9	174.2	178.7	0	108.7	A253 K257	A253-K255 PolarHBondContact O-N 3.31Å; K255-K257 VanDerWaalsContact C-N 3.34Å; K255-K257 PolarHBondContact O-N 3.39Å
256	N	49.8	Very low	51.6	Low	116 Å²	116	135.9 Å²	135.9	62%	0.62	76%	0.762	S	S	*	*			trans	-96	76.8	161.9	-74	-11.2	0	0	0	106.8	N254 S258	N254-N256 PolarHBondContact ND2-ND2 3.43Å; N254-N256 PolarHBondContact O-N 3.06Å; N254-N256 PolarHBondContact OD1-ND2 2.82Å; N256-S258 PolarHBondContact O-N 3.48Å
257	K	44.5	Very low	50.6	Low	199 Å²	199	133.5 Å²	133.5	87%	0.865	76%	0.762	S	S	*	*			trans	29.7	92.3	133	-60.8	177.8	178.7	-180	0	115.4	K255	K255-K257 VanDerWaalsContact C-N 3.34Å; K255-K257 PolarHBondContact O-N 3.39Å
258	S	46.6	Very low	49.8	Very low	119 Å²	119	133.2 Å²	133.2	83%	0.832	77%	0.769	S	S	*	*			trans	-164.8	65.9	146.8	61.1	0	0	0	0	111.9	N256	N256-S258 PolarHBondContact O-N 3.48Å
259	G	40.6	Very low	49.5	Very low	84 Å²	84	137.2 Å²	137.2	87%	0.866	78%	0.78	S	S	*	*			trans	-116.2	71.3	156.4	0	0	0	0	0	108.1
260	R	48.5	Very low	49.5	Very low	202 Å²	202	134.1 Å²	134.1	76%	0.762	77%	0.773	S	S	*	*			trans	-131.6	83.7	170.5	-161.4	170.4	179.1	175.2	-1.3	104.3
261	S	51.9	Low	50.4	Low	107 Å²	107	132.5 Å²	132.5	75%	0.748	78%	0.775	S	S	*	*				36.3	106.7	91.6	-166.7	0	0	0	0	110.7	Q263	S261-Q263 PolarHBondContact O-N 3.19Å
262	N	43.5	Very low	51.7	Low	158 Å²	158	134.1 Å²	134.1	85%	0.845	77%	0.766	S	S	*	*	S	Bend	trans	-32.5	108.5	166.8	-87.2	-17.8	0	0	0	111.1
263	Q	49.7	Very low	53.4	Low	158 Å²	158	126.3 Å²	126.3	74%	0.738	73%	0.726	S	S	*	*			trans	-175	100.2	142	-103.5	166.3	18.1	0	0	110.4	S261	S261-Q263 PolarHBondContact O-N 3.19Å
264	V	43	Very low	55.1	Low	131 Å²	131	129 Å²	129	79%	0.794	73%	0.728	S	S	*	*				25.7	108.2	129.3	-153.1	0	0	0	0	115.8
265	S	45.6	Very low	56.9	Low	102 Å²	102	124.5 Å²	124.5	71%	0.713	70%	0.702	S	S	*	*			trans	-178.8	131.5	136.8	23.2	0	0	0	0	111.9
266	F	38	Very low	58.9	Low	212 Å²	212	115.8 Å²	115.8	93%	0.93	67%	0.665	S	S	*	*			trans	-66.6	153.8	-179.3	-80.2	-116.9	0	0	0	113.2
267	G	43.8	Very low	60.8	Low	70 Å²	70	112.8 Å²	112.8	72%	0.722	65%	0.649	S	S	*	*			trans	141.4	75.2	170.8	0	0	0	0	0	111.8
268	A	45.3	Very low	62.9	Low	99 Å²	99	109.6 Å²	109.6	82%	0.818	64%	0.635	S	S	*	*				56.1	59.5	79.1	0	0	0	0	0	114.7
269	E	54.8	Low	65	Low	193 Å²	193	110.6 Å²	110.6	90%	0.902	62%	0.624	S	S	*	*	S	Bend	trans	-169.2	-4.6	153.6	-116.6	163.5	-173	0	0	118.3
270	G	65	Low	67.2	Low	59 Å²	59	110.6 Å²	110.6	61%	0.608	62%	0.624	S	S	*	*	S	Bend	trans	-119.6	-33.9	-167.9	0	0	0	0	0	118
271	T	75.4	Confident	69.2	Low	125 Å²	125	103.6 Å²	103.6	77%	0.767	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-94.3	129.7	-163	33.3	0	0	0	0	112.5
272	K	87.2	Confident	70.9	Confident	116 Å²	116	100.9 Å²	100.9	50%	0.504	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-68.9	138.6	172	-58.7	-173.2	-175.7	-179.8	0	109.4	L274 D277 K279	K272-L274 PolarHBondContact O-N 3Å; K272-D277 WeakPolarHBondContact CD-OD1 3.35Å; K272-D277 IonicContact NZ-OD1 3.6Å; K272-D277 IonicContact NZ-OD2 3.29Å; K272-K279 HydrophobicContact CG-CG 4.22Å
273	C	90.8	Very high	72.9	Confident	5 Å²	5	94.8 Å²	94.8	3%	0.034	55%	0.553	C	S	.	*	P	Polyproline II helix	trans	-61.3	127.1	176.1	172.6	0	0	0	0	111.1	R275 C276 D277 K278 H281 C286	C273-R275 PolarHBondContact O-N 3.36Å; C273-R275 VanDerWaalsContact O-N 3.14Å; C273-R275 PolarHBondContact SG-N 2.93Å; C273-R275 VanDerWaalsContact SG-N 3.41Å; C273-C276 PolarHBondContact O-N 3.36Å; C273-D277 WeakPolarHBondContact O-CA 3.36Å; C273-D277 PolarHBondContact O-N 3.4Å; C273-K278 VanDerWaalsContact CB-O 3.23Å; C273-K278 WeakPolarHBondContact CB-O 3.29Å; C273-K278 PolarHBondContact N-O 2.82Å; C273-H281 WeakPolarHBondContact CB-NE2 3.24Å; C273-H281 PolarHBondContact SG-NE2 3.28Å; C273-C286 VanDerWaalsContact SG-SG 3.66Å
