A0A087Y1Z4_POEFO Loading...

Rho GTPase activating protein 18

AlphaFold DB , UniProt , Accession A0A087Y1Z4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 631 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	S	33.7	Very low	32.8	Very low	171 Å²	171	164.5 Å²	164.5	100%	1.196	85%	0.849	S	S	*	*				0	122.2	0	-76.1	0	0	0	0	111
2	R	34.8	Very low	32.4	Very low	240 Å²	240	163.3 Å²	163.3	91%	0.906	85%	0.845	S	S	*	*			trans	50.6	101.8	157.2	-60.3	179.8	178.1	-179.3	-1.7	117.4
3	K	37.1	Very low	32	Very low	199 Å²	199	165.3 Å²	165.3	87%	0.865	85%	0.848	S	S	*	*				54.2	126.7	76.9	-76.4	-167.4	175.5	-176.9	0	112.1
4	T	36.6	Very low	31.9	Very low	137 Å²	137	161.6 Å²	161.6	84%	0.84	84%	0.844	S	S	*	*				-172.5	139.7	57.2	36.6	0	0	0	0	109.9
5	G	34.8	Very low	32.4	Very low	71 Å²	71	158.4 Å²	158.4	73%	0.732	84%	0.837	S	S	*	*				104.4	146.2	88.9	0	0	0	0	0	110.5
6	H	32.8	Very low	32.1	Very low	161 Å²	161	162.4 Å²	162.4	75%	0.745	84%	0.838	S	S	*	*			cis	-173.2	150.3	13.5	-116.3	-38.2	0	0	0	111.5
7	Y	31.4	Very low	31.9	Very low	188 Å²	188	162.6 Å²	162.6	74%	0.737	83%	0.833	S	S	*	*			trans	72.4	109.3	144.8	-72.7	-66.2	0	0	0	126.4
8	S	29.3	Very low	31.8	Very low	98 Å²	98	159.6 Å²	159.6	69%	0.685	83%	0.829	S	S	*	*				17.1	143.1	126.3	-47.9	0	0	0	0	124.7
9	L	30.2	Very low	32.3	Very low	175 Å²	175	156.9 Å²	156.9	92%	0.916	82%	0.822	S	S	*	*				-176.5	133.1	112.4	-98.4	151.7	0	0	0	113.3
10	E	29.4	Very low	32.2	Very low	176 Å²	176	156.6 Å²	156.6	82%	0.822	82%	0.821	S	S	*	*			trans	-81.6	152.3	168.3	-65.5	-175.2	146.5	0	0	111.9
11	H	30.2	Very low	32.2	Very low	194 Å²	194	156 Å²	156	90%	0.898	82%	0.824	S	S	*	*			trans	-157.3	135.5	141.9	-112	43.7	0	0	0	113.4
12	N	28.6	Very low	32.3	Very low	149 Å²	149	157.9 Å²	157.9	80%	0.797	81%	0.811	S	S	*	*			trans	-64.7	149.9	174.7	-86.5	-44.3	0	0	0	113.7
13	Q	27.8	Very low	32.2	Very low	190 Å²	190	152.2 Å²	152.2	89%	0.888	81%	0.806	S	S	*	*				162.5	130.5	116.1	-86.3	176.9	18.3	0	0	112.8
14	S	30.5	Very low	32.1	Very low	113 Å²	113	154.4 Å²	154.4	79%	0.79	81%	0.808	S	S	*	*			trans	-64.1	162.5	167.3	-39.7	0	0	0	0	112
15	P	38.9	Very low	31.9	Very low	114 Å²	114	153.5 Å²	153.5	74%	0.74	81%	0.805	S	S	*	*				-156.7	156.5	73.3	38.9	-16.8	0	0	0	119
16	R	27.7	Very low	31.9	Very low	223 Å²	223	158.5 Å²	158.5	84%	0.842	81%	0.809	S	S	*	*			trans	56.7	129	135.8	-70.5	-176	-179.1	-173.7	1.3	124
17	H	28.8	Very low	31.8	Very low	166 Å²	166	156.9 Å²	156.9	77%	0.769	81%	0.813	S	S	*	*			trans	108.3	116.7	138.4	-73.9	-57.3	0	0	0	121.1
18	S	30.3	Very low	31.8	Very low	108 Å²	108	154.4 Å²	154.4	76%	0.755	82%	0.818	S	S	*	*			trans	-58	-174.4	175.5	-37.9	0	0	0	0	115.7
19	P	40.9	Very low	31.8	Very low	108 Å²	108	155.7 Å²	155.7	70%	0.701	83%	0.825	S	S	*	*			cis	-142.8	163.6	8.1	39.8	-19.6	0	0	0	117.9
20	N	29.8	Very low	31.7	Very low	150 Å²	150	156.1 Å²	156.1	80%	0.802	82%	0.823	S	S	*	*			trans	142	97.8	138.4	-83.9	-21.4	0	0	0	113.6
21	T	32.3	Very low	31.7	Very low	144 Å²	144	156.6 Å²	156.6	88%	0.883	82%	0.817	S	S	*	*			trans	-169	122.8	130.1	21	0	0	0	0	108.4
22	K	37.2	Very low	31.5	Very low	211 Å²	211	152.3 Å²	152.3	92%	0.917	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-77	132.3	-176.1	-68.2	173.4	175.6	176.5	0	111.7
23	P	31.7	Very low	31.7	Very low	122 Å²	122	154.4 Å²	154.4	79%	0.792	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-95.4	144.5	150.4	6.6	13.2	0	0	0	110.6
24	R	34.3	Very low	32.2	Very low	244 Å²	244	150.2 Å²	150.2	92%	0.921	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-69.8	141	-178.3	-157.5	173.8	-174.9	179.8	0.1	110.4
25	P	32.3	Very low	32.2	Very low	118 Å²	118	151.5 Å²	151.5	77%	0.766	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-80.7	132.6	-172.4	22.4	-16.1	0	0	0	112.5
26	Q	35.8	Very low	32.1	Very low	176 Å²	176	153.8 Å²	153.8	82%	0.822	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-70.2	134.7	156.2	-78.2	179.6	-25.3	0	0	108.8	T28	Q26-T28 PolarHBondContact O-N 2.84Å
27	P	30.7	Very low	32.7	Very low	128 Å²	128	147 Å²	147	83%	0.831	79%	0.789	S	S	*	*			trans	-79.8	107.8	171.3	30.2	-28.7	0	0	0	109.7	C29	P27-C29 PolarHBondContact O-N 3.4Å
28	T	31.4	Very low	32.9	Very low	136 Å²	136	147.1 Å²	147.1	83%	0.834	80%	0.795	S	S	*	*			trans	-74.1	107.7	161.9	47	0	0	0	0	108.8	Q26	Q26-T28 PolarHBondContact O-N 2.84Å
29	C	29.2	Very low	33.5	Very low	124 Å²	124	148.2 Å²	148.2	84%	0.838	79%	0.792	S	S	*	*			trans	-99.5	119.7	164.1	-165.5	0	0	0	0	108.7	P27 R31	P27-C29 PolarHBondContact O-N 3.4Å; C29-R31 PolarHBondContact O-N 3.2Å
30	Q	27.3	Very low	34	Very low	185 Å²	185	148.9 Å²	148.9	86%	0.864	79%	0.786	S	S	*	*			trans	-64.1	120.5	172.3	-75.8	174.4	-26.6	0	0	109	S32	Q30-S32 PolarHBondContact O-N 2.92Å; Q30-S32 VanDerWaalsContact O-N 3.09Å
31	R	30.2	Very low	35.3	Very low	185 Å²	185	143.4 Å²	143.4	70%	0.698	76%	0.756	S	S	*	*			trans	-71.7	98.9	-179.4	-141.7	177.8	-171.6	177	2	109.1	C29	C29-R31 PolarHBondContact O-N 3.2Å
32	S	25.5	Very low	37.2	Very low	105 Å²	105	144.2 Å²	144.2	73%	0.734	75%	0.75	S	S	*	*			trans	-70.4	121.2	159.4	-157.6	0	0	0	0	107.2	Q30 S34	Q30-S32 PolarHBondContact O-N 2.92Å; Q30-S32 VanDerWaalsContact O-N 3.09Å; S32-S34 VanDerWaalsContact C-N 3.35Å; S32-S34 PolarHBondContact O-N 3.44Å
33	F	33.1	Very low	39.6	Very low	193 Å²	193	134.6 Å²	134.6	85%	0.846	71%	0.709	S	S	*	*	S	Bend	trans	-73.7	88.4	179.5	-76.5	-89.9	0	0	0	110.1
34	S	37.9	Very low	42.3	Very low	102 Å²	102	134 Å²	134	71%	0.713	70%	0.698	S	S	*	*			trans	-149	91.6	150.5	65.6	0	0	0	0	107.6	S32	S32-S34 VanDerWaalsContact C-N 3.35Å; S32-S34 PolarHBondContact O-N 3.44Å
35	Q	31.3	Very low	44.9	Very low	139 Å²	139	123.9 Å²	123.9	65%	0.65	66%	0.663	S	S	*	*			trans	-128.3	96.1	171.5	-81.6	-173.4	-57.5	0	0	107.8
36	D	36.6	Very low	47.7	Very low	162 Å²	162	118.4 Å²	118.4	87%	0.866	63%	0.627	S	S	*	*			trans	-56.5	152.5	143.2	-83.4	-42.2	0	0	0	109
37	S	41.1	Very low	50.3	Low	82 Å²	82	114 Å²	114	57%	0.573	60%	0.603	S	S	*	*			trans	89.9	84.6	178.9	95.6	0	0	0	0	116.9
38	L	32.9	Very low	53.1	Low	168 Å²	168	113 Å²	113	88%	0.88	59%	0.585	S	S	*	*			trans	-134.2	51.7	161.8	-76.1	178.8	0	0	0	110.5
39	D	41.5	Very low	56	Low	131 Å²	131	106.8 Å²	106.8	70%	0.701	55%	0.547	S	S	*	.			trans	-153.7	78.1	162	-90.5	-27.2	0	0	0	107.9
40	E	52.4	Low	58.8	Low	122 Å²	122	101.4 Å²	101.4	57%	0.57	51%	0.51	S	S	*	.			trans	-117.3	132.4	167.9	-70	-173.3	167	0	0	106.9	E42 F473	E40-E42 PolarHBondContact O-N 2.81Å; E40-E42 VanDerWaalsContact O-N 3.12Å; E40-F473 WeakPolarHBondContact OE2-CZ 3.39Å
41	L	56.8	Low	61.7	Low	34 Å²	34	98.6 Å²	98.6	18%	0.178	50%	0.496	C	S	.	.			trans	-45	123.2	174.5	-52.5	168.2	0	0	0	108.2	M43 N447 T477 A480	L41-M43 HydrophobicContact CB-SD 4.03Å; L41-M43 VanDerWaalsContact O-CG 3.25Å; L41-M43 WeakPolarHBondContact O-CG 3.37Å; L41-M43 PolarHBondContact O-N 3.43Å; L41-N447 VanDerWaalsContact CD2-OD1 3.25Å; L41-N447 WeakPolarHBondContact CD2-OD1 3.31Å; L41-T477 HydrophobicContact CD1-CG2 4.31Å; L41-A480 HydrophobicContact CD1-CB 4.49Å
42	E	71.4	Confident	64.3	Low	162 Å²	162	92.1 Å²	92.1	76%	0.757	48%	0.476	S	S	*	.			trans	-59.6	105.9	178.3	-70.7	-178	170.9	0	0	109.2	E40 D44	E40-E42 PolarHBondContact O-N 2.81Å; E40-E42 VanDerWaalsContact O-N 3.12Å; E42-D44 VanDerWaalsContact C-N 3.3Å; E42-D44 PolarHBondContact O-N 3.16Å
43	M	87.9	Confident	67.2	Low	9 Å²	9	88 Å²	88	4%	0.044	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	3.7	-173.2	-64.6	-51.9	-74.2	0	0	113.4	L41 D45 Y46 W47 V451 F473 A476 A480	L41-M43 HydrophobicContact CB-SD 4.03Å; L41-M43 VanDerWaalsContact O-CG 3.25Å; L41-M43 WeakPolarHBondContact O-CG 3.37Å; L41-M43 PolarHBondContact O-N 3.43Å; M43-D45 VanDerWaalsContact C-N 3.26Å; M43-D45 PolarHBondContact O-N 3.33Å; M43-Y46 HydrophobicContact CE-CD1 4.32Å; M43-Y46 HydrophobicContact CE-CD2 3.75Å; M43-Y46 HydrophobicContact CE-CE2 4.48Å; M43-Y46 HydrophobicContact CE-CG 3.67Å; M43-Y46 WeakPolarHBondContact O-CA 3.49Å; M43-Y46 VanDerWaalsContact O-CB 3.25Å; M43-Y46 WeakPolarHBondContact O-CB 3.43Å; M43-Y46 PolarHBondContact O-N 2.92Å; M43-W47 PolarHBondContact O-N 3.18Å; M43-W47 VanDerWaalsContact O-N 3.13Å; M43-V451 HydrophobicContact SD-CG1 4.34Å; M43-V451 HydrophobicContact SD-CG2 4.28Å; M43-F473 HydrophobicContact CB-CE2 4.26Å; M43-F473 HydrophobicContact CG-CE2 4.01Å; M43-F473 HydrophobicContact CG-CZ 4.34Å; M43-A476 VanDerWaalsContact CE-C 3.5Å; M43-A476 HydrophobicContact CE-CB 3.48Å; M43-A476 VanDerWaalsContact CE-CB 3.48Å; M43-A480 HydrophobicContact CE-CB 4.42Å
44	D	88.4	Confident	69.5	Low	108 Å²	108	84.1 Å²	84.1	58%	0.578	43%	0.43	S	S	*	.	H	α-helix	trans	-56.3	-40.6	179.7	-76.1	-2.9	0	0	0	112.3	E42 Y46 W47 K48	E42-D44 VanDerWaalsContact C-N 3.3Å; E42-D44 PolarHBondContact O-N 3.16Å; D44-Y46 VanDerWaalsContact C-N 3.3Å; D44-Y46 PolarHBondContact O-N 2.74Å; D44-W47 PolarHBondContact O-N 3.44Å; D44-K48 WeakPolarHBondContact O-CB 3.38Å; D44-K48 VanDerWaalsContact O-CG 3.28Å; D44-K48 WeakPolarHBondContact O-CG 3.42Å; D44-K48 PolarHBondContact O-N 3.27Å
45	D	89.5	Confident	71.4	Confident	32 Å²	32	83.3 Å²	83.3	17%	0.171	42%	0.424	C	S	.	.	H	α-helix	trans	-70	-28.3	178.2	-78.1	-11.3	0	0	0	112.1	M43 K48 E49 R336 V451 V452	M43-D45 VanDerWaalsContact C-N 3.26Å; M43-D45 PolarHBondContact O-N 3.33Å; D45-K48 IonicContact OD1-NZ 2.64Å; D45-E49 WeakPolarHBondContact O-CB 3.35Å; D45-E49 PolarHBondContact O-N 2.93Å; D45-E49 VanDerWaalsContact O-N 3.14Å; D45-R336 WeakPolarHBondContact OD2-CD 3.32Å; D45-V451 HydrophobicContact CB-CG1 4.17Å; D45-V452 HydrophobicContact CB-CG2 3.98Å
46	Y	90.8	Very high	73.1	Confident	4 Å²	4	78.9 Å²	78.9	2%	0.016	41%	0.408	C	S	.	.	H	α-helix	trans	-65.2	-53.5	173	-177.4	-86.1	0	0	0	109.8	M43 D44 K48 E49 I50 V451 A454 P455 A476	M43-Y46 HydrophobicContact CE-CD1 4.32Å; M43-Y46 HydrophobicContact CE-CD2 3.75Å; M43-Y46 HydrophobicContact CE-CE2 4.48Å; M43-Y46 HydrophobicContact CE-CG 3.67Å; M43-Y46 WeakPolarHBondContact O-CA 3.49Å; M43-Y46 VanDerWaalsContact O-CB 3.25Å; M43-Y46 WeakPolarHBondContact O-CB 3.43Å; M43-Y46 PolarHBondContact O-N 2.92Å; D44-Y46 VanDerWaalsContact C-N 3.3Å; D44-Y46 PolarHBondContact O-N 2.74Å; Y46-K48 PolarHBondContact O-N 3.38Å; Y46-E49 WeakPolarHBondContact O-CA 3.43Å; Y46-E49 WeakPolarHBondContact O-CB 3.27Å; Y46-E49 PolarHBondContact O-N 2.74Å; Y46-I50 HydrophobicContact CD1-CD1 4.14Å; Y46-I50 HydrophobicContact CD1-CG1 3.84Å; Y46-I50 HydrophobicContact CE1-CD1 3.6Å; Y46-I50 HydrophobicContact CE1-CG1 3.7Å; Y46-I50 WeakPolarHBondContact O-CG1 3.46Å; Y46-I50 PolarHBondContact O-N 3.1Å; Y46-V451 WeakPolarHBondContact CD2-O 3.47Å; Y46-A454 HydrophobicContact CD2-CB 4.48Å; Y46-A454 HydrophobicContact CE2-CB 4.18Å; Y46-P455 HydrophobicContact CD2-CG 4.29Å; Y46-P455 HydrophobicContact CE2-CB 4.11Å; Y46-P455 HydrophobicContact CE2-CG 4.32Å; Y46-A476 HydrophobicContact CD1-CB 3.76Å; Y46-A476 HydrophobicContact CD2-CB 4.15Å; Y46-A476 HydrophobicContact CE1-CB 3.39Å; Y46-A476 HydrophobicContact CE2-CB 3.81Å; Y46-A476 HydrophobicContact CG-CB 4.14Å; Y46-A476 VanDerWaalsContact CZ-CB 3.43Å
47	W	90.1	Very high	74.1	Confident	82 Å²	82	73.4 Å²	73.4	31%	0.311	39%	0.39	S	S	.	.	H	α-helix	trans	-65.9	-38.6	-176.7	-61.8	116.7	0	0	0	112.5	M43 D44 E49 I50 E51 E472 F473 A476	M43-W47 PolarHBondContact O-N 3.18Å; M43-W47 VanDerWaalsContact O-N 3.13Å; D44-W47 PolarHBondContact O-N 3.44Å; W47-E49 VanDerWaalsContact C-N 3.25Å; W47-E49 PolarHBondContact O-N 3.05Å; W47-I50 HydrophobicContact CE3-CG1 3.91Å; W47-I50 HydrophobicContact CZ3-CG1 4.4Å; W47-I50 VanDerWaalsContact O-CB 3.29Å; W47-I50 WeakPolarHBondContact O-CB 3.4Å; W47-I50 PolarHBondContact O-N 3.44Å; W47-I50 VanDerWaalsContact O-N 3.11Å; W47-E51 WeakPolarHBondContact O-CG 3.31Å; W47-E51 PolarHBondContact O-N 2.98Å; W47-E472 HydrophobicContact CH2-CB 3.91Å; W47-F473 HydrophobicContact CZ2-CD2 4.2Å; W47-A476 HydrophobicContact CZ2-CB 4.41Å