274	L	88.3	Confident	74.7	Confident	136 Å²	136	92.8 Å²	92.8	71%	0.712	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.1	-180	-64.4	175.2	0	0	0	113.7	K272	K272-L274 PolarHBondContact O-N 3Å
275	R	91.7	Very high	76.9	Confident	31 Å²	31	94.6 Å²	94.6	12%	0.117	54%	0.544	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-27.7	-178.7	-54.3	-164	166.7	158.5	-14.2	113	C273 A283 C286 E300 H301 V302	C273-R275 PolarHBondContact O-N 3.36Å; C273-R275 VanDerWaalsContact O-N 3.14Å; C273-R275 PolarHBondContact SG-N 2.93Å; C273-R275 VanDerWaalsContact SG-N 3.41Å; R275-A283 WeakPolarHBondContact CD-O 3.49Å; R275-A283 HydrophobicContact CG-CB 4.19Å; R275-A283 PolarHBondContact NH1-O 3.03Å; R275-C286 HydrophobicContact CB-CB 4.11Å; R275-C286 HydrophobicContact CG-CB 4.43Å; R275-E300 WeakPolarHBondContact CA-O 3.35Å; R275-E300 WeakPolarHBondContact CB-O 3.48Å; R275-E300 VanDerWaalsContact CD-O 3.28Å; R275-E300 WeakPolarHBondContact CD-O 3.35Å; R275-E300 WeakPolarHBondContact CG-O 3.46Å; R275-E300 IonicContact CZ-OE1 3.65Å; R275-E300 IonicContact CZ-OE2 2.9Å; R275-E300 IonicContact NE-OE2 3.68Å; R275-E300 IonicContact NH2-OE1 3.57Å; R275-E300 PolarHBondContact NH2-OE1 3.04Å; R275-E300 IonicContact NH2-OE2 2.74Å; R275-E300 PolarHBondContact NH2-OE2 3.09Å; R275-H301 VanDerWaalsContact O-CA 3.32Å; R275-H301 WeakPolarHBondContact O-CA 3.45Å; R275-V302 PolarHBondContact O-N 2.91Å
276	C	92.6	Very high	79.1	Confident	10 Å²	10	89.9 Å²	89.9	7%	0.068	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.5	0.1	-172.5	77.7	0	0	0	0	117.3	C273 K278 H281 F288 V302	C273-C276 PolarHBondContact O-N 3.36Å; C276-K278 PolarHBondContact O-N 3.37Å; C276-K278 VanDerWaalsContact O-N 3.14Å; C276-H281 PolarHBondContact SG-CE1 2.79Å; C276-H281 PolarHBondContact SG-NE2 3.44Å; C276-H281 VanDerWaalsContact SG-NE2 3.35Å; C276-F288 HydrophobicContact CB-CD2 3.3Å; C276-F288 HydrophobicContact CB-CE2 3.77Å; C276-F288 HydrophobicContact CB-CG 4.26Å; C276-V302 HydrophobicContact CB-CG1 4.45Å
277	D	90.1	Very high	81.7	Confident	52 Å²	52	91 Å²	91	28%	0.278	51%	0.51	S	S	.	.	S	Bend	trans	62	10.1	-177.9	-155.6	45.2	0	0	0	115.4	K272 C273 K304 V305	K272-D277 WeakPolarHBondContact CD-OD1 3.35Å; K272-D277 IonicContact NZ-OD1 3.6Å; K272-D277 IonicContact NZ-OD2 3.29Å; C273-D277 WeakPolarHBondContact O-CA 3.36Å; C273-D277 PolarHBondContact O-N 3.4Å; D277-K304 IonicContact OD2-NZ 3.85Å; D277-V305 HydrophobicContact CB-CG1 3.67Å
278	K	89.5	Confident	83.9	Confident	133 Å²	133	90.3 Å²	90.3	58%	0.578	49%	0.487	S	S	*	.			trans	-92.9	146.7	175.4	-61.1	-175.5	179	-171.5	0	111.4	C273 C276	C273-K278 VanDerWaalsContact CB-O 3.23Å; C273-K278 WeakPolarHBondContact CB-O 3.29Å; C273-K278 PolarHBondContact N-O 2.82Å; C276-K278 PolarHBondContact O-N 3.37Å; C276-K278 VanDerWaalsContact O-N 3.14Å
279	K	90.1	Very high	86	Confident	139 Å²	139	90.1 Å²	90.1	60%	0.604	47%	0.468	S	S	*	.	S	Bend	trans	-81.6	167.5	172.1	-62.3	-177	178.2	-175.8	0	110.5	K272	K272-K279 HydrophobicContact CG-CG 4.22Å
280	G	87.3	Confident	87.6	Confident	84 Å²	84	87.8 Å²	87.8	87%	0.866	46%	0.457	S	S	*	.	S	Bend	trans	93.1	7.8	170.6	0	0	0	0	0	116.3