48	K	90	Very high	74.1	Confident	108 Å²	108	72 Å²	72	47%	0.47	39%	0.389	S	S	.	.	H	α-helix	trans	-58.6	-39.7	170.2	-74	170.9	-168.9	160.4	0	111.9	D44 D45 Y46 E51 N52	D44-K48 WeakPolarHBondContact O-CB 3.38Å; D44-K48 VanDerWaalsContact O-CG 3.28Å; D44-K48 WeakPolarHBondContact O-CG 3.42Å; D44-K48 PolarHBondContact O-N 3.27Å; D45-K48 IonicContact OD1-NZ 2.64Å; Y46-K48 PolarHBondContact O-N 3.38Å; K48-E51 PolarHBondContact O-N 3.04Å; K48-N52 PolarHBondContact O-N 3.49Å; K48-N52 PolarHBondContact O-ND2 3.38Å
49	E	92.1	Very high	74.5	Confident	6 Å²	6	66.2 Å²	66.2	3%	0.028	37%	0.37	C	S	.	.	H	α-helix	trans	-67.9	-36.8	176	-174.7	66.4	179.5	0	0	111.8	D45 Y46 W47 E51 N52 I53 K375 P455 N456	D45-E49 WeakPolarHBondContact O-CB 3.35Å; D45-E49 PolarHBondContact O-N 2.93Å; D45-E49 VanDerWaalsContact O-N 3.14Å; Y46-E49 WeakPolarHBondContact O-CA 3.43Å; Y46-E49 WeakPolarHBondContact O-CB 3.27Å; Y46-E49 PolarHBondContact O-N 2.74Å; W47-E49 VanDerWaalsContact C-N 3.25Å; W47-E49 PolarHBondContact O-N 3.05Å; E49-E51 PolarHBondContact O-N 3.4Å; E49-N52 WeakPolarHBondContact O-CB 3.47Å; E49-N52 PolarHBondContact O-N 3.42Å; E49-I53 HydrophobicContact CG-CD1 4.11Å; E49-I53 WeakPolarHBondContact O-CD1 3.47Å; E49-I53 WeakPolarHBondContact O-CG1 3.32Å; E49-I53 PolarHBondContact O-N 2.79Å; E49-K375 WeakPolarHBondContact OE1-CD 3.44Å; E49-K375 VanDerWaalsContact OE1-CE 3.29Å; E49-K375 WeakPolarHBondContact OE1-CE 3.46Å; E49-K375 IonicContact OE1-NZ 3.96Å; E49-K375 PolarHBondContact OE1-NZ 3.47Å; E49-K375 IonicContact OE2-NZ 2.74Å; E49-K375 PolarHBondContact OE2-NZ 3.34Å; E49-P455 HydrophobicContact CB-CG 4.04Å; E49-P455 HydrophobicContact CG-CB 4.37Å; E49-P455 HydrophobicContact CG-CG 3.58Å; E49-N456 PolarHBondContact OE1-ND2 3.36Å
50	I	88.3	Confident	74.5	Confident	11 Å²	11	69 Å²	69	6%	0.056	38%	0.379	C	S	.	.	H	α-helix	trans	-55.5	-50.7	170.7	-58.5	-54.3	0	0	0	111.1	Y46 W47 N52 I53 E54 P455 M459	Y46-I50 HydrophobicContact CD1-CD1 4.14Å; Y46-I50 HydrophobicContact CD1-CG1 3.84Å; Y46-I50 HydrophobicContact CE1-CD1 3.6Å; Y46-I50 HydrophobicContact CE1-CG1 3.7Å; Y46-I50 WeakPolarHBondContact O-CG1 3.46Å; Y46-I50 PolarHBondContact O-N 3.1Å; W47-I50 HydrophobicContact CE3-CG1 3.91Å; W47-I50 HydrophobicContact CZ3-CG1 4.4Å; W47-I50 VanDerWaalsContact O-CB 3.29Å; W47-I50 WeakPolarHBondContact O-CB 3.4Å; W47-I50 PolarHBondContact O-N 3.44Å; W47-I50 VanDerWaalsContact O-N 3.11Å; I50-N52 VanDerWaalsContact C-N 3.3Å; I50-N52 PolarHBondContact O-N 2.95Å; I50-I53 WeakPolarHBondContact O-CB 3.43Å; I50-I53 PolarHBondContact O-N 3.12Å; I50-I53 VanDerWaalsContact O-N 3.11Å; I50-E54 HydrophobicContact CG2-CG 4.49Å; I50-E54 VanDerWaalsContact CG2-OE1 3.25Å; I50-E54 WeakPolarHBondContact CG2-OE1 3.5Å; I50-E54 WeakPolarHBondContact O-CG 3.33Å; I50-E54 PolarHBondContact O-N 2.87Å; I50-P455 HydrophobicContact CD1-CB 3.85Å; I50-M459 HydrophobicContact CD1-CE 2.94Å; I50-M459 HydrophobicContact CD1-SD 3.67Å; I50-M459 HydrophobicContact CG1-CE 4.45Å
51	E	87.5	Confident	73.7	Confident	125 Å²	125	66.9 Å²	66.9	58%	0.584	39%	0.389	S	S	*	.	H	α-helix	trans	-61.4	-39.3	179.1	-68.3	175.1	-175.7	0	0	111.7	W47 K48 E49 I53 E54 S55	W47-E51 WeakPolarHBondContact O-CG 3.31Å; W47-E51 PolarHBondContact O-N 2.98Å; K48-E51 PolarHBondContact O-N 3.04Å; E49-E51 PolarHBondContact O-N 3.4Å; E51-I53 VanDerWaalsContact C-N 3.35Å; E51-E54 PolarHBondContact O-N 3.45Å; E51-S55 WeakPolarHBondContact O-CB 3.41Å; E51-S55 PolarHBondContact O-N 2.57Å; E51-S55 PolarHBondContact O-OG 3.06Å
52	N	86.1	Confident	72.6	Confident	50 Å²	50	76.7 Å²	76.7	27%	0.267	42%	0.423	S	S	.	.	H	α-helix	trans	-63.6	-39.5	174.1	-69.2	-28.9	0	0	0	112.1	K48 E49 I50 S55 S56	K48-N52 PolarHBondContact O-N 3.49Å; K48-N52 PolarHBondContact O-ND2 3.38Å; E49-N52 WeakPolarHBondContact O-CB 3.47Å; E49-N52 PolarHBondContact O-N 3.42Å; I50-N52 VanDerWaalsContact C-N 3.3Å; I50-N52 PolarHBondContact O-N 2.95Å; N52-S55 WeakPolarHBondContact CA-OG 3.26Å; N52-S55 PolarHBondContact O-OG 3.36Å; N52-S55 VanDerWaalsContact O-OG 3.07Å; N52-S56 VanDerWaalsContact O-CB 3.28Å; N52-S56 WeakPolarHBondContact O-CB 3.26Å; N52-S56 PolarHBondContact O-N 3.47Å; N52-S56 PolarHBondContact O-OG 3.18Å
53	I	85.3	Confident	70.6	Confident	18 Å²	18	73.6 Å²	73.6	9%	0.092	43%	0.426	C	S	.	.	H	α-helix	trans	-64.4	-45.8	176.4	-69.4	164.3	0	0	0	110.2	E49 I50 E51 S56 G57 P455 M459	E49-I53 HydrophobicContact CG-CD1 4.11Å; E49-I53 WeakPolarHBondContact O-CD1 3.47Å; E49-I53 WeakPolarHBondContact O-CG1 3.32Å; E49-I53 PolarHBondContact O-N 2.79Å; I50-I53 WeakPolarHBondContact O-CB 3.43Å; I50-I53 PolarHBondContact O-N 3.12Å; I50-I53 VanDerWaalsContact O-N 3.11Å; E51-I53 VanDerWaalsContact C-N 3.35Å; I53-S56 PolarHBondContact O-N 3.33Å; I53-S56 PolarHBondContact O-OG 3.47Å; I53-S56 VanDerWaalsContact O-OG 3.04Å; I53-G57 PolarHBondContact O-N 2.9Å; I53-P455 HydrophobicContact CD1-CB 3.93Å; I53-M459 HydrophobicContact CD1-CE 4.01Å
54	E	82.3	Confident	68	Low	111 Å²	111	77.7 Å²	77.7	52%	0.519	47%	0.47	S	S	.	.	H	α-helix	trans	-67.8	-41.8	-178.1	-71.4	173.8	-170	0	0	112.2	I50 E51 G58 R464	I50-E54 HydrophobicContact CG2-CG 4.49Å; I50-E54 VanDerWaalsContact CG2-OE1 3.25Å; I50-E54 WeakPolarHBondContact CG2-OE1 3.5Å; I50-E54 WeakPolarHBondContact O-CG 3.33Å; I50-E54 PolarHBondContact O-N 2.87Å; E51-E54 PolarHBondContact O-N 3.45Å; E54-G58 PolarHBondContact O-N 3.34Å; E54-R464 IonicContact OE1-CZ 3.68Å; E54-R464 IonicContact OE1-NH1 2.93Å; E54-R464 PolarHBondContact OE1-NH1 2.91Å
55	S	76.7	Confident	65	Low	86 Å²	86	75.5 Å²	75.5	60%	0.601	47%	0.473	S	S	*	.	H	α-helix	trans	-68.8	-32.9	176.4	57.4	0	0	0	0	113.3	E51 N52	E51-S55 WeakPolarHBondContact O-CB 3.41Å; E51-S55 PolarHBondContact O-N 2.57Å; E51-S55 PolarHBondContact O-OG 3.06Å; N52-S55 WeakPolarHBondContact CA-OG 3.26Å; N52-S55 PolarHBondContact O-OG 3.36Å; N52-S55 VanDerWaalsContact O-OG 3.07Å
56	S	67.5	Low	62.4	Low	45 Å²	45	84 Å²	84	32%	0.315	51%	0.512	S	S	.	.	H	α-helix	trans	-78.1	-34	176	60.1	0	0	0	0	113.2	N52 I53 G58 R379	N52-S56 VanDerWaalsContact O-CB 3.28Å; N52-S56 WeakPolarHBondContact O-CB 3.26Å; N52-S56 PolarHBondContact O-N 3.47Å; N52-S56 PolarHBondContact O-OG 3.18Å; I53-S56 PolarHBondContact O-N 3.33Å; I53-S56 PolarHBondContact O-OG 3.47Å; I53-S56 VanDerWaalsContact O-OG 3.04Å; S56-G58 VanDerWaalsContact C-N 3.31Å; S56-G58 PolarHBondContact O-N 2.92Å; S56-R379 PolarHBondContact OG-NH2 3.47Å
57	G	57.5	Low	59.6	Low	47 Å²	47	87 Å²	87	49%	0.485	54%	0.544	S	S	.	.	H	α-helix	trans	-70.4	-17.4	178.5	0	0	0	0	0	115.2	I53 G59	I53-G57 PolarHBondContact O-N 2.9Å; G57-G59 PolarHBondContact O-N 3.48Å
58	G	41.8	Very low	56.6	Low	54 Å²	54	91.8 Å²	91.8	56%	0.557	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	5.9	-179.5	0	0	0	0	0	116.8	E54 S56	E54-G58 PolarHBondContact O-N 3.34Å; S56-G58 VanDerWaalsContact C-N 3.31Å; S56-G58 PolarHBondContact O-N 2.92Å
59	G	40.2	Very low	53.5	Low	46 Å²	46	93 Å²	93	47%	0.474	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.5	-16.7	-177.6	0	0	0	0	0	116.2	G57	G57-G59 PolarHBondContact O-N 3.48Å
60	H	42	Very low	50.6	Low	190 Å²	190	101 Å²	101	88%	0.88	62%	0.624	S	S	*	*	S	Bend	trans	-130.5	91.7	177	-79.3	-39.2	0	0	0	109
61	G	34.9	Very low	47.8	Very low	76 Å²	76	108.8 Å²	108.8	78%	0.784	66%	0.66	S	S	*	*	S	Bend	trans	133.2	7.9	170.9	0	0	0	0	0	117.4
62	R	33.4	Very low	45.2	Very low	240 Å²	240	110.6 Å²	110.6	91%	0.906	67%	0.669	S	S	*	*			trans	-131.5	54.1	168.1	-77.9	-170	175.8	-178	0.7	111.8
63	A	30	Very low	42.6	Very low	98 Å²	98	115.7 Å²	115.7	81%	0.81	69%	0.691	S	S	*	*			trans	-89.6	117.1	151.4	0	0	0	0	0	106.1	G65	A63-G65 PolarHBondContact O-N 3.3Å
64	G	33.3	Very low	40.1	Very low	94 Å²	94	124.1 Å²	124.1	97%	0.969	73%	0.73	S	S	*	*			trans	-59.2	104.7	172.3	0	0	0	0	0	109.9
65	G	25.9	Very low	38.1	Very low	62 Å²	62	124.9 Å²	124.9	64%	0.639	73%	0.733	S	S	*	*			trans	-135.7	115.9	159.8	0	0	0	0	0	105.5	A63 G67	A63-G65 PolarHBondContact O-N 3.3Å; G65-G67 PolarHBondContact O-N 3.44Å
66	E	35.2	Very low	36.5	Very low	211 Å²	211	129.9 Å²	129.9	99%	0.986	74%	0.744	S	S	*	*	S	Bend	trans	-55.6	120.3	175	-63.8	175.5	155.3	0	0	109
67	G	31.6	Very low	35.7	Very low	68 Å²	68	131.7 Å²	131.7	70%	0.701	76%	0.762	S	S	*	*			trans	110	54.8	165.2	0	0	0	0	0	117.8	G65	G65-G67 PolarHBondContact O-N 3.44Å
68	E	27.3	Very low	35.5	Very low	182 Å²	182	131 Å²	131	85%	0.85	75%	0.749	S	S	*	*			trans	-138.1	78.6	144.5	-75.8	-165.9	169.2	0	0	108.9	Q70	E68-Q70 VanDerWaalsContact C-N 3.32Å; E68-Q70 PolarHBondContact O-N 2.94Å
69	T	24.6	Very low	36.6	Very low	133 Å²	133	131.5 Å²	131.5	82%	0.816	74%	0.737	S	S	*	*			trans	-63.1	99	160.3	-35.5	0	0	0	0	105.9	E71	T69-E71 PolarHBondContact O-N 3.27Å
70	Q	31.2	Very low	38	Very low	174 Å²	174	134.2 Å²	134.2	81%	0.813	74%	0.737	S	S	*	*			trans	-59.4	110.8	160	-80.9	-177.2	-1.9	0	0	105.4	E68 E72	E68-Q70 VanDerWaalsContact C-N 3.32Å; E68-Q70 PolarHBondContact O-N 2.94Å; Q70-E72 PolarHBondContact O-N 3.38Å
71	E	28.7	Very low	39.6	Very low	175 Å²	175	125.1 Å²	125.1	82%	0.818	70%	0.695	S	S	*	*			trans	-57.1	95	164.4	-71.8	178.2	161	0	0	106	T69 E73	T69-E71 PolarHBondContact O-N 3.27Å; E71-E73 PolarHBondContact O-N 2.81Å
72	E	34.6	Very low	41.7	Very low	163 Å²	163	124.5 Å²	124.5	76%	0.762	67%	0.672	S	S	*	*			trans	-57.4	87.4	147.1	-77.8	-173.3	161.7	0	0	104.4	Q70 Q74	Q70-E72 PolarHBondContact O-N 3.38Å; E72-Q74 VanDerWaalsContact C-N 3.3Å; E72-Q74 PolarHBondContact O-N 2.82Å
73	E	31.6	Very low	43.9	Very low	157 Å²	157	115.2 Å²	115.2	73%	0.734	64%	0.639	S	S	*	*			trans	-47.4	110.1	159.3	-101.2	-174.7	156.6	0	0	104.2	E71 Q75	E71-E73 PolarHBondContact O-N 2.81Å; E73-Q75 PolarHBondContact O-N 2.96Å
74	Q	32.2	Very low	46.6	Very low	195 Å²	195	111 Å²	111	91%	0.911	60%	0.602	S	S	*	*			trans	-59	88.1	172.3	-85.9	164.8	-13.7	0	0	106.1	E72 K76	E72-Q74 VanDerWaalsContact C-N 3.3Å; E72-Q74 PolarHBondContact O-N 2.82Å; Q74-K76 PolarHBondContact O-N 3.48Å
75	Q	40.8	Very low	49	Very low	127 Å²	127	110.3 Å²	110.3	59%	0.593	57%	0.574	S	S	*	*			trans	-61.6	107.3	177.8	-76.5	-175.2	-12.8	0	0	105.4	E73 A77	E73-Q75 PolarHBondContact O-N 2.96Å; Q75-A77 PolarHBondContact O-N 3.1Å; Q75-A77 VanDerWaalsContact O-N 3.1Å
76	K	42	Very low	51.8	Low	190 Å²	190	110.2 Å²	110.2	83%	0.826	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-49.4	121.2	173.3	-173.4	177.5	179.3	-176.3	0	106.9	Q74 P78	Q74-K76 PolarHBondContact O-N 3.48Å; K76-P78 VanDerWaalsContact O-N 3.1Å
77	A	50	Low	54.4	Low	84 Å²	84	101.7 Å²	101.7	69%	0.694	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-49.2	124.2	175	0	0	0	0	0	107.3	Q75 E79	Q75-A77 PolarHBondContact O-N 3.1Å; Q75-A77 VanDerWaalsContact O-N 3.1Å; A77-E79 PolarHBondContact O-N 3.08Å
78	P	54.8	Low	57.1	Low	32 Å²	32	98.5 Å²	98.5	21%	0.208	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-60.5	138.4	-172.9	-8.5	18.1	0	0	0	108.4	K76 E82 H83 K282	K76-P78 VanDerWaalsContact O-N 3.1Å; P78-E82 HydrophobicContact CB-CB 4.06Å; P78-E82 WeakPolarHBondContact CB-OE2 3.37Å; P78-H83 WeakPolarHBondContact CB-CE1 3.35Å; P78-H83 WeakPolarHBondContact CG-CE1 3.4Å; P78-H83 PolarHBondContact O-CE1 3.36Å; P78-K282 HydrophobicContact CG-CD 3.85Å; P78-K282 VanDerWaalsContact CG-CE 3.46Å; P78-K282 HydrophobicContact CG-CG 4.22Å
79	E	64.4	Low	60	Low	65 Å²	65	93.6 Å²	93.6	30%	0.304	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-62.4	150.8	174	-157.5	167.5	-156.5	0	0	108.4	A77 G81 E82 H83 T135 R139 R142	A77-E79 PolarHBondContact O-N 3.08Å; E79-G81 PolarHBondContact O-N 2.78Å; E79-G81 VanDerWaalsContact O-N 3.11Å; E79-E82 WeakPolarHBondContact O-CB 3.34Å; E79-E82 PolarHBondContact O-N 3.12Å; E79-H83 PolarHBondContact O-ND1 2.97Å; E79-T135 HydrophobicContact CG-CG2 4.27Å; E79-R139 IonicContact OE2-CZ 2.9Å; E79-R139 VanDerWaalsContact OE2-CZ 3.22Å; E79-R139 IonicContact OE2-NE 2.79Å; E79-R139 PolarHBondContact OE2-NE 3.25Å; E79-R139 IonicContact OE2-NH2 2.61Å; E79-R139 PolarHBondContact OE2-NH2 3.44Å; E79-R142 IonicContact OE1-NH1 3.28Å; E79-R142 PolarHBondContact OE1-NH1 2.71Å
80	E	70.4	Confident	63	Low	102 Å²	102	90.8 Å²	90.8	48%	0.477	45%	0.453	S	S	.	.	H	α-helix	trans	-47.2	-44.3	-177.4	-171.5	173.8	-177.4	0	0	111.9	E82 H83 E84 S131	E80-E82 VanDerWaalsContact C-N 3.32Å; E80-E82 PolarHBondContact O-N 3.2Å; E80-H83 WeakPolarHBondContact O-CB 3.5Å; E80-H83 PolarHBondContact O-N 3.23Å; E80-H83 VanDerWaalsContact O-N 3.11Å; E80-E84 WeakPolarHBondContact O-CG 3.41Å; E80-E84 PolarHBondContact O-N 2.97Å; E80-S131 PolarHBondContact OE1-OG 3.1Å
81	G	74.9	Confident	65.7	Low	0 Å²	0	82.5 Å²	82.5	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-60.9	-29	176.6	0	0	0	0	0	115.9	E79 E84 E85 Y132 T135	E79-G81 PolarHBondContact O-N 2.78Å; E79-G81 VanDerWaalsContact O-N 3.11Å; G81-E84 PolarHBondContact O-N 2.67Å; G81-E85 WeakPolarHBondContact O-CB 3.26Å; G81-E85 PolarHBondContact O-N 3.01Å; G81-Y132 WeakPolarHBondContact O-CD2 3.33Å; G81-T135 PolarHBondContact N-OG1 3.08Å
82	E	78.6	Confident	68.3	Low	62 Å²	62	75.8 Å²	75.8	29%	0.29	39%	0.392	S	S	.	.	H	α-helix	trans	-72.2	-32	175.8	-69.9	176.2	-153.4	0	0	112.1	P78 E79 E80 A86 R139 K282	P78-E82 HydrophobicContact CB-CB 4.06Å; P78-E82 WeakPolarHBondContact CB-OE2 3.37Å; E79-E82 WeakPolarHBondContact O-CB 3.34Å; E79-E82 PolarHBondContact O-N 3.12Å; E80-E82 VanDerWaalsContact C-N 3.32Å; E80-E82 PolarHBondContact O-N 3.2Å; E82-A86 WeakPolarHBondContact O-CB 3.45Å; E82-A86 PolarHBondContact O-N 2.79Å; E82-A86 VanDerWaalsContact O-N 3.12Å; E82-R139 IonicContact OE1-NH2 2.72Å; E82-R139 PolarHBondContact OE1-NH2 2.94Å; E82-K282 IonicContact OE2-NZ 3.22Å; E82-K282 PolarHBondContact OE2-NZ 2.97Å
83	H	79.4	Confident	70.8	Confident	45 Å²	45	68 Å²	68	21%	0.208	36%	0.355	C	S	.	.	H	α-helix	trans	-69.5	-42.8	174.9	-65.5	89.4	0	0	0	110.4	P78 E79 E80 A86 W87	P78-H83 WeakPolarHBondContact CB-CE1 3.35Å; P78-H83 WeakPolarHBondContact CG-CE1 3.4Å; P78-H83 PolarHBondContact O-CE1 3.36Å; E79-H83 PolarHBondContact O-ND1 2.97Å; E80-H83 WeakPolarHBondContact O-CB 3.5Å; E80-H83 PolarHBondContact O-N 3.23Å; E80-H83 VanDerWaalsContact O-N 3.11Å; H83-A86 PolarHBondContact O-N 2.95Å; H83-W87 WeakPolarHBondContact O-CB 3.38Å; H83-W87 PolarHBondContact O-N 2.94Å
84	E	86.2	Confident	73.1	Confident	10 Å²	10	62.5 Å²	62.5	5%	0.047	33%	0.332	C	S	.	.	H	α-helix	trans	-65.6	-40.2	178.6	-60.9	-62	173.7	0	0	112.1	E80 G81 W87 L88 R128 Y132	E80-E84 WeakPolarHBondContact O-CG 3.41Å; E80-E84 PolarHBondContact O-N 2.97Å; G81-E84 PolarHBondContact O-N 2.67Å; E84-W87 PolarHBondContact O-N 3.43Å; E84-L88 WeakPolarHBondContact O-CB 3.33Å; E84-L88 VanDerWaalsContact O-CG 3.27Å; E84-L88 WeakPolarHBondContact O-CG 3.23Å; E84-L88 PolarHBondContact O-N 3.26Å; E84-R128 VanDerWaalsContact CD-CD 3.41Å; E84-R128 VanDerWaalsContact OE1-CD 3.32Å; E84-R128 WeakPolarHBondContact OE1-CD 3.28Å; E84-R128 IonicContact OE1-CZ 2.87Å; E84-R128 IonicContact OE1-NE 3.74Å; E84-R128 IonicContact OE1-NH1 3.83Å; E84-R128 PolarHBondContact OE1-NH1 3.5Å; E84-R128 WeakPolarHBondContact OE2-CA 3.43Å; E84-R128 WeakPolarHBondContact OE2-CB 3.36Å; E84-R128 WeakPolarHBondContact OE2-CD 3.44Å; E84-R128 WeakPolarHBondContact OE2-CG 3.42Å; E84-Y132 HydrophobicContact CB-CD2 4.43Å; E84-Y132 HydrophobicContact CB-CG 4.47Å
85	E	84.8	Confident	75.1	Confident	79 Å²	79	55.1 Å²	55.1	37%	0.369	30%	0.296	S	S	.	.	H	α-helix	trans	-61.6	-45.7	173.6	-172.6	-178	178.6	0	0	112.2	G81 W87 L88 T89 Y132	G81-E85 WeakPolarHBondContact O-CB 3.26Å; G81-E85 PolarHBondContact O-N 3.01Å; E85-W87 VanDerWaalsContact C-N 3.33Å; E85-W87 PolarHBondContact O-N 3.49Å; E85-L88 PolarHBondContact O-N 3.47Å; E85-T89 WeakPolarHBondContact O-CB 3.39Å; E85-T89 PolarHBondContact O-N 3.43Å; E85-T89 PolarHBondContact O-OG1 3.33Å; E85-Y132 HydrophobicContact CB-CD2 4.1Å; E85-Y132 HydrophobicContact CB-CE2 3.69Å; E85-Y132 HydrophobicContact CG-CE2 4.14Å
86	A	84.8	Confident	76.8	Confident	60 Å²	60	52.2 Å²	52.2	50%	0.496	29%	0.285	S	S	.	.	H	α-helix	trans	-62.8	-41.3	177.2	0	0	0	0	0	111.5	E82 H83 T89 E90	E82-A86 WeakPolarHBondContact O-CB 3.45Å; E82-A86 PolarHBondContact O-N 2.79Å; E82-A86 VanDerWaalsContact O-N 3.12Å; H83-A86 PolarHBondContact O-N 2.95Å; A86-T89 WeakPolarHBondContact O-CB 3.21Å; A86-T89 PolarHBondContact O-N 3.26Å; A86-E90 PolarHBondContact O-N 2.86Å
87	W	89.8	Confident	78.1	Confident	32 Å²	32	44.7 Å²	44.7	12%	0.121	25%	0.254	C	S	.	.	H	α-helix	trans	-63.4	-46.7	175.8	-174.7	97.2	0	0	0	111.8	H83 E84 E85 T89 E90 A91 L93 V125 R128 V265 T268	H83-W87 WeakPolarHBondContact O-CB 3.38Å; H83-W87 PolarHBondContact O-N 2.94Å; E84-W87 PolarHBondContact O-N 3.43Å; E85-W87 VanDerWaalsContact C-N 3.33Å; E85-W87 PolarHBondContact O-N 3.49Å; W87-T89 PolarHBondContact O-N 3.12Å; W87-E90 PolarHBondContact O-N 2.93Å; W87-A91 HydrophobicContact CE3-CB 4.28Å; W87-A91 HydrophobicContact CH2-CB 4.32Å; W87-A91 HydrophobicContact CZ3-CB 4.1Å; W87-A91 WeakPolarHBondContact O-CB 3.4Å; W87-A91 PolarHBondContact O-N 3.06Å; W87-L93 HydrophobicContact CZ3-CD1 4.39Å; W87-V125 HydrophobicContact CH2-CG2 3.97Å; W87-R128 HydrophobicContact CD2-CB 4.45Å; W87-R128 HydrophobicContact CD2-CG 4.11Å; W87-R128 HydrophobicContact CE3-CB 3.84Å; W87-R128 HydrophobicContact CE3-CG 3.95Å; W87-R128 HydrophobicContact CH2-CG 4.27Å; W87-R128 HydrophobicContact CZ2-CG 4.4Å; W87-R128 HydrophobicContact CZ3-CB 3.93Å; W87-R128 HydrophobicContact CZ3-CG 4.04Å; W87-V265 HydrophobicContact CH2-CG2 4Å; W87-V265 HydrophobicContact CZ2-CG2 4.13Å; W87-T268 HydrophobicContact CZ2-CG2 4.17Å; W87-T268 PolarHBondContact NE1-OG1 2.96Å
88	L	89	Confident	78.9	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-61.3	-33.7	175.8	-72.5	168.5	0	0	0	111.3	E84 E85 G92 L93 V94 V97 V129 Y132	E84-L88 WeakPolarHBondContact O-CB 3.33Å; E84-L88 VanDerWaalsContact O-CG 3.27Å; E84-L88 WeakPolarHBondContact O-CG 3.23Å; E84-L88 PolarHBondContact O-N 3.26Å; E85-L88 PolarHBondContact O-N 3.47Å; L88-G92 PolarHBondContact O-N 3.49Å; L88-L93 HydrophobicContact CD2-CB 3.9Å; L88-L93 CarbonylContact O-C 3.58Å; L88-L93 WeakPolarHBondContact O-CA 3.33Å; L88-L93 PolarHBondContact O-N 3.48Å; L88-V94 PolarHBondContact O-N 3.45Å; L88-V97 HydrophobicContact CD1-CG2 3.82Å; L88-V129 HydrophobicContact CD2-CG2 3.8Å; L88-Y132 HydrophobicContact CD1-CD1 4.06Å; L88-Y132 HydrophobicContact CD1-CG 4.32Å
89	T	87.6	Confident	79	Confident	79 Å²	79	48.5 Å²	48.5	49%	0.485	26%	0.261	S	S	.	.	H	α-helix	trans	-65.2	-50	173.9	-55.1	0	0	0	0	112.3	E85 A86 W87 A91 G92 V94	E85-T89 WeakPolarHBondContact O-CB 3.39Å; E85-T89 PolarHBondContact O-N 3.43Å; E85-T89 PolarHBondContact O-OG1 3.33Å; A86-T89 WeakPolarHBondContact O-CB 3.21Å; A86-T89 PolarHBondContact O-N 3.26Å; W87-T89 PolarHBondContact O-N 3.12Å; T89-A91 VanDerWaalsContact C-N 3.31Å; T89-A91 PolarHBondContact O-N 3.47Å; T89-G92 PolarHBondContact O-N 3.08Å; T89-G92 VanDerWaalsContact O-N 3.08Å; T89-V94 HydrophobicContact CG2-CG2 4.03Å; T89-V94 VanDerWaalsContact OG1-CG2 3.26Å; T89-V94 WeakPolarHBondContact OG1-CG2 3.44Å
90	E	86.6	Confident	78.5	Confident	73 Å²	73	49.9 Å²	49.9	34%	0.341	28%	0.278	S	S	.	.	H	α-helix	trans	-65	-36.8	178.6	-165.8	178.7	177.2	0	0	112.4	A86 W87 G92 R260 L264 Y390	A86-E90 PolarHBondContact O-N 2.86Å; W87-E90 PolarHBondContact O-N 2.93Å; E90-G92 PolarHBondContact O-N 3.34Å; E90-R260 IonicContact OE1-CZ 2.79Å; E90-R260 IonicContact OE1-NE 2.78Å; E90-R260 IonicContact OE1-NH2 3.78Å; E90-R260 PolarHBondContact OE1-NH2 3.45Å; E90-L264 HydrophobicContact CB-CD2 3.79Å; E90-L264 HydrophobicContact CG-CD2 3.76Å; E90-Y390 PolarHBondContact OE1-OH 3.35Å
91	A	87.8	Confident	77.6	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-10.6	175.5	0	0	0	0	0	113.7	W87 T89 L93 R261 L264	W87-A91 HydrophobicContact CE3-CB 4.28Å; W87-A91 HydrophobicContact CH2-CB 4.32Å; W87-A91 HydrophobicContact CZ3-CB 4.1Å; W87-A91 WeakPolarHBondContact O-CB 3.4Å; W87-A91 PolarHBondContact O-N 3.06Å; T89-A91 VanDerWaalsContact C-N 3.31Å; T89-A91 PolarHBondContact O-N 3.47Å; A91-L93 HydrophobicContact CB-CB 4.38Å; A91-L93 HydrophobicContact CB-CD1 3.99Å; A91-L93 HydrophobicContact CB-CG 4.04Å; A91-R261 PolarHBondContact O-NE 2.86Å; A91-R261 PolarHBondContact O-NH2 2.83Å; A91-R261 VanDerWaalsContact O-NH2 3.13Å; A91-L264 HydrophobicContact CB-CD2 4.11Å
92	G	84.9	Confident	76	Confident	34 Å²	34	54.2 Å²	54.2	35%	0.351	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	35.3	-174.1	0	0	0	0	0	112.9	L88 T89 E90 S110 R261	L88-G92 PolarHBondContact O-N 3.49Å; T89-G92 PolarHBondContact O-N 3.08Å; T89-G92 VanDerWaalsContact O-N 3.08Å; E90-G92 PolarHBondContact O-N 3.34Å; G92-S110 PolarHBondContact O-OG 2.91Å; G92-R261 PolarHBondContact O-NH2 3.44Å
93	L	86.2	Confident	74.4	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	32%	0.323	C	S	.	.			trans	-121.6	9.4	-175.3	-65.2	179.5	0	0	0	113.6	W87 L88 A91 R95 L96 F113 L114 V125	W87-L93 HydrophobicContact CZ3-CD1 4.39Å; L88-L93 HydrophobicContact CD2-CB 3.9Å; L88-L93 CarbonylContact O-C 3.58Å; L88-L93 WeakPolarHBondContact O-CA 3.33Å; L88-L93 PolarHBondContact O-N 3.48Å; A91-L93 HydrophobicContact CB-CB 4.38Å; A91-L93 HydrophobicContact CB-CD1 3.99Å; A91-L93 HydrophobicContact CB-CG 4.04Å; L93-R95 PolarHBondContact O-N 2.97Å; L93-R95 VanDerWaalsContact O-N 3.08Å; L93-L96 HydrophobicContact CB-CD1 4.13Å; L93-L96 HydrophobicContact CD1-CD1 4.47Å; L93-L96 HydrophobicContact CD2-CD1 4.2Å; L93-L96 WeakPolarHBondContact O-CB 3.39Å; L93-L96 PolarHBondContact O-N 3.08Å; L93-F113 HydrophobicContact CD1-CE1 4.17Å; L93-F113 HydrophobicContact CD2-CD1 3.96Å; L93-F113 HydrophobicContact CD2-CE1 4.39Å; L93-L114 HydrophobicContact CD1-CD2 4.38Å; L93-L114 HydrophobicContact CD2-CD2 4.17Å; L93-L114 HydrophobicContact CD2-CG 4.37Å; L93-V125 HydrophobicContact CD1-CG1 3.74Å; L93-V125 HydrophobicContact CD1-CG2 4.04Å
94	V	79.5	Confident	72.8	Confident	41 Å²	41	60 Å²	60	25%	0.248	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-48.4	-39.6	178.1	-171.3	0	0	0	0	112.5	L88 T89 L96 V97 D98	L88-V94 PolarHBondContact O-N 3.45Å; T89-V94 HydrophobicContact CG2-CG2 4.03Å; T89-V94 VanDerWaalsContact OG1-CG2 3.26Å; T89-V94 WeakPolarHBondContact OG1-CG2 3.44Å; V94-L96 PolarHBondContact O-N 3.04Å; V94-L96 VanDerWaalsContact O-N 3.14Å; V94-V97 PolarHBondContact O-N 3.43Å; V94-D98 HydrophobicContact CG1-CB 4.48Å; V94-D98 PolarHBondContact O-N 3.28Å; V94-D98 VanDerWaalsContact O-N 3.12Å
95	R	74.9	Confident	71	Confident	40 Å²	40	66.5 Å²	66.5	15%	0.151	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-65.1	-15.6	-177.4	-63.6	-170.2	71.7	167.1	-1.5	114.4	L93 V97 A103 E107	L93-R95 PolarHBondContact O-N 2.97Å; L93-R95 VanDerWaalsContact O-N 3.08Å; R95-V97 PolarHBondContact O-N 3.14Å; R95-A103 PolarHBondContact NH1-O 3.23Å; R95-E107 IonicContact CZ-OE1 3.46Å; R95-E107 IonicContact NE-OE1 3.76Å; R95-E107 IonicContact NH2-OE1 2.67Å; R95-E107 PolarHBondContact NH2-OE1 2.98Å; R95-E107 IonicContact NH2-OE2 3.9Å