281	H	90.9	Very high	88.8	Confident	56 Å²	56	87.7 Å²	87.7	26%	0.259	44%	0.442	S	S	.	.	S	Bend	trans	-156.9	157.3	172.1	61.7	-78	0	0	0	111.3	C273 C276 F285 C286	C273-H281 WeakPolarHBondContact CB-NE2 3.24Å; C273-H281 PolarHBondContact SG-NE2 3.28Å; C276-H281 PolarHBondContact SG-CE1 2.79Å; C276-H281 PolarHBondContact SG-NE2 3.44Å; C276-H281 VanDerWaalsContact SG-NE2 3.35Å; H281-F285 HydrophobicContact CB-CB 4.36Å; H281-C286 WeakPolarHBondContact CD2-CA 3.43Å; H281-C286 PolarHBondContact NE2-SG 3.11Å; H281-C286 VanDerWaalsContact NE2-SG 3.42Å
282	S	87.5	Confident	89.7	Confident	50 Å²	50	86.2 Å²	86.2	35%	0.35	43%	0.429	S	S	.	.			trans	-80	167	170.5	77.4	0	0	0	0	111.4	D284 F285 C286	S282-D284 PolarHBondContact O-N 2.96Å; S282-D284 PolarHBondContact OG-N 3.07Å; S282-F285 PolarHBondContact O-N 3.33Å; S282-F285 WeakPolarHBondContact OG-CD2 3.28Å; S282-C286 PolarHBondContact O-N 2.94Å
283	A	85.4	Confident	90	Very high	30 Å²	30	80.7 Å²	80.7	25%	0.248	41%	0.405	C	S	.	.	S	Bend	trans	-55.4	-35.3	175.7	0	0	0	0	0	112.2	R275 F285 C286	R275-A283 WeakPolarHBondContact CD-O 3.49Å; R275-A283 HydrophobicContact CG-CB 4.19Å; R275-A283 PolarHBondContact NH1-O 3.03Å; A283-F285 PolarHBondContact O-N 3.14Å; A283-C286 VanDerWaalsContact O-CB 3.28Å; A283-C286 WeakPolarHBondContact O-CB 3.31Å; A283-C286 PolarHBondContact O-N 2.93Å
284	D	86.3	Confident	89.9	Confident	115 Å²	115	85 Å²	85	62%	0.615	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-35.3	-178.4	-50.4	-45.3	0	0	0	112.7	S282	S282-D284 PolarHBondContact O-N 2.96Å; S282-D284 PolarHBondContact OG-N 3.07Å
285	F	89.3	Confident	89.9	Confident	169 Å²	169	83 Å²	83	74%	0.741	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	13.5	178.3	-59.4	-70.4	0	0	0	113.4	H281 S282 A283 R287	H281-F285 HydrophobicContact CB-CB 4.36Å; S282-F285 PolarHBondContact O-N 3.33Å; S282-F285 WeakPolarHBondContact OG-CD2 3.28Å; A283-F285 PolarHBondContact O-N 3.14Å; F285-R287 PolarHBondContact O-N 3.43Å
286	C	92.2	Very high	89.9	Confident	3 Å²	3	82.4 Å²	82.4	2%	0.02	41%	0.408	C	S	.	.			trans	-71.5	129.6	178.9	-173.7	0	0	0	0	111.6	C273 R275 H281 S282 A283 F288 K289	C273-C286 VanDerWaalsContact SG-SG 3.66Å; R275-C286 HydrophobicContact CB-CB 4.11Å; R275-C286 HydrophobicContact CG-CB 4.43Å; H281-C286 WeakPolarHBondContact CD2-CA 3.43Å; H281-C286 PolarHBondContact NE2-SG 3.11Å; H281-C286 VanDerWaalsContact NE2-SG 3.42Å; S282-C286 PolarHBondContact O-N 2.94Å; A283-C286 VanDerWaalsContact O-CB 3.28Å; A283-C286 WeakPolarHBondContact O-CB 3.31Å; A283-C286 PolarHBondContact O-N 2.93Å; C286-F288 PolarHBondContact O-N 3.36Å; C286-F288 PolarHBondContact SG-N 2.68Å; C286-K289 VanDerWaalsContact O-CB 3.25Å; C286-K289 WeakPolarHBondContact O-CB 3.49Å; C286-K289 VanDerWaalsContact O-CG 3.29Å; C286-K289 WeakPolarHBondContact O-CG 3.44Å; C286-K289 PolarHBondContact O-N 3.03Å
287	R	91.6	Very high	89.7	Confident	236 Å²	236	88.6 Å²	88.6	89%	0.891	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-25.2	171.3	-177.6	176	171.3	-173.8	-2.6	113	F285	F285-R287 PolarHBondContact O-N 3.43Å
288	F	90.4	Very high	89.7	Confident	56 Å²	56	93.2 Å²	93.2	25%	0.246	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	16.4	179.3	-54.8	-75.4	0	0	0	113.6	C276 C286 E290 L291 V302	C276-F288 HydrophobicContact CB-CD2 3.3Å; C276-F288 HydrophobicContact CB-CE2 3.77Å; C276-F288 HydrophobicContact CB-CG 4.26Å; C286-F288 PolarHBondContact O-N 3.36Å; C286-F288 PolarHBondContact SG-N 2.68Å; F288-E290 PolarHBondContact O-N 3.3Å; F288-L291 HydrophobicContact CB-CB 4.04Å; F288-L291 HydrophobicContact CB-CD2 4.46Å; F288-L291 