96	L	75.9	Confident	69.4	Low	67 Å²	67	68.6 Å²	68.6	35%	0.351	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-65.2	-15.2	170.7	-68.1	179.6	0	0	0	112.4	L93 V94 L114 V125 V129	L93-L96 HydrophobicContact CB-CD1 4.13Å; L93-L96 HydrophobicContact CD1-CD1 4.47Å; L93-L96 HydrophobicContact CD2-CD1 4.2Å; L93-L96 WeakPolarHBondContact O-CB 3.39Å; L93-L96 PolarHBondContact O-N 3.08Å; V94-L96 PolarHBondContact O-N 3.04Å; V94-L96 VanDerWaalsContact O-N 3.14Å; L96-L114 HydrophobicContact CD1-CD1 4.17Å; L96-L114 HydrophobicContact CD2-CD1 4.06Å; L96-V125 HydrophobicContact CD1-CG1 4.26Å; L96-V129 HydrophobicContact CB-CG2 4.37Å; L96-V129 HydrophobicContact CD1-CG2 4Å
97	V	69.7	Low	67.8	Low	31 Å²	31	70.7 Å²	70.7	19%	0.188	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.2	-8.3	-175	-153.5	0	0	0	0	114.1	L88 V94 R95 V129 Y132 Q133 L136	L88-V97 HydrophobicContact CD1-CG2 3.82Å; V94-V97 PolarHBondContact O-N 3.43Å; R95-V97 PolarHBondContact O-N 3.14Å; V97-V129 HydrophobicContact CG2-CG1 4.07Å; V97-V129 HydrophobicContact CG2-CG2 4.4Å; V97-Y132 HydrophobicContact CB-CD1 3.62Å; V97-Y132 HydrophobicContact CB-CE1 3.58Å; V97-Y132 HydrophobicContact CG1-CD1 3.29Å; V97-Y132 HydrophobicContact CG1-CE1 3.31Å; V97-Y132 HydrophobicContact CG2-CD1 3.8Å; V97-Y132 HydrophobicContact CG2-CE1 4.25Å; V97-Q133 HydrophobicContact CG1-CG 3.87Å; V97-L136 HydrophobicContact CG1-CD1 4.18Å
98	D	66.3	Low	66.2	Low	55 Å²	55	73.9 Å²	73.9	29%	0.294	41%	0.412	S	S	.	.			trans	-126.3	99.3	171	-168.5	0.4	0	0	0	111.6	V94 S100	V94-D98 HydrophobicContact CG1-CB 4.48Å; V94-D98 PolarHBondContact O-N 3.28Å; V94-D98 VanDerWaalsContact O-N 3.12Å; D98-S100 PolarHBondContact O-N 2.78Å; D98-S100 WeakPolarHBondContact OD1-CB 3.48Å; D98-S100 PolarHBondContact OD1-N 3.48Å; D98-S100 PolarHBondContact OD1-OG 3.19Å; D98-S100 PolarHBondContact OD2-OG 3.03Å
99	D	57.9	Low	65.5	Low	141 Å²	141	76.4 Å²	76.4	75%	0.754	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-6.6	177.6	-70.5	-25	0	0	0	112.9
100	S	53.7	Low	65.2	Low	94 Å²	94	73.2 Å²	73.2	66%	0.657	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-7.8	-171.2	71.6	0	0	0	0	115.2	D98	D98-S100 PolarHBondContact O-N 2.78Å; D98-S100 WeakPolarHBondContact OD1-CB 3.48Å; D98-S100 PolarHBondContact OD1-N 3.48Å; D98-S100 PolarHBondContact OD1-OG 3.19Å; D98-S100 PolarHBondContact OD2-OG 3.03Å
101	L	50.7	Low	65.1	Low	111 Å²	111	72.3 Å²	72.3	58%	0.581	41%	0.411	S	S	*	.			trans	-103.2	48.2	-177.2	-65.3	173.3	0	0	0	113.3	A103	L101-A103 PolarHBondContact O-N 3.11Å
102	A	40.8	Very low	65.1	Low	82 Å²	82	72.4 Å²	72.4	68%	0.678	41%	0.412	S	S	*	.			trans	-73.3	86.6	-177.4	0	0	0	0	0	113.7
103	A	45	Very low	65.3	Low	54 Å²	54	70.8 Å²	70.8	45%	0.446	40%	0.396	S	S	.	.			trans	-100.3	126.6	150.8	0	0	0	0	0	108.6	R95 L101 D105	R95-A103 PolarHBondContact NH1-O 3.23Å; L101-A103 PolarHBondContact O-N 3.11Å; A103-D105 PolarHBondContact O-N 2.99Å; A103-D105 VanDerWaalsContact O-N 3.08Å
104	E	47.4	Very low	65.6	Low	176 Å²	176	73.6 Å²	73.6	82%	0.822	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.3	-169.6	-64.9	-178.3	169.4	0	0	114.2
105	D	48	Very low	66.1	Low	145 Å²	145	74.9 Å²	74.9	78%	0.775	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-14.9	-171.8	-71.6	-27.4	0	0	0	115.9	A103	A103-D105 PolarHBondContact O-N 2.99Å; A103-D105 VanDerWaalsContact O-N 3.08Å
106	H	49.9	Very low	67	Low	123 Å²	123	73.4 Å²	73.4	57%	0.569	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	-17.5	-170.8	-73.1	-59.7	0	0	0	116	E108	H106-E108 VanDerWaalsContact C-N 3.28Å; H106-E108 PolarHBondContact O-N 3.42Å
107	E	52.2	Low	68	Low	104 Å²	104	71.3 Å²	71.3	49%	0.486	41%	0.405	S	S	.	.	H	α-helix	trans	-69.2	-33.1	-179.2	-133.1	163.7	-129.4	0	0	111.3	R95 D109 S110 A111	R95-E107 IonicContact CZ-OE1 3.46Å; R95-E107 IonicContact NE-OE1 3.76Å; R95-E107 IonicContact NH2-OE1 2.67Å; R95-E107 PolarHBondContact NH2-OE1 2.98Å; R95-E107 IonicContact NH2-OE2 3.9Å; E107-D109 VanDerWaalsContact C-N 3.34Å; E107-D109 PolarHBondContact O-N 3.38Å; E107-S110 PolarHBondContact O-N 3.39Å; E107-A111 PolarHBondContact O-N 3.15Å
108	E	56.8	Low	69.2	Low	99 Å²	99	71.6 Å²	71.6	46%	0.463	41%	0.408	S	S	.	.	H	α-helix	trans	-73	-25.4	-176.5	-59.4	-172.5	163.5	0	0	113.6	H106 V112 K514	H106-E108 VanDerWaalsContact C-N 3.28Å; H106-E108 PolarHBondContact O-N 3.42Å; E108-V112 WeakPolarHBondContact O-CG2 3.34Å; E108-V112 PolarHBondContact O-N 2.88Å; E108-K514 PolarHBondContact O-NZ 3.24Å
109	D	73.3	Confident	70.7	Confident	55 Å²	55	77.3 Å²	77.3	29%	0.294	43%	0.425	S	S	.	.	H	α-helix	trans	-76.1	-35.4	177.3	-172.4	51.7	0	0	0	111.5	E107 V112 F113 R261	E107-D109 VanDerWaalsContact C-N 3.34Å; E107-D109 PolarHBondContact O-N 3.38Å; D109-V112 PolarHBondContact O-N 3.42Å; D109-F113 WeakPolarHBondContact O-CB 3.39Å; D109-F113 PolarHBondContact O-N 2.97Å; D109-R261 IonicContact OD2-NH1 3.75Å; D109-R261 PolarHBondContact OD2-NH1 3.42Å
110	S	81.6	Confident	72.5	Confident	12 Å²	12	71.2 Å²	71.2	8%	0.084	39%	0.393	C	S	.	.	H	α-helix	trans	-66.6	-40.3	175.6	-58.9	0	0	0	0	112	G92 E107 F113 L114	G92-S110 PolarHBondContact O-OG 2.91Å; E107-S110 PolarHBondContact O-N 3.39Å; S110-F113 WeakPolarHBondContact O-CB 3.34Å; S110-F113 PolarHBondContact O-N 3.29Å; S110-L114 VanDerWaalsContact O-CG 3.3Å; S110-L114 WeakPolarHBondContact O-CG 3.44Å; S110-L114 PolarHBondContact O-N 2.85Å
111	A	84.2	Confident	74.6	Confident	54 Å²	54	66.7 Å²	66.7	45%	0.446	36%	0.361	S	S	.	.	H	α-helix	trans	-65.1	-41.2	177.2	0	0	0	0	0	112.8	E107 F113 L114 S115	E107-A111 PolarHBondContact O-N 3.15Å; A111-F113 VanDerWaalsContact C-N 3.32Å; A111-L114 PolarHBondContact O-N 2.71Å; A111-S115 PolarHBondContact O-N 3.46Å; A111-S115 VanDerWaalsContact O-N 3.1Å; A111-S115 PolarHBondContact O-OG 3.4Å
112	V	88	Confident	76.8	Confident	3 Å²	3	62.8 Å²	62.8	2%	0.018	35%	0.345	C	S	.	.	H	α-helix	trans	-66.4	-35.6	174.3	170.4	0	0	0	0	111.2	E108 D109 S115 T116 Q507 E510 K514	E108-V112 WeakPolarHBondContact O-CG2 3.34Å; E108-V112 PolarHBondContact O-N 2.88Å; D109-V112 PolarHBondContact O-N 3.42Å; V112-S115 PolarHBondContact O-OG 3.41Å; V112-T116 WeakPolarHBondContact O-CG2 3.33Å; V112-Q507 HydrophobicContact CG1-CB 3.98Å; V112-Q507 HydrophobicContact CG1-CG 4.11Å; V112-E510 HydrophobicContact CG1-CB 3.84Å; V112-E510 HydrophobicContact CG2-CB 4.25Å; V112-K514 HydrophobicContact CG2-CD 3.94Å; V112-K514 VanDerWaalsContact CG2-CE 3.44Å
113	F	90.2	Very high	79.4	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-50.9	175.2	178.9	-96.7	0	0	0	111	L93 D109 S110 A111 S115 T116 L117 R261 L262 V265 Q507	L93-F113 HydrophobicContact CD1-CE1 4.17Å; L93-F113 HydrophobicContact CD2-CD1 3.96Å; L93-F113 HydrophobicContact CD2-CE1 4.39Å; D109-F113 WeakPolarHBondContact O-CB 3.39Å; D109-F113 PolarHBondContact O-N 2.97Å; S110-F113 WeakPolarHBondContact O-CB 3.34Å; S110-F113 PolarHBondContact O-N 3.29Å; A111-F113 VanDerWaalsContact C-N 3.32Å; F113-S115 PolarHBondContact O-N 2.98Å; F113-T116 PolarHBondContact O-N 3.02Å; F113-T116 PolarHBondContact O-OG1 2.96Å; F113-L117 HydrophobicContact CD1-CD1 4.42Å; F113-L117 HydrophobicContact CE1-CD1 4.06Å; F113-L117 HydrophobicContact CE1-CD2 4Å; F113-L117 HydrophobicContact CE1-CG 4.41Å; F113-L117 HydrophobicContact CZ-CD2 4.03Å; F113-R261 HydrophobicContact CD2-CB 4.43Å; F113-R261 HydrophobicContact CE2-CB 3.6Å; F113-R261 HydrophobicContact CZ-CB 4.04Å; F113-L262 HydrophobicContact CD2-CD2 4.43Å; F113-L262 HydrophobicContact CE2-CD2 3.74Å; F113-L262 HydrophobicContact CE2-CG 3.91Å; F113-L262 HydrophobicContact CZ-CD2 4.22Å; F113-V265 HydrophobicContact CE1-CG2 4.01Å; F113-V265 HydrophobicContact CZ-CG2 3.79Å; F113-Q507 VanDerWaalsContact CD2-NE2 3.28Å
114	L	91.3	Very high	81.8	Confident	58 Å²	58	58.4 Å²	58.4	30%	0.304	31%	0.309	S	S	.	.	H	α-helix	trans	-65	-35.1	-177.1	-66.7	173.3	0	0	0	113.6	L93 L96 S110 A111 T116 L117 V125	L93-L114 HydrophobicContact CD1-CD2 4.38Å; L93-L114 HydrophobicContact CD2-CD2 4.17Å; L93-L114 HydrophobicContact CD2-CG 4.37Å; L96-L114 HydrophobicContact CD1-CD1 4.17Å; L96-L114 HydrophobicContact CD2-CD1 4.06Å; S110-L114 VanDerWaalsContact O-CG 3.3Å; S110-L114 WeakPolarHBondContact O-CG 3.44Å; S110-L114 PolarHBondContact O-N 2.85Å; A111-L114 PolarHBondContact O-N 2.71Å; L114-T116 PolarHBondContact O-N 3.38Å; L114-L117 HydrophobicContact CD2-CD1 3.79Å; L114-L117 PolarHBondContact O-N 3.27Å; L114-V125 HydrophobicContact CD2-CG1 4.04Å
115	S	91.3	Very high	84	Confident	68 Å²	68	50.3 Å²	50.3	48%	0.476	27%	0.271	S	S	.	.	H	α-helix	trans	-62.8	-24.6	178.2	59.1	0	0	0	0	113.1	A111 V112 F113 E510	A111-S115 PolarHBondContact O-N 3.46Å; A111-S115 VanDerWaalsContact O-N 3.1Å; A111-S115 PolarHBondContact O-OG 3.4Å; V112-S115 PolarHBondContact O-OG 3.41Å; F113-S115 PolarHBondContact O-N 2.98Å; S115-E510 PolarHBondContact OG-OE2 3.23Å
116	T	93.6	Very high	86.2	Confident	10 Å²	10	49.7 Å²	49.7	6%	0.061	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-9.5	-178.7	63	0	0	0	0	114.2	V112 F113 L114 Q503 Q506 Q507	V112-T116 WeakPolarHBondContact O-CG2 3.33Å; F113-T116 PolarHBondContact O-N 3.02Å; F113-T116 PolarHBondContact O-OG1 2.96Å; L114-T116 PolarHBondContact O-N 3.38Å; T116-Q503 PolarHBondContact O-NE2 3.48Å; T116-Q506 HydrophobicContact CG2-CB 3.74Å; T116-Q507 HydrophobicContact CG2-CG 3.68Å; T116-Q507 PolarHBondContact OG1-NE2 2.98Å
117	L	95.9	Very high	88.2	Confident	22 Å²	22	48.4 Å²	48.4	12%	0.115	26%	0.261	C	S	.	.			trans	-72.3	144.9	-175.6	-61.6	-176.2	0	0	0	112.2	F113 L114 Q121 A122 V125 L262 V265	F113-L117 HydrophobicContact CD1-CD1 4.42Å; F113-L117 HydrophobicContact CE1-CD1 4.06Å; F113-L117 HydrophobicContact CE1-CD2 4Å; F113-L117 HydrophobicContact CE1-CG 4.41Å; F113-L117 HydrophobicContact CZ-CD2 4.03Å; L114-L117 HydrophobicContact CD2-CD1 3.79Å; L114-L117 PolarHBondContact O-N 3.27Å; L117-Q121 HydrophobicContact CB-CB 3.93Å; L117-Q121 HydrophobicContact CD2-CB 4.24Å; L117-Q121 HydrophobicContact CG-CB 4.47Å; L117-A122 HydrophobicContact CB-CB 4.36Å; L117-V125 HydrophobicContact CD1-CG2 3.79Å; L117-L262 HydrophobicContact CD2-CD2 3.8Å; L117-V265 HydrophobicContact CD1-CG1 4.36Å; L117-V265 HydrophobicContact CD2-CG1 4.33Å
118	T	96.4	Very high	90.1	Very high	38 Å²	38	45.3 Å²	45.3	23%	0.233	24%	0.244	C	C	.	.			trans	-69.4	169.8	169	69.1	0	0	0	0	111	T120 Q121 A122 A204	T118-T120 VanDerWaalsContact C-N 3.34Å; T118-T120 PolarHBondContact O-N 2.95Å; T118-T120 PolarHBondContact OG1-OG1 3.22Å; T118-Q121 PolarHBondContact O-N 2.79Å; T118-Q121 WeakPolarHBondContact OG1-CB 3.48Å; T118-Q121 WeakPolarHBondContact OG1-CG 3.27Å; T118-Q121 PolarHBondContact OG1-N 2.95Å; T118-Q121 PolarHBondContact OG1-OE1 3.13Å; T118-A122 WeakPolarHBondContact O-CB 3.3Å; T118-A122 PolarHBondContact O-N 2.94Å; T118-A204 HydrophobicContact CG2-CB 3.84Å
119	R	96.3	Very high	91.7	Very high	175 Å²	175	41.7 Å²	41.7	66%	0.66	23%	0.229	S	C	*	.	H	α-helix	trans	-59.5	-45.6	179.6	-177.7	-177.7	63.3	168.1	0.5	111.7	A123 E207 L210	R119-A123 WeakPolarHBondContact O-CB 3.44Å; R119-A123 PolarHBondContact O-N 3.5Å; R119-E207 PolarHBondContact N-OE1 3.4Å; R119-E207 IonicContact NH2-OE2 2.7Å; R119-L210 VanDerWaalsContact NH2-CD2 3.35Å
120	T	96.6	Very high	92.5	Very high	12 Å²	12	41.7 Å²	41.7	7%	0.074	23%	0.233	C	C	.	.	H	α-helix	trans	-66.7	-40.6	177.8	45.5	0	0	0	0	112.6	T118 A123 A124 S206 E207 L210 T273	T118-T120 VanDerWaalsContact C-N 3.34Å; T118-T120 PolarHBondContact O-N 2.95Å; T118-T120 PolarHBondContact OG1-OG1 3.22Å; T120-A123 PolarHBondContact O-N 3.27Å; T120-A124 PolarHBondContact O-N 2.68Å; T120-S206 WeakPolarHBondContact OG1-CB 3.36Å; T120-S206 PolarHBondContact OG1-OG 3.08Å; T120-E207 WeakPolarHBondContact CB-OE1 3.41Å; T120-E207 HydrophobicContact CG2-CG 4.42Å; T120-E207 VanDerWaalsContact CG2-OE1 3.3Å; T120-E207 WeakPolarHBondContact CG2-OE1 3.44Å; T120-E207 PolarHBondContact N-OE1 3.42Å; T120-E207 WeakPolarHBondContact OG1-CG 3.46Å; T120-E207 PolarHBondContact OG1-OE1 2.77Å; T120-L210 HydrophobicContact CG2-CB 4.29Å; T120-L210 HydrophobicContact CG2-CD2 3.68Å; T120-T273 HydrophobicContact CG2-CG2 4.06Å