HydrophobicContact CD1-CB 4.29Å; F288-L291 HydrophobicContact CD1-CD2 3.76Å; F288-L291 HydrophobicContact CD1-CG 4.39Å; F288-L291 HydrophobicContact CE1-CD2 4.46Å; F288-L291 HydrophobicContact CG-CD2 4.48Å; F288-L291 WeakPolarHBondContact O-CB 3.44Å; F288-L291 PolarHBondContact O-N 3.5Å; F288-V302 HydrophobicContact CB-CG1 4.11Å; F288-V302 HydrophobicContact CD1-CG1 3.81Å; F288-V302 HydrophobicContact CD2-CG1 4.02Å; F288-V302 HydrophobicContact CE1-CG1 4.12Å; F288-V302 HydrophobicContact CE2-CG1 4.31Å; F288-V302 HydrophobicContact CG-CG1 3.7Å; F288-V302 HydrophobicContact CZ-CG1 4.34Å
289	K	89.3	Confident	89.8	Confident	95 Å²	95	93.6 Å²	93.6	41%	0.413	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-36.5	180	62.1	172.8	-171.4	167.8	0	114.1	C286 E300	C286-K289 VanDerWaalsContact O-CB 3.25Å; C286-K289 WeakPolarHBondContact O-CB 3.49Å; C286-K289 VanDerWaalsContact O-CG 3.29Å; C286-K289 WeakPolarHBondContact O-CG 3.44Å; C286-K289 PolarHBondContact O-N 3.03Å; K289-E300 WeakPolarHBondContact O-CA 3.2Å
290	E	89.3	Confident	89.7	Confident	143 Å²	143	91.8 Å²	91.8	67%	0.668	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	5.2	-177.9	-76.1	164.6	-145.5	0	0	112.7	F288	F288-E290 PolarHBondContact O-N 3.3Å
291	L	90.5	Very high	90	Very high	57 Å²	57	89.2 Å²	89.2	30%	0.298	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-69.4	134.5	179.5	-170.6	82.4	0	0	0	110.5	F288 K299 E300 V302	F288-L291 HydrophobicContact CB-CB 4.04Å; F288-L291 HydrophobicContact CB-CD2 4.46Å; F288-L291 HydrophobicContact CD1-CB 4.29Å; F288-L291 HydrophobicContact CD1-CD2 3.76Å; F288-L291 HydrophobicContact CD1-CG 4.39Å; F288-L291 HydrophobicContact CE1-CD2 4.46Å; F288-L291 HydrophobicContact CG-CD2 4.48Å; F288-L291 WeakPolarHBondContact O-CB 3.44Å; F288-L291 PolarHBondContact O-N 3.5Å; L291-K299 CarbonylContact O-C 3.51Å; L291-K299 WeakPolarHBondContact O-CA 3.38Å; L291-E300 PolarHBondContact O-N 3.14Å; L291-V302 HydrophobicContact CD2-CG1 3.82Å
292	L	92.8	Very high	90.1	Very high	95 Å²	95	87.7 Å²	87.7	50%	0.497	41%	0.408	S	S	.	.	B	Isolated β-bridge	trans	-79.9	125.5	165.8	-67.7	169.6	0	0	0	109.9	H294 K299	L292-H294 PolarHBondContact O-N 3.07Å; L292-K299 HydrophobicContact CD2-CG 3.51Å; L292-K299 HydrophobicContact CG-CG 4.46Å
293	C	93.4	Very high	90.3	Very high	0 Å²	0	86.9 Å²	86.9	0%	0	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-63.1	125.3	176.2	-179.6	0	0	0	0	110.9	R295 H297 K298 H301	C293-R295 PolarHBondContact O-N 3.33Å; C293-R295 VanDerWaalsContact O-N 3.11Å; C293-R295 PolarHBondContact SG-N 2.86Å; C293-R295 VanDerWaalsContact SG-N 3.41Å; C293-H297 VanDerWaalsContact O-CA 3.24Å; C293-H297 WeakPolarHBondContact O-CA 3.24Å; C293-H297 PolarHBondContact O-N 3.08Å; C293-K298 WeakPolarHBondContact CB-O 3.43Å; C293-K298 PolarHBondContact N-O 2.73Å; C293-H301 WeakPolarHBondContact CA-O 3.22Å; C293-H301 WeakPolarHBondContact CB-NE2 3.33Å; C293-H301 WeakPolarHBondContact CB-O 3.48Å; C293-H301 PolarHBondContact SG-NE2 3.13Å
294	H	89.8	Confident	90.5	Very high	96 Å²	96	93.3 Å²	93.3	44%	0.444	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-11.2	177.8	-57.7	-83.2	0	0	0	114	L292 S303 Y315	L292-H294 PolarHBondContact O-N 3.07Å; H294-S303 WeakPolarHBondContact CB-OG 2.97Å; H294-S303 PolarHBondContact N-OG 2.73Å; H294-Y315 HydrophobicContact CB-CD2 4.31Å; H294-Y315 HydrophobicContact CB-CE2 3.9Å; H294-Y315 AromaticContact CG-CE2 3.9Å; H294-Y315 AromaticContact ND1-CE2 3.22Å; H294-Y315 WeakPolarHBondContact ND1-CE2 3.35Å; H294-Y315 AromaticContact ND1-CZ 3.45Å; H294-Y315 PolarHBondContact ND1-OH 3.11Å; H294-Y315 VanDerWaalsContact ND1-OH 3.13Å
295	R	87.6	Confident	90.7	Very high	94 Å²	94	89.5 Å²	89.5	36%	0.355	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-43	177.8	-174.8	-177.6	-69.6	168.6	-4.4	113.4	C293 C306	C293-R295 PolarHBondContact O-N 3.33Å; C293-R295 VanDerWaalsContact O-N 3.11Å; C293-R295 PolarHBondContact SG-N 2.86Å; C293-R295 VanDerWaalsContact SG-N 3.41Å; R295-C306 HydrophobicContact CB-CB 4.35Å
296	C	92.5	Very high	90.9	Very high	18 Å²	18	82.1 Å²	82.1	12%	0.122	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-2.5	-173.1	76.6	0	0	0	0	114.5	K298 H301 C306 S308 L310	C296-K298 PolarHBondContact O-N 3.35Å; C296-K298 PolarHBondContact SG-N 3.45Å; C296-H301 PolarHBondContact SG-CE1 3.33Å; C296-H301 PolarHBondContact SG-NE2 3.43Å; C296-C306 VanDerWaalsContact SG-SG 3.62Å; C296-S308 WeakPolarHBondContact CB-OG 3.04Å; C296-L310 HydrophobicContact CB-CD1 4.2Å
297	H	88.7	Confident	90.7	Very high	140 Å²	140	93 Å²	93	65%	0.648	42%	0.415	S	S	*	.			trans	56.8	18.5	-178.6	-53.6	-76.5	0	0	0	115.1	C293	C293-H297 VanDerWaalsContact O-CA 3.24Å; C293-H297 WeakPolarHBondContact O-CA 3.24Å; C293-H297 PolarHBondContact O-N 3.08Å
298	K	89.5	Confident	90.5	Very high	149 Å²	149	83.4 Å²	83.4	65%	0.648	39%	0.385	S	S	*	.			trans	-93	150.4	171.6	-59	-179.8	-178	-175	0	110.7	C293 C296	C293-K298 WeakPolarHBondContact CB-O 3.43Å; C293-K298 PolarHBondContact N-O 2.73Å; C296-K298 PolarHBondContact O-N 3.35Å; C296-K298 PolarHBondContact SG-N 3.45Å
299	K	91	Very high	90	Very high	141 Å²	141	86.9 Å²	86.9	61%	0.613	42%	0.416	S	S	*	.	B	Isolated β-bridge	trans	-68.7	166.7	177.9	-69	-175.2	177.6	-176.2	0	112	L291 L292 H301	L291-K299 CarbonylContact O-C 3.51Å; L291-K299 WeakPolarHBondContact O-CA 3.38Å; L292-K299 HydrophobicContact CD2-CG 3.51Å; L292-K299 HydrophobicContact CG-CG 4.46Å; K299-H301 PolarHBondContact O-ND1 3.03Å
300	E	89	Confident	89.2	Confident	100 Å²	100	86.9 Å²	86.9	47%	0.467	42%	0.42	S	S	.	.	S	Bend	trans	79.2	11	165.2	-43.7	-154.9	145.7	0	0	117.6	R275 K289 L291	R275-E300 WeakPolarHBondContact CA-O 3.35Å; R275-E300 WeakPolarHBondContact CB-O 3.48Å; R275-E300 VanDerWaalsContact CD-O 3.28Å; R275-E300 WeakPolarHBondContact CD-O 3.35Å; R275-E300 WeakPolarHBondContact CG-O 3.46Å; R275-E300 IonicContact CZ-OE1 3.65Å; R275-E300 IonicContact CZ-OE2 2.9Å; R275-E300 IonicContact NE-OE2 3.68Å; R275-E300 IonicContact NH2-OE1 3.57Å; R275-E300 PolarHBondContact NH2-OE1 3.04Å; R275-E300 IonicContact NH2-OE2 2.74Å; R275-E300 PolarHBondContact NH2-OE2 3.09Å; K289-E300 WeakPolarHBondContact O-CA 3.2Å; L291-E300 PolarHBondContact O-N 3.14Å
301	H	93.8	Very high	88.1	Confident	31 Å²	31	85 Å²	85	14%	0.144	42%	0.42	C	S	.	.			trans	-158	155.7	175.6	65.6	-73.6	0	0	0	114.9	R275 C293 C296 K299 V305 C306	R275-H301 VanDerWaalsContact O-CA 3.32Å; R275-H301 WeakPolarHBondContact O-CA 3.45Å; C293-H301 WeakPolarHBondContact CA-O 3.22Å; C293-H301 WeakPolarHBondContact CB-NE2 3.33Å; C293-H301 WeakPolarHBondContact CB-O 3.48Å; C293-H301 PolarHBondContact SG-NE2 3.13Å; C296-H301 PolarHBondContact SG-CE1 3.33Å; C296-H301 PolarHBondContact SG-NE2 3.43Å; K299-H301 PolarHBondContact O-ND1 3.03Å; H301-V305 HydrophobicContact CB-CG2 3.75Å; H301-C306 PolarHBondContact NE2-SG 2.6Å