121	Q	97.3	Very high	92.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-46.4	174.8	-73.3	173.2	-12.3	0	0	112	L117 T118 A123 A124 V125 V265 E266 A269	L117-Q121 HydrophobicContact CB-CB 3.93Å; L117-Q121 HydrophobicContact CD2-CB 4.24Å; L117-Q121 HydrophobicContact CG-CB 4.47Å; T118-Q121 PolarHBondContact O-N 2.79Å; T118-Q121 WeakPolarHBondContact OG1-CB 3.48Å; T118-Q121 WeakPolarHBondContact OG1-CG 3.27Å; T118-Q121 PolarHBondContact OG1-N 2.95Å; T118-Q121 PolarHBondContact OG1-OE1 3.13Å; Q121-A123 VanDerWaalsContact C-N 3.33Å; Q121-A123 PolarHBondContact O-N 3.25Å; Q121-A124 WeakPolarHBondContact O-CB 3.41Å; Q121-A124 PolarHBondContact O-N 3.27Å; Q121-V125 WeakPolarHBondContact O-CG2 3.47Å; Q121-V125 PolarHBondContact O-N 2.88Å; Q121-V265 HydrophobicContact CB-CG1 3.7Å; Q121-V265 HydrophobicContact CG-CG1 4.06Å; Q121-E266 VanDerWaalsContact CG-OE2 3.25Å; Q121-E266 WeakPolarHBondContact CG-OE2 3.45Å; Q121-E266 PolarHBondContact NE2-OE2 3.2Å; Q121-A269 HydrophobicContact CG-CB 4.49Å
122	A	96.4	Very high	92.9	Very high	29 Å²	29	40.7 Å²	40.7	24%	0.24	22%	0.218	C	C	.	.	H	α-helix	trans	-63.3	-39.4	177.2	0	0	0	0	0	111.9	L117 T118 V125 Q126	L117-A122 HydrophobicContact CB-CB 4.36Å; T118-A122 WeakPolarHBondContact O-CB 3.3Å; T118-A122 PolarHBondContact O-N 2.94Å; A122-V125 PolarHBondContact O-N 2.83Å; A122-Q126 VanDerWaalsContact O-CG 3.29Å; A122-Q126 WeakPolarHBondContact O-CG 3.3Å; A122-Q126 PolarHBondContact O-N 3.36Å
123	A	95.9	Very high	92.9	Very high	42 Å²	42	44.8 Å²	44.8	35%	0.347	24%	0.238	S	C	.	.	H	α-helix	trans	-61.5	-43.1	174.3	0	0	0	0	0	111.7	R119 T120 Q121 V125 Q126 L127	R119-A123 WeakPolarHBondContact O-CB 3.44Å; R119-A123 PolarHBondContact O-N 3.5Å; T120-A123 PolarHBondContact O-N 3.27Å; Q121-A123 VanDerWaalsContact C-N 3.33Å; Q121-A123 PolarHBondContact O-N 3.25Å; A123-V125 PolarHBondContact O-N 2.79Å; A123-Q126 PolarHBondContact O-N 2.95Å; A123-L127 VanDerWaalsContact O-CG 3.32Å; A123-L127 WeakPolarHBondContact O-CG 3.48Å; A123-L127 PolarHBondContact O-N 3.37Å
124	A	94.6	Very high	92.7	Very high	2 Å²	2	49.5 Å²	49.5	2%	0.017	26%	0.259	C	S	.	.	H	α-helix	trans	-59.9	-47	175.4	0	0	0	0	0	111.6	T120 Q121 Q126 L127 R128 T268 A269	T120-A124 PolarHBondContact O-N 2.68Å; Q121-A124 WeakPolarHBondContact O-CB 3.41Å; Q121-A124 PolarHBondContact O-N 3.27Å; A124-Q126 VanDerWaalsContact C-N 3.33Å; A124-Q126 PolarHBondContact O-N 3.25Å; A124-L127 PolarHBondContact O-N 2.9Å; A124-R128 WeakPolarHBondContact O-CG 3.36Å; A124-R128 PolarHBondContact O-N 3.36Å; A124-R128 VanDerWaalsContact O-N 3.13Å; A124-T268 HydrophobicContact CB-CG2 4.43Å; A124-A269 HydrophobicContact CB-CB 3.77Å
125	V	94.8	Very high	92.4	Very high	5 Å²	5	47 Å²	47	3%	0.03	25%	0.246	C	C	.	.	H	α-helix	trans	-57.1	-46.3	174.9	174.9	0	0	0	0	111.4	W87 L93 L96 L114 L117 Q121 A122 A123 L127 R128 V129 V265	W87-V125 HydrophobicContact CH2-CG2 3.97Å; L93-V125 HydrophobicContact CD1-CG1 3.74Å; L93-V125 HydrophobicContact CD1-CG2 4.04Å; L96-V125 HydrophobicContact CD1-CG1 4.26Å; L114-V125 HydrophobicContact CD2-CG1 4.04Å; L117-V125 HydrophobicContact CD1-CG2 3.79Å; Q121-V125 WeakPolarHBondContact O-CG2 3.47Å; Q121-V125 PolarHBondContact O-N 2.88Å; A122-V125 PolarHBondContact O-N 2.83Å; A123-V125 PolarHBondContact O-N 2.79Å; V125-L127 VanDerWaalsContact C-N 3.32Å; V125-L127 PolarHBondContact O-N 3.12Å; V125-R128 PolarHBondContact O-N 3.47Å; V125-V129 HydrophobicContact CG1-CG2 4.34Å; V125-V129 WeakPolarHBondContact O-CG2 3.49Å; V125-V129 PolarHBondContact O-N 2.99Å; V125-V265 HydrophobicContact CG2-CG1 3.84Å; V125-V265 HydrophobicContact CG2-CG2 4.18Å
126	Q	93.7	Very high	91.9	Very high	132 Å²	132	46.8 Å²	46.8	62%	0.617	24%	0.24	S	C	*	.	H	α-helix	trans	-62.1	-38.5	179.3	-73.5	173.5	3.2	0	0	112.4	A122 A123 A124 S130	A122-Q126 VanDerWaalsContact O-CG 3.29Å; A122-Q126 WeakPolarHBondContact O-CG 3.3Å; A122-Q126 PolarHBondContact O-N 3.36Å; A123-Q126 PolarHBondContact O-N 2.95Å; A124-Q126 VanDerWaalsContact C-N 3.33Å; A124-Q126 PolarHBondContact O-N 3.25Å; Q126-S130 WeakPolarHBondContact O-CB 3.48Å; Q126-S130 PolarHBondContact O-N 3.46Å; Q126-S130 PolarHBondContact O-OG 3.42Å
127	L	92.3	Very high	91.3	Very high	97 Å²	97	51.2 Å²	51.2	51%	0.508	26%	0.262	S	S	.	.	H	α-helix	trans	-61.7	-45.3	175.7	-72.4	172	0	0	0	111.4	A123 A124 V125 S130 S131	A123-L127 VanDerWaalsContact O-CG 3.32Å; A123-L127 WeakPolarHBondContact O-CG 3.48Å; A123-L127 PolarHBondContact O-N 3.37Å; A124-L127 PolarHBondContact O-N 2.9Å; V125-L127 VanDerWaalsContact C-N 3.32Å; V125-L127 PolarHBondContact O-N 3.12Å; L127-S130 WeakPolarHBondContact CA-OG 2.75Å; L127-S130 PolarHBondContact O-N 2.83Å; L127-S130 PolarHBondContact O-OG 3.1Å; L127-S131 WeakPolarHBondContact O-CB 3.39Å; L127-S131 PolarHBondContact O-N 3.43Å
128	R	91.4	Very high	90.6	Very high	39 Å²	39	56.3 Å²	56.3	15%	0.147	28%	0.28	C	S	.	.	H	α-helix	trans	-66.5	-43.3	179.5	-57.5	-58.3	158.9	-166.5	5	112.2	E84 W87 A124 V125 S131 Y132 D272	E84-R128 VanDerWaalsContact CD-CD 3.41Å; E84-R128 VanDerWaalsContact OE1-CD 3.32Å; E84-R128 WeakPolarHBondContact OE1-CD 3.28Å; E84-R128 IonicContact OE1-CZ 2.87Å; E84-R128 IonicContact OE1-NE 3.74Å; E84-R128 IonicContact OE1-NH1 3.83Å; E84-R128 PolarHBondContact OE1-NH1 3.5Å; E84-R128 WeakPolarHBondContact OE2-CA 3.43Å; E84-R128 WeakPolarHBondContact OE2-CB 3.36Å; E84-R128 WeakPolarHBondContact OE2-CD 3.44Å; E84-R128 WeakPolarHBondContact OE2-CG 3.42Å; W87-R128 HydrophobicContact CD2-CB 4.45Å; W87-R128 HydrophobicContact CD2-CG 4.11Å; W87-R128 HydrophobicContact CE3-CB 3.84Å; W87-R128 HydrophobicContact CE3-CG 3.95Å; W87-R128 HydrophobicContact CH2-CG 4.27Å; W87-R128 HydrophobicContact CZ2-CG 4.4Å; W87-R128 HydrophobicContact CZ3-CB 3.93Å; W87-R128 HydrophobicContact CZ3-CG 4.04Å; A124-R128 WeakPolarHBondContact O-CG 3.36Å; A124-R128 PolarHBondContact O-N 3.36Å; A124-R128 VanDerWaalsContact O-N 3.13Å; V125-R128 PolarHBondContact O-N 3.47Å; R128-S131 PolarHBondContact O-N 2.96Å; R128-Y132 WeakPolarHBondContact O-CB 3.13Å; R128-Y132 PolarHBondContact O-N 2.89Å; R128-D272 IonicContact CZ-OD1 3.19Å; R128-D272 IonicContact NH2-OD1 2.85Å; R128-D272 PolarHBondContact NH2-OD1 3.31Å; R128-D272 IonicContact NH2-OD2 3.11Å
129	V	90.5	Very high	89.7	Confident	22 Å²	22	58.1 Å²	58.1	13%	0.133	28%	0.283	C	S	.	.	H	α-helix	trans	-60.4	-48	174	171.1	0	0	0	0	111.6	L88 L96 V97 V125 Y132 Q133	L88-V129 HydrophobicContact CD2-CG2 3.8Å; L96-V129 HydrophobicContact CB-CG2 4.37Å; L96-V129 HydrophobicContact CD1-CG2 4Å; V97-V129 HydrophobicContact CG2-CG1 4.07Å; V97-V129 HydrophobicContact CG2-CG2 4.4Å; V125-V129 HydrophobicContact CG1-CG2 4.34Å; V125-V129 WeakPolarHBondContact O-CG2 3.49Å; V125-V129 PolarHBondContact O-N 2.99Å; V129-Y132 PolarHBondContact O-N 3.34Å; V129-Q133 HydrophobicContact CG1-CG 4.48Å; V129-Q133 WeakPolarHBondContact O-CG 3.33Å; V129-Q133 PolarHBondContact O-N 3.22Å
130	S	90.4	Very high	88.6	Confident	56 Å²	56	58.6 Å²	58.6	39%	0.392	29%	0.285	S	S	.	.	H	α-helix	trans	-67.2	-39.2	-179	58	0	0	0	0	112.6	Q126 L127 Q133 Q134	Q126-S130 WeakPolarHBondContact O-CB 3.48Å; Q126-S130 PolarHBondContact O-N 3.46Å; Q126-S130 PolarHBondContact O-OG 3.42Å; L127-S130 WeakPolarHBondContact CA-OG 2.75Å; L127-S130 PolarHBondContact O-N 2.83Å; L127-S130 PolarHBondContact O-OG 3.1Å; S130-Q133 PolarHBondContact O-N 3.29Å; S130-Q134 WeakPolarHBondContact O-CB 3.44Å; S130-Q134 PolarHBondContact O-N 3.26Å
131	S	88.2	Confident	87.4	Confident	14 Å²	14	63.3 Å²	63.3	10%	0.098	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-43.6	174.2	-178.2	0	0	0	0	112	E80 L127 R128 Q134 T135	E80-S131 PolarHBondContact OE1-OG 3.1Å; L127-S131 WeakPolarHBondContact O-CB 3.39Å; L127-S131 PolarHBondContact O-N 3.43Å; R128-S131 PolarHBondContact O-N 2.96Å; S131-Q134 PolarHBondContact O-N 2.87Å; S131-T135 PolarHBondContact O-N 3.44Å; S131-T135 PolarHBondContact O-OG1 3.48Å
132	Y	86.9	Confident	85.8	Confident	30 Å²	30	71.7 Å²	71.7	12%	0.118	34%	0.341	C	S	.	.	H	α-helix	trans	-62	-49.5	175.3	-178.4	-123.6	0	0	0	112	G81 E84 E85 L88 V97 R128 V129 Q134 T135 L136	G81-Y132 WeakPolarHBondContact O-CD2 3.33Å; E84-Y132 HydrophobicContact CB-CD2 4.43Å; E84-Y132 HydrophobicContact CB-CG 4.47Å; E85-Y132 HydrophobicContact CB-CD2 4.1Å; E85-Y132 HydrophobicContact CB-CE2 3.69Å; E85-Y132 HydrophobicContact CG-CE2 4.14Å; L88-Y132 HydrophobicContact CD1-CD1 4.06Å; L88-Y132 HydrophobicContact CD1-CG 4.32Å; V97-Y132 HydrophobicContact CB-CD1 3.62Å; V97-Y132 HydrophobicContact CB-CE1 3.58Å; V97-Y132 HydrophobicContact CG1-CD1 3.29Å; V97-Y132 HydrophobicContact CG1-CE1 3.31Å; V97-Y132 HydrophobicContact CG2-CD1 3.8Å; V97-Y132 HydrophobicContact CG2-CE1 4.25Å; R128-Y132 WeakPolarHBondContact O-CB 3.13Å; R128-Y132 PolarHBondContact O-N 2.89Å; V129-Y132 PolarHBondContact O-N 3.34Å; Y132-Q134 VanDerWaalsContact C-N 3.34Å; Y132-Q134 PolarHBondContact O-N 3.11Å; Y132-T135 WeakPolarHBondContact O-CB 3.29Å; Y132-T135 PolarHBondContact O-N 3.18Å; Y132-T135 VanDerWaalsContact O-N 3.11Å; Y132-L136 HydrophobicContact CD1-CD1 4.16Å; Y132-L136 HydrophobicContact CE1-CD1 3.63Å; Y132-L136 HydrophobicContact CE1-CG 4.29Å; Y132-L136 HydrophobicContact CE2-CD1 4.35Å; Y132-L136 HydrophobicContact CE2-CD2 4.16Å; Y132-L136 HydrophobicContact CE2-CG 4.14Å; Y132-L136 PolarHBondContact O-N 3Å
133	Q	87.2	Confident	83.8	Confident	90 Å²	90	78.4 Å²	78.4	42%	0.421	37%	0.367	S	S	.	.	H	α-helix	trans	-59.8	-41.9	177.4	-72.9	175.2	-16.2	0	0	112.3	V97 V129 S130 T135 L136 L137	V97-Q133 HydrophobicContact CG1-CG 3.87Å; V129-Q133 HydrophobicContact CG1-CG 4.48Å; V129-Q133 WeakPolarHBondContact O-CG 3.33Å; V129-Q133 PolarHBondContact O-N 3.22Å; S130-Q133 PolarHBondContact O-N 3.29Å; Q133-T135 VanDerWaalsContact C-N 3.3Å; Q133-T135 PolarHBondContact O-N 3.11Å; Q133-L136 PolarHBondContact O-N 3.42Å; Q133-L137 WeakPolarHBondContact O-CG 3.2Å; Q133-L137 PolarHBondContact O-N 3.26Å
134	Q	86.5	Confident	81.6	Confident	98 Å²	98	83.9 Å²	83.9	46%	0.458	39%	0.386	S	S	.	.	H	α-helix	trans	-62.7	-38.6	176.2	-169.9	178.5	25.4	0	0	111.5	S130 S131 Y132 L137 R138	S130-Q134 WeakPolarHBondContact O-CB 3.44Å; S130-Q134 PolarHBondContact O-N 3.26Å; S131-Q134 PolarHBondContact O-N 2.87Å; Y132-Q134 VanDerWaalsContact C-N 3.34Å; Y132-Q134 PolarHBondContact O-N 3.11Å; Q134-L137 PolarHBondContact O-N 3.32Å; Q134-R138 WeakPolarHBondContact O-CG 3.46Å; Q134-R138 PolarHBondContact O-N 2.91Å
135	T	83.7	Confident	79.3	Confident	5 Å²	5	90.7 Å²	90.7	3%	0.031	42%	0.421	C	S	.	.	H	α-helix	trans	-66.6	-41.6	175.3	-58.6	0	0	0	0	111.7	E79 G81 S131 Y132 Q133 L137 R138 R139	E79-T135 HydrophobicContact CG-CG2 4.27Å; G81-T135 PolarHBondContact N-OG1 3.08Å; S131-T135 PolarHBondContact O-N 3.44Å; S131-T135 PolarHBondContact O-OG1 3.48Å; Y132-T135 WeakPolarHBondContact O-CB 3.29Å; Y132-T135 PolarHBondContact O-N 3.18Å; Y132-T135 VanDerWaalsContact O-N 3.11Å; Q133-T135 VanDerWaalsContact C-N 3.3Å; Q133-T135 PolarHBondContact O-N 3.11Å; T135-L137 PolarHBondContact O-N 2.99Å; T135-R138 PolarHBondContact O-N 2.95Å; T135-R139 WeakPolarHBondContact O-CG 3.46Å; T135-R139 PolarHBondContact O-N 3.22Å
136	L	81.4	Confident	77.3	Confident	64 Å²	64	94.7 Å²	94.7	34%	0.335	45%	0.447	S	S	.	.	H	α-helix	trans	-60.4	-43.2	174.4	-70.3	179.8	0	0	0	112.1	V97 Y132 Q133 R138 R139 R140	V97-L136 HydrophobicContact CG1-CD1 4.18Å; Y132-L136 HydrophobicContact CD1-CD1 4.16Å; Y132-L136 HydrophobicContact CE1-CD1 3.63Å; Y132-L136 HydrophobicContact CE1-CG 4.29Å; Y132-L136 HydrophobicContact CE2-CD1 4.35Å; Y132-L136 HydrophobicContact CE2-CD2 4.16Å; Y132-L136 HydrophobicContact CE2-CG 4.14Å; Y132-L136 PolarHBondContact O-N 3Å; Q133-L136 PolarHBondContact O-N 3.42Å; L136-R138 PolarHBondContact O-N 2.85Å; L136-R139 PolarHBondContact O-N 2.93Å; L136-R140 PolarHBondContact O-N 2.95Å
137	L	81.9	Confident	75.6	Confident	103 Å²	103	92.7 Å²	92.7	54%	0.539	44%	0.44	S	S	.	.	H	α-helix	trans	-61.7	-43.4	175.3	-71.1	172.6	0	0	0	111.8	Q133 Q134 T135 R139 R140 N141	Q133-L137 WeakPolarHBondContact O-CG 3.2Å; Q133-L137 PolarHBondContact O-N 3.26Å; Q134-L137 PolarHBondContact O-N 3.32Å; T135-L137 PolarHBondContact O-N 2.99Å; L137-R139 VanDerWaalsContact C-N 3.32Å; L137-R139 PolarHBondContact O-N 2.78Å; L137-R140 PolarHBondContact O-N 3.49Å; L137-N141 WeakPolarHBondContact O-CB 3.39Å; L137-N141 VanDerWaalsContact O-CG 3.27Å; L137-N141 PolarHBondContact O-N 2.74Å
138	R	80.7	Confident	73.9	Confident	129 Å²	129	92.6 Å²	92.6	49%	0.487	44%	0.444	S	S	.	.	H	α-helix	trans	-61	-40	174.9	-74.4	176.1	179	173	4.3	111.9	Q134 T135 L136 N141 R142	Q134-R138 WeakPolarHBondContact O-CG 3.46Å; Q134-R138 PolarHBondContact O-N 2.91Å; T135-R138 PolarHBondContact O-N 2.95Å; L136-R138 PolarHBondContact O-N 2.85Å; R138-N141 PolarHBondContact O-N 3.21Å; R138-R142 WeakPolarHBondContact O-CB 3.38Å; R138-R142 PolarHBondContact O-N 3.13Å
139	R	77.9	Confident	72.3	Confident	77 Å²	77	100.2 Å²	100.2	29%	0.291	47%	0.473	S	S	.	.	H	α-helix	trans	-64.7	-45.9	175.9	-75	179.8	172.3	-171.2	-3.7	111.7	E79 E82 T135 L136 L137 N141 R142 Q143	E79-R139 IonicContact OE2-CZ 2.9Å; E79-R139 VanDerWaalsContact OE2-CZ 3.22Å; E79-R139 IonicContact OE2-NE 2.79Å; E79-R139 PolarHBondContact OE2-NE 3.25Å; E79-R139 IonicContact OE2-NH2 2.61Å; E79-R139 PolarHBondContact OE2-NH2 3.44Å; E82-R139 IonicContact OE1-NH2 2.72Å; E82-R139 PolarHBondContact OE1-NH2 2.94Å; T135-R139 WeakPolarHBondContact O-CG 3.46Å; T135-R139 PolarHBondContact O-N 3.22Å; L136-R139 PolarHBondContact O-N 2.93Å; L137-R139 VanDerWaalsContact C-N 3.32Å; L137-R139 PolarHBondContact O-N 2.78Å; R139-N141 VanDerWaalsContact C-N 3.35Å; R139-N141 PolarHBondContact O-N 2.87Å; R139-R142 PolarHBondContact O-N 3.38Å; R139-Q143 PolarHBondContact O-N 3.02Å
140	R	73.3	Confident	70.8	Confident	185 Å²	185	103 Å²	103	70%	0.698	49%	0.487	S	S	*	.	H	α-helix	trans	-61.5	-41.4	176.1	-173.9	176.8	173.8	176.8	-1.9	112	L136 L137 Q143 H144	L136-R140 PolarHBondContact O-N 2.95Å; L137-R140 PolarHBondContact O-N 3.49Å; R140-Q143 PolarHBondContact O-N 3.23Å; R140-H144 PolarHBondContact O-N 2.98Å
141	N	69.7	Low	69.2	Low	111 Å²	111	106.4 Å²	106.4	59%	0.594	50%	0.499	S	S	*	.	H	α-helix	trans	-69.9	-34	177.8	-70.8	-13.2	0	0	0	112.7	L137 R138 R139 Q143 H144	L137-N141 WeakPolarHBondContact O-CB 3.39Å; L137-N141 VanDerWaalsContact O-CG 3.27Å; L137-N141 PolarHBondContact O-N 2.74Å; R138-N141 PolarHBondContact O-N 3.21Å; R139-N141 VanDerWaalsContact C-N 3.35Å; R139-N141 PolarHBondContact O-N 2.87Å; N141-Q143 VanDerWaalsContact C-N 3.31Å; N141-Q143 PolarHBondContact O-N 3.4Å; N141-H144 CarbonylContact O-C 3.34Å; N141-H144 PolarHBondContact O-N 3.47Å; N141-H144 VanDerWaalsContact O-N 3.1Å
142	R	63.6	Low	67.5	Low	175 Å²	175	113.7 Å²	113.7	66%	0.66	53%	0.529	S	S	*	.	H	α-helix	trans	-65.1	-32.2	172.7	-87.8	-177.8	171.8	163	-1.2	113.2	E79 R138 R139 H144	E79-R142 IonicContact OE1-NH1 3.28Å; E79-R142 PolarHBondContact OE1-NH1 2.71Å; R138-R142 WeakPolarHBondContact O-CB 3.38Å; R138-R142 PolarHBondContact O-N 3.13Å; R139-R142 PolarHBondContact O-N 3.38Å; R142-H144 PolarHBondContact O-N 2.98Å
143	Q	55.7	Low	65.8	Low	170 Å²	170	121 Å²	121	79%	0.794	56%	0.557	S	S	*	*	H	α-helix	trans	-69.7	-18.4	173.6	-69.7	177.2	-6.8	0	0	112.2	R139 R140 N141 L145	R139-Q143 PolarHBondContact O-N 3.02Å; R140-Q143 PolarHBondContact O-N 3.23Å; N141-Q143 VanDerWaalsContact C-N 3.31Å; N141-Q143 PolarHBondContact O-N 3.4Å; Q143-L145 PolarHBondContact O-N 3.39Å
144	H	49.4	Very low	63.7	Low	158 Å²	158	121.8 Å²	121.8	73%	0.731	57%	0.569	S	S	*	*			trans	-97.6	48.5	176.9	-131.4	-18.2	0	0	0	111.7	R140 N141 R142	R140-H144 PolarHBondContact O-N 2.98Å; N141-H144 CarbonylContact O-C 3.34Å; N141-H144 PolarHBondContact O-N 3.47Å; N141-H144 VanDerWaalsContact O-N 3.1Å; R142-H144 PolarHBondContact O-N 2.98Å
145	L	46.3	Very low	61.5	Low	144 Å²	144	123 Å²	123	75%	0.754	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-66.7	126.2	158.8	-78.6	159.8	0	0	0	107.2	Q143 D147	Q143-L145 PolarHBondContact O-N 3.39Å; L145-D147 PolarHBondContact O-N 2.79Å
146	P	52.4	Low	59.2	Low	89 Å²	89	132.1 Å²	132.1	58%	0.578	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-55.2	138.5	172.8	-20.4	30.8	0	0	0	109.4	V148 D150	P146-V148 PolarHBondContact O-N 2.88Å; P146-D150 HydrophobicContact CB-CB 4.29Å
147	D	58.6	Low	57	Low	90 Å²	90	138 Å²	138	48%	0.481	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-54.6	139.8	172.1	-173.4	-20.3	0	0	0	107.8	L145 R149 D150	L145-D147 PolarHBondContact O-N 2.79Å; D147-R149 HydrophobicContact CB-CB 4.5Å; D147-R149 PolarHBondContact O-N 2.88Å; D147-R149 WeakPolarHBondContact OD1-CG 3.32Å; D147-R149 PolarHBondContact OD1-N 3.27Å; D147-D150 WeakPolarHBondContact O-CB 3.44Å; D147-D150 PolarHBondContact O-N 2.8Å
148	V	56.9	Low	54.7	Low	96 Å²	96	140 Å²	140	58%	0.582	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-53.3	-23.9	178	-179.6	0	0	0	0	111	P146 D150 I151 F152	P146-V148 PolarHBondContact O-N 2.88Å; V148-D150 PolarHBondContact O-N 2.81Å; V148-I151 HydrophobicContact CG1-CD1 4.44Å; V148-I151 WeakPolarHBondContact O-CB 3.36Å; V148-I151 PolarHBondContact O-N 3.06Å; V148-I151 VanDerWaalsContact O-N 3.16Å; V148-F152 HydrophobicContact CG1-CE2 4.34Å
149	R	56.9	Low	52.4	Low	199 Å²	199	143.1 Å²	143.1	75%	0.751	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-63	-23.2	173.2	-64.2	177.3	-177.8	-176.6	1.5	114.5	D147 I151	D147-R149 HydrophobicContact CB-CB 4.5Å; D147-R149 PolarHBondContact O-N 2.88Å; D147-R149 WeakPolarHBondContact OD1-CG 3.32Å; D147-R149 PolarHBondContact OD1-N 3.27Å; R149-I151 VanDerWaalsContact C-N 3.32Å
150	D	58.3	Low	50.2	Low	80 Å²	80	148.6 Å²	148.6	43%	0.428	71%	0.711	S	S	.	*	G	3₁₀ helix	trans	-80.5	-11.7	175.7	-71.9	-40.3	0	0	0	113.2	P146 D147 V148 R153	P146-D150 HydrophobicContact CB-CB 4.29Å; D147-D150 WeakPolarHBondContact O-CB 3.44Å; D147-D150 PolarHBondContact O-N 2.8Å; V148-D150 PolarHBondContact O-N 2.81Å; D150-R153 IonicContact OD1-CZ 3.81Å; D150-R153 IonicContact OD1-NH2 2.84Å; D150-R153 PolarHBondContact OD1-NH2 2.91Å
151	I	58.6	Low	48.5	Very low	127 Å²	127	145.3 Å²	145.3	65%	0.651	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-23.6	174.5	-58	175.4	0	0	0	111.3	V148 R149	V148-I151 HydrophobicContact CG1-CD1 4.44Å; V148-I151 WeakPolarHBondContact O-CB 3.36Å; V148-I151 PolarHBondContact O-N 3.06Å; V148-I151 VanDerWaalsContact O-N 3.16Å; R149-I151 VanDerWaalsContact C-N 3.32Å
152	F	51.9	Low	46.7	Very low	167 Å²	167	146.1 Å²	146.1	73%	0.732	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	13.2	-177.3	-67.9	-76.7	0	0	0	114.2	V148 P154	V148-F152 HydrophobicContact CG1-CE2 4.34Å; F152-P154 WeakPolarHBondContact O-CD 3.36Å
153	R	50.4	Low	45.1	Very low	184 Å²	184	147.5 Å²	147.5	69%	0.694	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-72	119.5	173.8	-164	178.5	-62.6	177.9	5.6	108.9	D150	D150-R153 IonicContact OD1-CZ 3.81Å; D150-R153 IonicContact OD1-NH2 2.84Å; D150-R153 PolarHBondContact OD1-NH2 2.91Å
154	P	42.7	Very low	43.8	Very low	106 Å²	106	147.7 Å²	147.7	69%	0.688	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-67.5	144.1	-179.8	26.2	-30.4	0	0	0	110.1	F152 E156	F152-P154 WeakPolarHBondContact O-CD 3.36Å; P154-E156 PolarHBondContact O-N 3.36Å
155	P	42.2	Very low	42.8	Very low	123 Å²	123	149.5 Å²	149.5	80%	0.799	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-73.5	125.5	-172.1	28.2	-32.3	0	0	0	110.9
156	E	35.1	Very low	42	Very low	197 Å²	197	152 Å²	152	92%	0.921	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-73.3	139.3	158.8	-71.8	-169.7	165.7	0	0	109.5	P154	P154-E156 PolarHBondContact O-N 3.36Å
157	K	35.3	Very low	40.8	Very low	187 Å²	187	151.7 Å²	151.7	81%	0.813	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-75.9	146.8	-170.6	-86.3	177.9	171.7	178.1	0	112.9
158	N	32.2	Very low	39.5	Very low	146 Å²	146	152.2 Å²	152.2	78%	0.781	78%	0.781	S	S	*	*			trans	88.5	109.4	156.7	-52.6	-23.4	0	0	0	116.6
159	E	32.6	Very low	38.2	Very low	194 Å²	194	155.5 Å²	155.5	91%	0.907	80%	0.796	S	S	*	*				-168.7	151.3	87.1	-89.7	-177.4	175.5	0	0	110.1
160	E	32.8	Very low	36.9	Very low	193 Å²	193	155.1 Å²	155.1	90%	0.902	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-73	155.3	-170.8	-71	177.8	145.4	0	0	114.8
161	P	36.6	Very low	35.4	Very low	116 Å²	116	158.9 Å²	158.9	75%	0.753	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-94.4	154.3	174	36	-31.4	0	0	0	113.1
162	P	33.1	Very low	33.9	Very low	127 Å²	127	156.9 Å²	156.9	83%	0.825	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-86.1	149.2	164.1	33	-27.6	0	0	0	112.1
163	K	29.2	Very low	32.7	Very low	205 Å²	205	155.3 Å²	155.3	89%	0.891	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-66.6	147.4	-169.4	-69.6	165.4	172.1	174.1	0	114.7
164	L	29.2	Very low	31.6	Very low	174 Å²	174	153.6 Å²	153.6	91%	0.911	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-83.1	135.6	160.6	-71.4	159.4	0	0	0	109.5
165	E	28.7	Very low	30.9	Very low	195 Å²	195	153 Å²	153	91%	0.911	84%	0.84	S	S	*	*			trans	-108.3	125.2	158.1	-77.6	-160.1	162.6	0	0	109.4
166	E	29.2	Very low	30.2	Very low	198 Å²	198	150.8 Å²	150.8	93%	0.925	84%	0.84	S	S	*	*			trans	-82.8	136.3	166.8	-72.4	180	149.2	0	0	109.6
167	G	27.4	Very low	29.8	Very low	81 Å²	81	150.5 Å²	150.5	84%	0.835	84%	0.841	S	S	*	*			trans	-139.2	100.6	170	0	0	0	0	0	110.3
168	S	29.9	Very low	29.4	Very low	101 Å²	101	147.1 Å²	147.1	71%	0.706	84%	0.841	S	S	*	*			trans	-72	142.9	164.8	124.9	0	0	0	0	109.3
169	D	29.9	Very low	29.1	Very low	166 Å²	166	151.6 Å²	151.6	89%	0.888	85%	0.847	S	S	*	*			trans	-159	149.7	141.2	-101.2	-25.5	0	0	0	114.8
170	K	30.2	Very low	28.8	Very low	191 Å²	191	149.8 Å²	149.8	83%	0.83	84%	0.843	S	S	*	*			trans	-98.1	162.1	-169.5	-67.9	174.4	175	175.1	0	113
171	D	26.6	Very low	28.6	Very low	159 Å²	159	147.5 Å²	147.5	85%	0.85	84%	0.843	S	S	*	*			trans	-9.7	141.5	161.8	-65	-38.2	0	0	0	120.4
172	A	27.2	Very low	28	Very low	84 Å²	84	145.6 Å²	145.6	69%	0.694	84%	0.844	S	S	*	*				160.4	132.4	95.1	0	0	0	0	0	114.5
173	T	26.7	Very low	27.7	Very low	134 Å²	134	149 Å²	149	82%	0.822	85%	0.849	S	S	*	*			trans	45.2	128.5	146.5	34.9	0	0	0	0	122.9
174	T	27.5	Very low	27.5	Very low	149 Å²	149	151.2 Å²	151.2	91%	0.914	85%	0.852	S	S	*	*			trans	-150.2	135.3	130.1	-52.5	0	0	0	0	110.9
175	A	26.9	Very low	27.4	Very low	93 Å²	93	148.3 Å²	148.3	77%	0.769	85%	0.846	S	S	*	*			trans	-78.4	151.9	-178.2	0	0	0	0	0	113.4
176	G	27.5	Very low	27.3	Very low	77 Å²	77	146.9 Å²	146.9	79%	0.794	84%	0.843	S	S	*	*			trans	-145	107.4	167.7	0	0	0	0	0	110.9
177	M	26.5	Very low	27.2	Very low	191 Å²	191	143.1 Å²	143.1	94%	0.941	84%	0.838	S	S	*	*			trans	-56.9	134.4	175.5	-91.1	76.7	139.6	0	0	112.4
178	S	28.1	Very low	27.1	Very low	115 Å²	115	142.8 Å²	142.8	80%	0.804	84%	0.835	S	S	*	*			trans	-111.2	131.6	163	-163.6	0	0	0	0	110