302	V	92.8	Very high	86.6	Confident	23 Å²	23	88.2 Å²	88.2	14%	0.139	44%	0.442	C	S	.	.			trans	-83.8	155.7	172.3	-58.6	0	0	0	0	111.7	R275 C276 F288 L291 K304 V305 C306	R275-V302 PolarHBondContact O-N 2.91Å; C276-V302 HydrophobicContact CB-CG1 4.45Å; F288-V302 HydrophobicContact CB-CG1 4.11Å; F288-V302 HydrophobicContact CD1-CG1 3.81Å; F288-V302 HydrophobicContact CD2-CG1 4.02Å; F288-V302 HydrophobicContact CE1-CG1 4.12Å; F288-V302 HydrophobicContact CE2-CG1 4.31Å; F288-V302 HydrophobicContact CG-CG1 3.7Å; F288-V302 HydrophobicContact CZ-CG1 4.34Å; L291-V302 HydrophobicContact CD2-CG1 3.82Å; V302-K304 HydrophobicContact CG2-CB 3.97Å; V302-K304 PolarHBondContact O-N 3.5Å; V302-V305 HydrophobicContact CG2-CG2 3.99Å; V302-V305 WeakPolarHBondContact O-CG2 3.24Å; V302-V305 PolarHBondContact O-N 3.3Å; V302-C306 PolarHBondContact O-N 3.34Å
303	S	91.1	Very high	84.6	Confident	33 Å²	33	89.6 Å²	89.6	23%	0.231	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-53.4	-30.2	178.3	-54	0	0	0	0	114	H294 V305 C306	H294-S303 WeakPolarHBondContact CB-OG 2.97Å; H294-S303 PolarHBondContact N-OG 2.73Å; S303-V305 VanDerWaalsContact C-N 3.3Å; S303-V305 PolarHBondContact O-N 3.2Å; S303-C306 VanDerWaalsContact O-CB 3.26Å; S303-C306 WeakPolarHBondContact O-CB 3.4Å; S303-C306 PolarHBondContact O-N 2.98Å
304	K	89.6	Confident	82.5	Confident	166 Å²	166	95.1 Å²	95.1	72%	0.722	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-61.8	-32.5	178.6	-171.5	-179.1	177.5	-172.4	0	113.6	D277 V302	D277-K304 IonicContact OD2-NZ 3.85Å; V302-K304 HydrophobicContact CG2-CB 3.97Å; V302-K304 PolarHBondContact O-N 3.5Å
305	V	91.5	Very high	80.5	Confident	35 Å²	35	97.6 Å²	97.6	21%	0.212	50%	0.5	C	S	.	.	G	3₁₀ helix	trans	-107.1	13.2	-179.9	-58.6	0	0	0	0	112.3	D277 H301 V302 S303 R307	D277-V305 HydrophobicContact CB-CG1 3.67Å; H301-V305 HydrophobicContact CB-CG2 3.75Å; V302-V305 HydrophobicContact CG2-CG2 3.99Å; V302-V305 WeakPolarHBondContact O-CG2 3.24Å; V302-V305 PolarHBondContact O-N 3.3Å; S303-V305 VanDerWaalsContact C-N 3.3Å; S303-V305 PolarHBondContact O-N 3.2Å; V305-R307 PolarHBondContact O-N 2.82Å
306	C	92.6	Very high	78.6	Confident	14 Å²	14	102 Å²	102	10%	0.095	53%	0.525	C	S	.	.			trans	-72.1	123.6	-177.4	-168.5	0	0	0	0	111.2	R295 C296 H301 V302 S303 S308	R295-C306 HydrophobicContact CB-CB 4.35Å; C296-C306 VanDerWaalsContact SG-SG 3.62Å; H301-C306 PolarHBondContact NE2-SG 2.6Å; V302-C306 PolarHBondContact O-N 3.34Å; S303-C306 VanDerWaalsContact O-CB 3.26Å; S303-C306 WeakPolarHBondContact O-CB 3.4Å; S303-C306 PolarHBondContact O-N 2.98Å; C306-S308 PolarHBondContact SG-OG 3.05Å
307	R	88.4	Confident	76.1	Confident	230 Å²	230	109.3 Å²	109.3	87%	0.868	56%	0.557	S	S	*	*			trans	-93.6	10.1	179.6	-61.2	-177.6	178	-176.4	-1.6	113.9	V305	V305-R307 PolarHBondContact O-N 2.82Å
308	S	86.5	Confident	73.9	Confident	35 Å²	35	112 Å²	112	25%	0.245	57%	0.569	C	S	.	*			trans	-77.4	134.7	178.6	63.8	0	0	0	0	111.4	C296 C306 L310	C296-S308 WeakPolarHBondContact CB-OG 3.04Å; C306-S308 PolarHBondContact SG-OG 3.05Å; S308-L310 PolarHBondContact O-N 3.18Å; S308-L310 VanDerWaalsContact O-N 3.07Å
309	S	79.8	Confident	71.6	Confident	130 Å²	130	110.1 Å²	110.1	91%	0.909	58%	0.575	S	S	*	*			trans	-75.1	19.6	173.7	-45.5	0	0	0	0	114.3
310	L	72.8	Confident	69	Low	95 Å²	95	108 Å²	108	50%	0.497	58%	0.584	S	S	.	*			trans	-71	138.2	179.9	-69.7	168.8	0	0	0	110.4	C296 S308	C296-L310 HydrophobicContact CB-CD1 4.2Å; S308-L310 PolarHBondContact O-N 3.18Å; S308-L310 VanDerWaalsContact O-N 3.07Å
311	P	66.3	Low	66.8	Low	102 Å²	102	111.5 Å²	111.5	66%	0.662	60%	0.604	S	S	*	*			trans	-56.1	146.9	173.9	-19.7	30.6	0	0	0	111.2	T313	P311-T313 PolarHBondContact O-N 3.27Å