179	R	26.4	Very low	27.2	Very low	240 Å²	240	145.6 Å²	145.6	91%	0.906	84%	0.842	S	S	*	*			trans	-90.3	126.2	178.8	-82	177.2	167.8	160.5	-3.6	109.5
180	N	26.1	Very low	27	Very low	157 Å²	157	146.5 Å²	146.5	84%	0.84	84%	0.838	S	S	*	*			trans	-76.5	137.1	170.3	-74.6	-16.7	0	0	0	111.1
181	T	27.3	Very low	27.2	Very low	144 Å²	144	144.3 Å²	144.3	88%	0.883	84%	0.841	S	S	*	*			trans	-127.7	114.3	153.9	41.2	0	0	0	0	107.2
182	G	24.9	Very low	27.2	Very low	76 Å²	76	142.6 Å²	142.6	78%	0.784	84%	0.836	S	S	*	*			trans	-90.8	146.8	178.6	0	0	0	0	0	111.6
183	E	26.8	Very low	27.6	Very low	200 Å²	200	143.9 Å²	143.9	94%	0.935	84%	0.838	S	S	*	*			trans	-127.5	131.2	160.4	-79.8	-174.3	151.9	0	0	109.1
184	R	25.5	Very low	28.3	Very low	251 Å²	251	143.2 Å²	143.2	95%	0.947	83%	0.825	S	S	*	*			trans	-98.3	136.1	174.7	-89.8	177.8	172.6	176	-2.3	108.9
185	S	25.4	Very low	29.1	Very low	113 Å²	113	141 Å²	141	79%	0.79	81%	0.812	S	S	*	*			trans	-153.5	96.2	156.2	39.2	0	0	0	0	108.2
186	I	27.7	Very low	30.6	Very low	164 Å²	164	141.9 Å²	141.9	84%	0.841	80%	0.8	S	S	*	*				62.1	106.2	105.3	-58.1	174	0	0	0	113.5
187	S	27.8	Very low	33	Very low	119 Å²	119	142.5 Å²	142.5	83%	0.832	78%	0.783	S	S	*	*			trans	-60.2	130.8	168.6	50.3	0	0	0	0	112.6
188	G	25.2	Very low	35.5	Very low	74 Å²	74	140 Å²	140	76%	0.763	77%	0.769	S	S	*	*			trans	-129.7	106.4	165.3	0	0	0	0	0	109.4	K190	G188-K190 PolarHBondContact O-N 2.65Å
189	D	30.5	Very low	38.2	Very low	161 Å²	161	135 Å²	135	86%	0.861	73%	0.734	S	S	*	*			trans	-66.5	116.7	173.4	-171.6	16.1	0	0	0	110
190	K	27.1	Very low	41.2	Very low	185 Å²	185	126 Å²	126	80%	0.804	70%	0.704	S	S	*	*			trans	-148.6	116.4	165.5	-82.7	-169.1	178.1	175.8	0	109.2	G188 T192	G188-K190 PolarHBondContact O-N 2.65Å; K190-T192 PolarHBondContact O-N 3.26Å
191	T	33.2	Very low	44.2	Very low	145 Å²	145	119.2 Å²	119.2	89%	0.89	67%	0.668	S	S	*	*			trans	-44.3	112	163.8	28.7	0	0	0	0	111.4
192	T	27.5	Very low	47.1	Very low	122 Å²	122	116.7 Å²	116.7	75%	0.748	65%	0.646	S	S	*	*			trans	-92	142.9	177.2	42.3	0	0	0	0	111.6	K190	K190-T192 PolarHBondContact O-N 3.26Å
193	P	35	Very low	50.4	Low	112 Å²	112	116.1 Å²	116.1	73%	0.727	63%	0.627	S	S	*	*			trans	-69.9	148.9	173.6	31.2	-32.8	0	0	0	109.9	T195	P193-T195 PolarHBondContact O-N 2.77Å; P193-T195 VanDerWaalsContact O-N 3.07Å
194	E	40.7	Very low	53.7	Low	120 Å²	120	106.8 Å²	106.8	56%	0.561	58%	0.584	S	S	*	*			trans	-50.3	115.1	178.9	-62.8	-178.8	170.2	0	0	110.2	E196 K232	E194-E196 PolarHBondContact O-N 3.25Å; E194-E196 VanDerWaalsContact O-N 3.09Å; E194-K232 IonicContact OE1-NZ 2.97Å; E194-K232 PolarHBondContact OE1-NZ 2.78Å
195	T	45.8	Very low	57.1	Low	103 Å²	103	95.1 Å²	95.1	63%	0.632	54%	0.54	S	S	*	.			trans	-73.9	103.6	-176	-44.1	0	0	0	0	109	P193 M197	P193-T195 PolarHBondContact O-N 2.77Å; P193-T195 VanDerWaalsContact O-N 3.07Å; T195-M197 PolarHBondContact O-N 3.24Å
196	E	58.8	Low	60.4	Low	111 Å²	111	89.8 Å²	89.8	52%	0.519	50%	0.503	S	S	.	.			trans	-63.2	128.6	171.4	-62.5	-169.6	162.1	0	0	109.4	E194 K237	E194-E196 PolarHBondContact O-N 3.25Å; E194-E196 VanDerWaalsContact O-N 3.09Å; E196-K237 WeakPolarHBondContact OE1-CE 3.26Å; E196-K237 IonicContact OE1-NZ 2.78Å; E196-K237 PolarHBondContact OE1-NZ 3.17Å; E196-K237 WeakPolarHBondContact OE2-CE 3.06Å; E196-K237 IonicContact OE2-NZ 2.98Å; E196-K237 PolarHBondContact OE2-NZ 2.71Å
197	M	77.2	Confident	63.7	Low	90 Å²	90	83.4 Å²	83.4	44%	0.443	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.5	-178.9	-65.2	-168.3	-174.6	0	0	110.3	T195 P234 N235 F236 K237	T195-M197 PolarHBondContact O-N 3.24Å; M197-P234 HydrophobicContact CE-CB 4.2Å; M197-P234 HydrophobicContact CG-CB 4.42Å; M197-P234 HydrophobicContact SD-CB 4.02Å; M197-N235 PolarHBondContact N-O 3.42Å; M197-F236 HydrophobicContact CB-CD1 3.61Å; M197-F236 HydrophobicContact CB-CE1 3.58Å; M197-F236 HydrophobicContact CG-CE1 4.34Å; M197-F236 VanDerWaalsContact O-CA 3.32Å; M197-F236 WeakPolarHBondContact O-CA 3.42Å; M197-F236 HydrophobicContact SD-CE1 3.92Å; M197-F236 HydrophobicContact SD-CZ 4.24Å; M197-K237 PolarHBondContact O-N 2.93Å; M197-K237 VanDerWaalsContact O-N 3.1Å
198	E	78.9	Confident	66.8	Low	139 Å²	139	79.1 Å²	79.1	65%	0.65	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	129.6	179.8	-65.6	-178.5	173.7	0	0	112.1
199	L	84.9	Confident	70	Confident	10 Å²	10	75.9 Å²	75.9	5%	0.052	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	106.5	170.7	-72.4	170.2	0	0	0	109.7	V201 F236 K237 L239 K404 L407 L492	L199-V201 PolarHBondContact O-N 2.92Å; L199-F236 HydrophobicContact CD1-CB 3.7Å; L199-F236 HydrophobicContact CD1-CD1 4.37Å; L199-F236 HydrophobicContact CD1-CG 4.16Å; L199-F236 HydrophobicContact CD2-CD1 3.92Å; L199-F236 HydrophobicContact CD2-CE1 4.35Å; L199-F236 HydrophobicContact CD2-CG 4.41Å; L199-F236 HydrophobicContact CG-CB 3.99Å; L199-F236 HydrophobicContact CG-CD1 3.85Å; L199-F236 HydrophobicContact CG-CG 4.14Å; L199-K237 PolarHBondContact N-O 2.83Å; L199-L239 PolarHBondContact O-N 3.01Å; L199-K404 HydrophobicContact CD2-CD 4.34Å; L199-K404 HydrophobicContact CD2-CG 3.76Å; L199-L407 HydrophobicContact CD1-CD2 3.72Å; L199-L407 HydrophobicContact CD1-CG 4.47Å; L199-L492 HydrophobicContact CD1-CD1 3.85Å
200	N	88.2	Confident	73	Confident	51 Å²	51	69.8 Å²	69.8	27%	0.273	37%	0.369	S	S	.	.			trans	-71.4	117.5	166.4	-176.5	-14.4	0	0	0	109.2	E202 V203 Q208	N200-E202 WeakPolarHBondContact OD1-CB 3.49Å; N200-E202 PolarHBondContact OD1-N 3.5Å; N200-V203 PolarHBondContact OD1-N 3.35Å; N200-Q208 PolarHBondContact O-NE2 3.39Å
201	V	89.6	Confident	76.1	Confident	14 Å²	14	64 Å²	64	9%	0.085	35%	0.352	C	S	.	.			trans	-113.3	9.3	176.2	-64.6	0	0	0	0	113.2	L199 F205 L238 P497 K498 F499	L199-V201 PolarHBondContact O-N 2.92Å; V201-F205 HydrophobicContact CG1-CE1 4.11Å; V201-F205 HydrophobicContact CG1-CZ 4.15Å; V201-L238 HydrophobicContact CB-CD1 4.35Å; V201-L238 HydrophobicContact CG1-CD1 3.44Å; V201-L238 VanDerWaalsContact CG1-CD1 3.44Å; V201-L238 HydrophobicContact CG1-CG 4.22Å; V201-L238 HydrophobicContact CG2-CD1 4.04Å; V201-L238 HydrophobicContact CG2-CD2 4.09Å; V201-L238 HydrophobicContact CG2-CG 3.93Å; V201-P497 HydrophobicContact CB-CB 4.32Å; V201-K498 HydrophobicContact CG2-CB 4.29Å; V201-K498 WeakPolarHBondContact O-CA 3.48Å; V201-K498 WeakPolarHBondContact O-CB 3.33Å; V201-K498 PolarHBondContact O-N 2.92Å; V201-F499 WeakPolarHBondContact O-CD1 3.33Å; V201-F499 PolarHBondContact O-N 3.42Å
202	E	89.1	Confident	78.8	Confident	90 Å²	90	61.4 Å²	61.4	42%	0.421	33%	0.326	S	S	.	.	S	Bend	trans	-89.1	-24.8	175.8	-48.2	-157.1	132.9	0	0	112.5	N200 K498 F499	N200-E202 WeakPolarHBondContact OD1-CB 3.49Å; N200-E202 PolarHBondContact OD1-N 3.5Å; E202-K498 HydrophobicContact CG-CD 4.15Å; E202-K498 IonicContact OE1-NZ 3.95Å; E202-K498 PolarHBondContact OE1-NZ 2.58Å; E202-F499 VanDerWaalsContact O-CB 3.31Å; E202-F499 WeakPolarHBondContact O-CB 3.37Å
203	V	92.9	Very high	81.7	Confident	64 Å²	64	60.8 Å²	60.8	39%	0.388	31%	0.31	S	S	.	.	S	Bend	trans	-105.7	138.6	176.5	-177.2	0	0	0	0	109.1	N200 F205 E207 Q208	N200-V203 PolarHBondContact OD1-N 3.35Å; V203-F205 PolarHBondContact O-N 3.06Å; V203-E207 HydrophobicContact CG1-CB 4.08Å; V203-Q208 HydrophobicContact CB-CG 4.22Å; V203-Q208 HydrophobicContact CG1-CG 4.05Å; V203-Q208 PolarHBondContact O-NE2 3.31Å
204	A	96.3	Very high	84.2	Confident	4 Å²	4	58.3 Å²	58.3	3%	0.033	29%	0.291	C	S	.	.			trans	-51.5	138.5	174.6	0	0	0	0	0	111.7	T118 S206 E207 Q208 F499	T118-A204 HydrophobicContact CG2-CB 3.84Å; A204-S206 VanDerWaalsContact C-N 3.31Å; A204-S206 PolarHBondContact O-N 3.47Å; A204-E207 HydrophobicContact CB-CB 4.38Å; A204-E207 HydrophobicContact CB-CG 4.03Å; A204-E207 PolarHBondContact O-N 3.41Å; A204-Q208 WeakPolarHBondContact O-CG 3.49Å; A204-Q208 PolarHBondContact O-N 3.22Å; A204-Q208 VanDerWaalsContact O-N 3.08Å; A204-F499 HydrophobicContact CB-CD2 3.91Å; A204-F499 HydrophobicContact CB-CE2 3.85Å; A204-F499 HydrophobicContact CB-CG 4.44Å; A204-F499 HydrophobicContact CB-CZ 4.36Å
205	F	96.6	Very high	86.3	Confident	7 Å²	7	57 Å²	57	3%	0.031	29%	0.288	C	S	.	.	H	α-helix	trans	-65.5	-36.3	-177.3	-60.7	-22.1	0	0	0	111.5	V201 V203 Q208 A209 E266 L270 Q408 L412 P497 F499	V201-F205 HydrophobicContact CG1-CE1 4.11Å; V201-F205 HydrophobicContact CG1-CZ 4.15Å; V203-F205 PolarHBondContact O-N 3.06Å; F205-Q208 WeakPolarHBondContact O-CB 3.36Å; F205-Q208 PolarHBondContact O-N 3.35Å; F205-A209 WeakPolarHBondContact O-CB 3.38Å; F205-A209 PolarHBondContact O-N 2.87Å; F205-E266 VanDerWaalsContact CA-OE1 3.31Å; F205-E266 WeakPolarHBondContact CA-OE1 3.18Å; F205-E266 WeakPolarHBondContact CB-OE1 3.41Å; F205-E266 PolarHBondContact N-OE1 3.27Å; F205-L270 HydrophobicContact CB-CD1 4.46Å; F205-L270 HydrophobicContact CB-CD2 4.45Å; F205-Q408 HydrophobicContact CB-CB 4.12Å; F205-Q408 HydrophobicContact CB-CG 4.29Å; F205-Q408 HydrophobicContact CD1-CB 4.37Å; F205-Q408 HydrophobicContact CD1-CG 3.77Å; F205-Q408 HydrophobicContact CD2-CB 3.51Å; F205-Q408 HydrophobicContact CD2-CG 3.78Å; F205-Q408 HydrophobicContact CE1-CG 3.92Å; F205-Q408 HydrophobicContact CE2-CB 3.91Å; F205-Q408 HydrophobicContact CE2-CG 3.94Å; F205-Q408 HydrophobicContact CG-CB 3.76Å; F205-Q408 HydrophobicContact CG-CG 3.69Å; F205-Q408 HydrophobicContact CZ-CB 4.47Å; F205-Q408 HydrophobicContact CZ-CG 4Å; F205-L412 HydrophobicContact CD2-CD1 3.96Å; F205-L412 HydrophobicContact CD2-CD2 4.14Å; F205-L412 HydrophobicContact CD2-CG 3.99Å; F205-L412 HydrophobicContact CE2-CD2 4.24Å; F205-L412 HydrophobicContact CE2-CG 4.27Å; F205-P497 HydrophobicContact CE2-CB 4.5Å; F205-P497 HydrophobicContact CE2-CG 3.82Å; F205-P497 HydrophobicContact CZ-CB 4Å; F205-P497 HydrophobicContact CZ-CG 3.69Å; F205-F499 AromaticContact CD1-CE1 3.83Å; F205-F499 HydrophobicContact CD1-CE1 3.83Å; F205-F499 HydrophobicContact CD1-CZ 4.48Å; F205-F499 HydrophobicContact CD2-CE1 4.3Å; F205-F499 HydrophobicContact CD2-CZ 4.4Å; F205-F499 AromaticContact CE1-CE1 3.82Å; F205-F499 HydrophobicContact CE1-CE1 3.82Å; F205-F499 HydrophobicContact CE2-CE1 4.28Å; F205-F499 HydrophobicContact CG-CE1 4.1Å; F205-F499 HydrophobicContact CG-CZ 4.32Å; F205-F499 HydrophobicContact CZ-CE1 4.05Å
206	S	96.4	Very high	87.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-39.5	173	59.2	0	0	0	0	112.8	T120 A204 A209 L210 E266	T120-S206 WeakPolarHBondContact OG1-CB 3.36Å; T120-S206 PolarHBondContact OG1-OG 3.08Å; A204-S206 VanDerWaalsContact C-N 3.31Å; A204-S206 PolarHBondContact O-N 3.47Å; S206-A209 PolarHBondContact O-N 3.25Å; S206-L210 WeakPolarHBondContact O-CB 2.98Å; S206-L210 PolarHBondContact O-N 3.31Å; S206-E266 PolarHBondContact N-OE1 3.36Å; S206-E266 PolarHBondContact OG-OE1 2.92Å; S206-E266 PolarHBondContact OG-OE2 3.4Å
207	E	95.9	Very high	88.3	Confident	31 Å²	31	55.9 Å²	55.9	15%	0.145	28%	0.278	C	S	.	.	H	α-helix	trans	-69.6	-37.4	175.9	-64.8	-65.4	161.5	0	0	111.6	R119 T120 V203 A204 A209 L210 S211	R119-E207 PolarHBondContact N-OE1 3.4Å; R119-E207 IonicContact NH2-OE2 2.7Å; T120-E207 WeakPolarHBondContact CB-OE1 3.41Å; T120-E207 HydrophobicContact CG2-CG 4.42Å; T120-E207 VanDerWaalsContact CG2-OE1 3.3Å; T120-E207 WeakPolarHBondContact CG2-OE1 3.44Å; T120-E207 PolarHBondContact N-OE1 3.42Å; T120-E207 WeakPolarHBondContact OG1-CG 3.46Å; T120-E207 PolarHBondContact OG1-OE1 2.77Å; V203-E207 HydrophobicContact CG1-CB 4.08Å; A204-E207 HydrophobicContact CB-CB 4.38Å; A204-E207 HydrophobicContact CB-CG 4.03Å; A204-E207 PolarHBondContact O-N 3.41Å; E207-A209 VanDerWaalsContact C-N 3.35Å; E207-L210 PolarHBondContact O-N 2.83Å; E207-S211 WeakPolarHBondContact O-CB 3.32Å; E207-S211 PolarHBondContact O-N 3.01Å; E207-S211 PolarHBondContact O-OG 2.99Å