312	T	58.4	Low	64.1	Low	125 Å²	125	120 Å²	120	77%	0.767	64%	0.641	S	S	*	*			trans	-74.6	87.5	177	-55.1	0	0	0	0	109.1
313	T	52.2	Low	61.5	Low	125 Å²	125	122.5 Å²	122.5	77%	0.767	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-92	130.3	170.8	30.6	0	0	0	0	110.7	P311	P311-T313 PolarHBondContact O-N 3.27Å
314	S	49	Very low	58.8	Low	115 Å²	115	128.3 Å²	128.3	80%	0.804	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-60.7	133.5	178.8	48	0	0	0	0	111.9	Q316	S314-Q316 PolarHBondContact O-N 3.37Å
315	Y	46.9	Very low	56.5	Low	149 Å²	149	124.5 Å²	124.5	58%	0.584	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-58	121.9	179.8	-151.1	-103.1	0	0	0	112.1	H294 Q317	H294-Y315 HydrophobicContact CB-CD2 4.31Å; H294-Y315 HydrophobicContact CB-CE2 3.9Å; H294-Y315 AromaticContact CG-CE2 3.9Å; H294-Y315 AromaticContact ND1-CE2 3.22Å; H294-Y315 WeakPolarHBondContact ND1-CE2 3.35Å; H294-Y315 AromaticContact ND1-CZ 3.45Å; H294-Y315 PolarHBondContact ND1-OH 3.11Å; H294-Y315 VanDerWaalsContact ND1-OH 3.13Å; Y315-Q317 HydrophobicContact CD1-CB 4.42Å; Y315-Q317 HydrophobicContact CE1-CB 4.38Å; Y315-Q317 HydrophobicContact CE1-CG 4.47Å
316	Q	48.6	Very low	54	Low	187 Å²	187	134.7 Å²	134.7	87%	0.874	73%	0.729	S	S	*	*			trans	-106.8	131.1	154.7	-79.1	-176.4	-14	0	0	108.1	S314	S314-Q316 PolarHBondContact O-N 3.37Å
317	Q	40.1	Very low	51.4	Low	170 Å²	170	137.8 Å²	137.8	79%	0.794	76%	0.764	S	S	*	*			trans	-92.9	101.7	-170	-168.9	176.9	30.1	0	0	108.1	Y315	Y315-Q317 HydrophobicContact CD1-CB 4.42Å; Y315-Q317 HydrophobicContact CE1-CB 4.38Å; Y315-Q317 HydrophobicContact CE1-CG 4.47Å
318	E	41.7	Very low	49.5	Very low	196 Å²	196	133.5 Å²	133.5	92%	0.916	76%	0.763	S	S	*	*			trans	-103.2	105.3	168.8	-85.8	-178.1	161.6	0	0	110.2
319	S	42.5	Very low	47.2	Very low	110 Å²	110	137.9 Å²	137.9	77%	0.769	78%	0.784	S	S	*	*			trans	-64.2	124.7	167.4	35.7	0	0	0	0	111.1
320	A	36.3	Very low	45.5	Very low	97 Å²	97	142.5 Å²	142.5	80%	0.802	78%	0.781	S	S	*	*			trans	-1.9	116.7	156.4	0	0	0	0	0	117.6
321	I	41.9	Very low	43.9	Very low	174 Å²	174	149.6 Å²	149.6	89%	0.892	80%	0.802	S	S	*	*			trans	-134.2	122.1	139.6	-59.4	-176.2	0	0	0	109.3
322	F	37.4	Very low	42.7	Very low	210 Å²	210	156.8 Å²	156.8	92%	0.921	82%	0.815	S	S	*	*			trans	-68.7	136.5	178.9	-155.8	-99.4	0	0	0	110.4
323	G	37.3	Very low	42.2	Very low	75 Å²	75	155.4 Å²	155.4	77%	0.773	81%	0.811	S	S	*	*			trans	172.9	74.4	177.5	0	0	0	0	0	117
324	N	35.3	Very low	42.3	Very low	154 Å²	154	156.2 Å²	156.2	82%	0.824	82%	0.816	S	S	*	*			trans	-10.6	143.9	161.7	-107.9	-3.6	0	0	0	121.3
325	S	40.7	Very low	42.3	Very low	87 Å²	87	158.8 Å²	158.8	61%	0.608	81%	0.814	S	S	*	*			trans	101.3	113.6	133.7	-68.4	0	0	0	0	120.4
326	R	38.5	Very low	42.1	Very low	248 Å²	248	156.3 Å²	156.3	94%	0.936	83%	0.825	S	S	*	*			trans	79.6	110.6	138.8	-64.4	173.6	-179.6	179	-0.5	117.6
327	G	39.4	Very low	42.5	Very low	80 Å²	80	154.1 Å²	154.1	83%	0.825	82%	0.824	S	S	*	*			trans	173.2	93.7	162.5	0	0	0	0	0	111.4
328	T	48.2	Very low	42.9	Very low	139 Å²	139	154.6 Å²	154.6	85%	0.853	83%	0.826	S	S	*	*			trans	-65.1	131.1	-178.7	47	0	0	0	0	113.2
329	D	38	Very low	43	Very low	128 Å²	128	154.1 Å²	154.1	68%	0.684	82%	0.824	S	S	*	*			trans	31.6	116.3	131.3	-161	24.1	0	0	0	118.7
330	R	43.9	Very low	43.3	Very low	227 Å²	227	155.1 Å²	155.1	86%	0.857	83%	0.825	S	S	*	*				-179.8	129.3	109.1	-97.5	173.5	178.5	-179.7	-1.5	114
331	R	39.1	Very low	43.5	Very low	244 Å²	244	156.7 Å²	156.7	92%	0.921	83%	0.827	S	S	*	*			trans	-46.2	136.4	167.1	-75.8	172.3	164.8	-167.1	-5	113.1
332	R	41.1	Very low	44	Very low	252 Å²	252	154.3 Å²	154.3	95%	0.951	83%	0.826	S	S	*	*			trans	-98.3	114.1	156	-104.9	177.8	177.1	172.7	-0.8	109.8
333	S	48.4	Very low	44.3	Very low	97 Å²	97	156 Å²	156	68%	0.678	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-77.7	134.9	163.5	-179.4	0	0	0	0	108.8
334	V	54.2	Low	44.6	Very low	142 Å²	142	159.9 Å²	159.9	86%	0.861	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-84.1	121.7	173.9	177.6	0	0	0	0	108
335	H	48.1	Very low	45	Very low	168 Å²	168	158.5 Å²	158.5	78%	0.778	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-81.7	135	177.3	-84.1	-79.6	0	0	0	111.4
336	A	44	Very low	45	Very low	98 Å²	98	160.5 Å²	160.5	81%	0.81	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-74.1	140.6	163.6	0	0	0	0	0	109.9
337	V	55.7	Low	45.1	Very low	140 Å²	140	153.1 Å²	153.1	85%	0.848	83%	0.828	S	S	*	*			trans	-95.1	115.6	177.7	175.1	0	0	0	0	108.7
338	E	49.9	Very low	45.2	Very low	181 Å²	181	155 Å²	155	85%	0.846	82%	0.824	S	S	*	*			trans	-92.1	133.8	170	-130	169.4	-169.9	0	0	108.9
339	Q	42.7	Very low	45.4	Very low	186 Å²	186	159.8 Å²	159.8	87%	0.869	83%	0.826	S	S	*	*			trans	-87.7	124.4	174.7	-69.4	176.7	-7.3	0	0	109.2
340	T	50.3	Low	45.6	Very low	130 Å²	130	163.1 Å²	163.1	80%	0.798	84%	0.837	S	S	*	*			trans	-118.4	141	164.8	45.2	0	0	0	0	110.7
341	P	39	Very low	46.5	Very low	130 Å²	130	157.6 Å²	157.6	84%	0.844	83%	0.834	S	S	*	*			trans	-93.6	145.7	-176.9	35.8	-30.8	0	0	0	111.4
342	S	52.8	Low	47.1	Very low	124 Å²	124	155 Å²	155	87%	0.867	83%	0.832	S	S	*	*			trans	-146	138.9	166.3	58.6	0	0	0	0	112.5
343	R	44.4	Very low	48.3	Very low	247 Å²	247	150.7 Å²	150.7	93%	0.932	83%	0.828	S	S	*	*			trans	-67.1	152.3	-171.9	-70.9	162	156.8	168.8	-8.1	114.9
344	D	42.9	Very low	48.9	Very low	156 Å²	156	153.6 Å²	153.6	83%	0.834	84%	0.836	S	S	*	*			trans	-49.5	170.1	155.7	-75.1	-48.1	0	0	0	113.6
345	P	43.7	Very low	49	Very low	124 Å²	124	158.7 Å²	158.7	81%	0.805	86%	0.857	S	S	*	*			cis	-142.7	164.4	23.7	37.3	-16.2	0	0	0	117.3
346	C	39.9	Very low	49	Very low	130 Å²	130	158.2 Å²	158.2	88%	0.878	86%	0.861	S	S	*	*			trans	-143.8	124.4	158.3	-157.8	0	0	0	0	112.3
347	S	40.7	Very low	49.3	Very low	93 Å²	93	161.4 Å²	161.4	65%	0.65	86%	0.863	S	S	*	*			trans	-84	170.5	179.1	46.5	0	0	0	0	113.3
348	T	41.5	Very low	48.9	Very low	119 Å²	119	162.6 Å²	162.6	73%	0.73	86%	0.864	S	S	*	*			trans	78.7	134.2	173.1	67	0	0	0	0	112.3
349	W	52.6	Low	48.9	Very low	240 Å²	240	161.5 Å²	161.5	91%	0.909	87%	0.865	S	S	*	*				-144.3	136.8	50.4	-78.1	38.2	0	0	0	111.4
350	E	43.5	Very low	49.2	Very low	197 Å²	197	159.9 Å²	159.9	92%	0.921	87%	0.865	S	S	*	*			trans	-77.4	139	161.1	-71	169.7	125.2	0	0	109
351	S	61.4	Low	49.2	Very low	111 Å²	111	161.9 Å²	161.9	78%	0.776	87%	0.87	S	S	*	*			trans	-145.2	107.9	158.8	61.9	0	0	0	0	108.3
352	E	52.1	Low	49.9	Very low	191 Å²	191	164.2 Å²	164.2	89%	0.893	87%	0.871	S	S	*	*			trans	-68.7	136.7	161	-63.5	171.7	116.7	0	0	108.5
353	D	66.6	Low	49.7	Very low	160 Å²	160	167.3 Å²	167.3	86%	0.856	87%	0.872	S	S	*	*			trans	-148.3	125.3	156.8	-92.2	-39.1	0	0	0	108.4
354	D	60.2	Low	50.1	Low	158 Å²	158	160.7 Å²	160.7	85%	0.845	87%	0.867	S	S	*	*			trans	-61.9	142.7	-175.7	-69.2	-65.3	0	0	0	114.7
355	L	56.3	Low	50.8	Low	249 Å²	249	161.1 Å²	161.1	100%	1.304	87%	0.87	S	S	*	*				-173.5	0	129.5	-97.9	174.5	0	0	0	112.2

Retrieved 355 of 355 residues in 369.3 ms (Link to these results)

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