208	Q	93.9	Very high	87.5	Confident	29 Å²	29	61.3 Å²	61.3	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-63.4	-42.2	172.8	-67	-179	51.5	0	0	111.2	N200 V203 A204 F205 S211 Y212	N200-Q208 PolarHBondContact O-NE2 3.39Å; V203-Q208 HydrophobicContact CB-CG 4.22Å; V203-Q208 HydrophobicContact CG1-CG 4.05Å; V203-Q208 PolarHBondContact O-NE2 3.31Å; A204-Q208 WeakPolarHBondContact O-CG 3.49Å; A204-Q208 PolarHBondContact O-N 3.22Å; A204-Q208 VanDerWaalsContact O-N 3.08Å; F205-Q208 WeakPolarHBondContact O-CB 3.36Å; F205-Q208 PolarHBondContact O-N 3.35Å; Q208-S211 PolarHBondContact O-N 3.46Å; Q208-Y212 WeakPolarHBondContact O-CB 3.47Å; Q208-Y212 PolarHBondContact O-N 3.12Å
209	A	92.7	Very high	86.4	Confident	5 Å²	5	60 Å²	60	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	-66.5	-41.6	177.4	0	0	0	0	0	112.2	F205 S206 E207 Y212 R213 L270 Q405	F205-A209 WeakPolarHBondContact O-CB 3.38Å; F205-A209 PolarHBondContact O-N 2.87Å; S206-A209 PolarHBondContact O-N 3.25Å; E207-A209 VanDerWaalsContact C-N 3.35Å; A209-Y212 WeakPolarHBondContact O-CB 3.42Å; A209-Y212 PolarHBondContact O-N 3.11Å; A209-R213 WeakPolarHBondContact O-CB 3.49Å; A209-R213 PolarHBondContact O-N 3.05Å; A209-L270 HydrophobicContact CB-CD1 3.6Å; A209-Q405 HydrophobicContact CB-CG 4.5Å
210	L	93.2	Very high	84.8	Confident	34 Å²	34	69.2 Å²	69.2	18%	0.178	33%	0.33	C	S	.	.	H	α-helix	trans	-60.9	-47	173.9	-176.9	63.1	0	0	0	111.4	R119 T120 S206 E207 Y212 R213 D214 T273	R119-L210 VanDerWaalsContact NH2-CD2 3.35Å; T120-L210 HydrophobicContact CG2-CB 4.29Å; T120-L210 HydrophobicContact CG2-CD2 3.68Å; S206-L210 WeakPolarHBondContact O-CB 2.98Å; S206-L210 PolarHBondContact O-N 3.31Å; E207-L210 PolarHBondContact O-N 2.83Å; L210-Y212 VanDerWaalsContact C-N 3.29Å; L210-Y212 PolarHBondContact O-N 3.16Å; L210-R213 WeakPolarHBondContact O-CB 3.45Å; L210-R213 PolarHBondContact O-N 3.15Å; L210-R213 VanDerWaalsContact O-N 3.14Å; L210-D214 PolarHBondContact O-N 3Å; L210-T273 HydrophobicContact CB-CG2 4.42Å
211	S	92.1	Very high	82.5	Confident	62 Å²	62	70.9 Å²	70.9	43%	0.434	34%	0.342	S	S	.	.	H	α-helix	trans	-60	-40.6	177.5	-57.8	0	0	0	0	111.9	E207 Q208 N215	E207-S211 WeakPolarHBondContact O-CB 3.32Å; E207-S211 PolarHBondContact O-N 3.01Å; E207-S211 PolarHBondContact O-OG 2.99Å; Q208-S211 PolarHBondContact O-N 3.46Å; S211-N215 WeakPolarHBondContact O-CB 3.36Å; S211-N215 PolarHBondContact O-N 2.88Å; S211-N215 VanDerWaalsContact O-N 3.08Å; S211-N215 PolarHBondContact O-ND2 3.05Å
212	Y	89.2	Confident	80.3	Confident	92 Å²	92	77.9 Å²	77.9	36%	0.361	38%	0.379	S	S	.	.	H	α-helix	trans	-62.6	-45.2	174.5	176.4	-95.8	0	0	0	112	Q208 A209 L210 N215 N216 P401 T402	Q208-Y212 WeakPolarHBondContact O-CB 3.47Å; Q208-Y212 PolarHBondContact O-N 3.12Å; A209-Y212 WeakPolarHBondContact O-CB 3.42Å; A209-Y212 PolarHBondContact O-N 3.11Å; L210-Y212 VanDerWaalsContact C-N 3.29Å; L210-Y212 PolarHBondContact O-N 3.16Å; Y212-N215 PolarHBondContact O-N 2.85Å; Y212-N216 WeakPolarHBondContact CE1-ND2 3.2Å; Y212-N216 VanDerWaalsContact CE2-ND2 3.32Å; Y212-N216 WeakPolarHBondContact CE2-ND2 3.5Å; Y212-N216 WeakPolarHBondContact O-CB 3.49Å; Y212-N216 PolarHBondContact O-N 3.42Å; Y212-N216 PolarHBondContact O-ND2 3.15Å; Y212-N216 PolarHBondContact OH-ND2 2.83Å; Y212-P401 HydrophobicContact CE1-CB 4.34Å; Y212-P401 HydrophobicContact CE1-CG 4.12Å; Y212-T402 HydrophobicContact CE1-CG2 3.87Å; Y212-T402 HydrophobicContact CE2-CG2 3.85Å; Y212-T402 VanDerWaalsContact CZ-CG2 3.41Å; Y212-T402 WeakPolarHBondContact OH-CG2 3.37Å
213	R	87.8	Confident	77.8	Confident	108 Å²	108	79.1 Å²	79.1	41%	0.408	39%	0.388	S	S	.	.	H	α-helix	trans	-62.2	-47.7	177.8	179.8	178	174.2	170.3	-2.4	111.5	A209 L210 N215 N216 Q217 T273	A209-R213 WeakPolarHBondContact O-CB 3.49Å; A209-R213 PolarHBondContact O-N 3.05Å; L210-R213 WeakPolarHBondContact O-CB 3.45Å; L210-R213 PolarHBondContact O-N 3.15Å; L210-R213 VanDerWaalsContact O-N 3.14Å; R213-N215 VanDerWaalsContact C-N 3.33Å; R213-N215 PolarHBondContact O-N 3.13Å; R213-N216 PolarHBondContact O-N 3.38Å; R213-Q217 HydrophobicContact CG-CG 4.41Å; R213-Q217 VanDerWaalsContact NE-NE2 3.14Å; R213-Q217 WeakPolarHBondContact O-CB 3.39Å; R213-Q217 WeakPolarHBondContact O-CG 3.14Å; R213-Q217 PolarHBondContact O-N 3.22Å; R213-T273 WeakPolarHBondContact CD-O 3.31Å; R213-T273 PolarHBondContact NH1-O 3.36Å
214	D	87.6	Confident	75.2	Confident	60 Å²	60	82.1 Å²	82.1	32%	0.321	41%	0.412	S	S	.	.	H	α-helix	trans	-61.7	-42.3	-179.7	-73.8	-8.7	0	0	0	111.5	L210 Q217 R218	L210-D214 PolarHBondContact O-N 3Å; D214-Q217 PolarHBondContact O-N 3.2Å; D214-R218 WeakPolarHBondContact O-CB 3.36Å; D214-R218 VanDerWaalsContact O-CG 3.26Å; D214-R218 WeakPolarHBondContact O-CG 3.47Å; D214-R218 PolarHBondContact O-N 3.07Å
215	N	86.1	Confident	72.5	Confident	92 Å²	92	86.7 Å²	86.7	49%	0.492	44%	0.444	S	S	.	.	H	α-helix	trans	-65.9	-42.2	177.8	-71.9	-18.4	0	0	0	112.2	S211 Y212 R213 R218 L219	S211-N215 WeakPolarHBondContact O-CB 3.36Å; S211-N215 PolarHBondContact O-N 2.88Å; S211-N215 VanDerWaalsContact O-N 3.08Å; S211-N215 PolarHBondContact O-ND2 3.05Å; Y212-N215 PolarHBondContact O-N 2.85Å; R213-N215 VanDerWaalsContact C-N 3.33Å; R213-N215 PolarHBondContact O-N 3.13Å; N215-R218 PolarHBondContact O-N 3.21Å; N215-L219 PolarHBondContact O-N 3Å
216	N	79.8	Confident	69.7	Low	76 Å²	76	92.9 Å²	92.9	41%	0.406	48%	0.476	S	S	.	.	H	α-helix	trans	-72.3	-28.8	177.1	-78.5	-27.1	0	0	0	113.5	Y212 R213 L219	Y212-N216 WeakPolarHBondContact CE1-ND2 3.2Å; Y212-N216 VanDerWaalsContact CE2-ND2 3.32Å; Y212-N216 WeakPolarHBondContact CE2-ND2 3.5Å; Y212-N216 WeakPolarHBondContact O-CB 3.49Å; Y212-N216 PolarHBondContact O-N 3.42Å; Y212-N216 PolarHBondContact O-ND2 3.15Å; Y212-N216 PolarHBondContact OH-ND2 2.83Å; R213-N216 PolarHBondContact O-N 3.38Å; N216-L219 CarbonylContact O-C 3.09Å
217	Q	67	Low	66.9	Low	116 Å²	116	100.7 Å²	100.7	54%	0.542	52%	0.518	S	S	.	.	H	α-helix	trans	-72.9	-32.5	173	-74.3	-177	0.7	0	0	112.1	R213 D214	R213-Q217 HydrophobicContact CG-CG 4.41Å; R213-Q217 VanDerWaalsContact NE-NE2 3.14Å; R213-Q217 WeakPolarHBondContact O-CB 3.39Å; R213-Q217 WeakPolarHBondContact O-CG 3.14Å; R213-Q217 PolarHBondContact O-N 3.22Å; D214-Q217 PolarHBondContact O-N 3.2Å
218	R	59.5	Low	63.9	Low	203 Å²	203	104.5 Å²	104.5	77%	0.766	55%	0.548	S	S	*	.	H	α-helix	trans	-71.8	-34.7	175.2	-74.3	174.3	-177.8	-163	1.6	112.6	D214 N215 K220	D214-R218 WeakPolarHBondContact O-CB 3.36Å; D214-R218 VanDerWaalsContact O-CG 3.26Å; D214-R218 WeakPolarHBondContact O-CG 3.47Å; D214-R218 PolarHBondContact O-N 3.07Å; N215-R218 PolarHBondContact O-N 3.21Å; R218-K220 PolarHBondContact O-N 2.68Å
219	L	56.4	Low	60.9	Low	111 Å²	111	107.2 Å²	107.2	58%	0.581	57%	0.571	S	S	*	*	S	Bend	trans	-93.3	86.6	174.2	-65.2	167.2	0	0	0	108.7	N215 N216 V221	N215-L219 PolarHBondContact O-N 3Å; N216-L219 CarbonylContact O-C 3.09Å; L219-V221 HydrophobicContact CB-CG2 4.11Å; L219-V221 PolarHBondContact O-N 3.12Å
220	K	50.6	Low	58.7	Low	205 Å²	205	110.6 Å²	110.6	89%	0.891	59%	0.588	S	S	*	*			trans	-66.1	64.7	166.5	-73.3	-173.6	179.5	179.6	0	110.5	R218	R218-K220 PolarHBondContact O-N 2.68Å
221	V	40.6	Very low	56.4	Low	86 Å²	86	115.6 Å²	115.6	52%	0.521	62%	0.615	S	S	.	*			trans	-101.8	116.4	175.7	-179.9	0	0	0	0	106.8	L219 N223	L219-V221 HydrophobicContact CB-CG2 4.11Å; L219-V221 PolarHBondContact O-N 3.12Å; V221-N223 WeakPolarHBondContact CG1-OD1 3.46Å; V221-N223 PolarHBondContact O-N 3.34Å
222	N	43.3	Very low	55	Low	161 Å²	161	119.8 Å²	119.8	86%	0.861	63%	0.625	S	S	*	*			trans	-63.1	87.4	167	-74.6	-11.8	0	0	0	108.7	S224	N222-S224 PolarHBondContact O-N 3.33Å
223	N	37	Very low	54.4	Low	116 Å²	116	116.3 Å²	116.3	62%	0.62	61%	0.613	S	S	*	*			trans	-89.4	84.5	170	-86.6	-8.8	0	0	0	109.5	V221 S225	V221-N223 WeakPolarHBondContact CG1-OD1 3.46Å; V221-N223 PolarHBondContact O-N 3.34Å; N223-S225 PolarHBondContact O-N 3.49Å
224	S	37.5	Very low	54.1	Low	127 Å²	127	112.5 Å²	112.5	89%	0.888	60%	0.602	S	S	*	*			trans	-74.6	40.8	157.5	59.9	0	0	0	0	111.5	N222	N222-S224 PolarHBondContact O-N 3.33Å
225	S	39.3	Very low	53.9	Low	99 Å²	99	111.6 Å²	111.6	69%	0.692	60%	0.597	S	S	*	*			trans	-133.2	63.1	177.9	-170.4	0	0	0	0	109.6	N223	N223-S225 PolarHBondContact O-N 3.49Å
226	L	38	Very low	53.8	Low	137 Å²	137	108 Å²	108	72%	0.717	58%	0.577	S	S	*	*			trans	-121.3	76	158.7	-91.3	110.3	0	0	0	106
227	N	37.2	Very low	54	Low	165 Å²	165	109.4 Å²	109.4	88%	0.882	58%	0.579	S	S	*	*			trans	-160.9	59.7	163.9	-84.8	-25.3	0	0	0	106.9
228	S	33.1	Very low	54.6	Low	110 Å²	110	105.1 Å²	105.1	77%	0.769	56%	0.56	S	S	*	*	S	Bend	trans	-79.4	128	155.6	63.7	0	0	0	0	106.2	D230	S228-D230 PolarHBondContact O-N 2.93Å; S228-D230 VanDerWaalsContact O-N 3.14Å
229	S	31.7	Very low	55.4	Low	87 Å²	87	98.7 Å²	98.7	61%	0.608	54%	0.541	S	S	*	.			trans	-40.4	118.2	-178.9	42.9	0	0	0	0	112.2	D231	S229-D231 PolarHBondContact O-N 3.33Å
230	D	45.2	Very low	56.1	Low	75 Å²	75	101.8 Å²	101.8	40%	0.401	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	13.8	-171.9	-157.1	46.7	0	0	0	112.7	S228 K232 K403 R484	S228-D230 PolarHBondContact O-N 2.93Å; S228-D230 VanDerWaalsContact O-N 3.14Å; D230-K232 VanDerWaalsContact C-N 3.34Å; D230-K403 VanDerWaalsContact OD1-CE 3.24Å; D230-K403 WeakPolarHBondContact OD1-CE 3.32Å; D230-K403 IonicContact OD1-NZ 2.65Å; D230-K403 PolarHBondContact OD1-NZ 3.43Å; D230-K403 IonicContact OD2-NZ 3.87Å; D230-K403 PolarHBondContact OD2-NZ 2.81Å; D230-R484 PolarHBondContact O-NH1 3.29Å; D230-R484 IonicContact OD2-CZ 3.6Å; D230-R484 IonicContact OD2-NH1 3.86Å; D230-R484 IonicContact OD2-NH2 3.5Å; D230-R484 PolarHBondContact OD2-NH2 2.98Å
231	D	44.6	Very low	57.5	Low	139 Å²	139	94.2 Å²	94.2	74%	0.743	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-12.1	-179	-114.4	8.4	0	0	0	113.1	S229	S229-D231 PolarHBondContact O-N 3.33Å
232	K	62.6	Low	59.7	Low	150 Å²	150	94.8 Å²	94.8	65%	0.652	51%	0.509	S	S	*	.	S	Bend	trans	-123.5	86.6	172.8	-64.7	-168.6	176.7	-157.5	0	110.8	E194 D230	E194-K232 IonicContact OE1-NZ 2.97Å; E194-K232 PolarHBondContact OE1-NZ 2.78Å; D230-K232 VanDerWaalsContact C-N 3.34Å
233	L	77.3	Confident	61.9	Low	20 Å²	20	87.8 Å²	87.8	11%	0.105	47%	0.473	C	S	.	.			trans	-52.4	131.1	166.9	-74.3	176.2	0	0	0	109.6	L446 R484 L485 R488	L233-L446 HydrophobicContact CD1-CD2 4.49Å; L233-R484 HydrophobicContact CD1-CG 3.99Å; L233-L485 HydrophobicContact CD1-CD2 4.38Å; L233-L485 HydrophobicContact CD2-CD2 3.94Å; L233-R488 HydrophobicContact CB-CG 4.44Å; L233-R488 HydrophobicContact CD1-CB 4.11Å; L233-R488 HydrophobicContact CD1-CG 3.97Å
234	P	82	Confident	64.4	Low	27 Å²	27	82.9 Å²	82.9	18%	0.175	45%	0.449	C	S	.	.			trans	-62.9	144.5	-174.6	24.9	-34.8	0	0	0	111.9	M197 F236 K403 Y489	M197-P234 HydrophobicContact CE-CB 4.2Å; M197-P234 HydrophobicContact CG-CB 4.42Å; M197-P234 HydrophobicContact SD-CB 4.02Å; P234-F236 HydrophobicContact CB-CE2 4.27Å; P234-F236 HydrophobicContact CB-CZ 4.31Å; P234-F236 HydrophobicContact CG-CD2 4.24Å; P234-F236 HydrophobicContact CG-CE2 3.49Å; P234-F236 VanDerWaalsContact CG-CE2 3.49Å; P234-F236 HydrophobicContact CG-CZ 3.69Å; P234-F236 PolarHBondContact O-N 3Å; P234-K403 HydrophobicContact CG-CB 4.45Å; P234-Y489 VanDerWaalsContact O-CE1 3.31Å; P234-Y489 WeakPolarHBondContact O-CE1 3.3Å; P234-Y489 PolarHBondContact O-OH 2.82Å
235	N	83.2	Confident	67	Low	42 Å²	42	78.8 Å²	78.8	23%	0.225	42%	0.416	C	S	.	.			trans	-81	104.4	173.4	-70.1	-23.5	0	0	0	109.1	M197 R488	M197-N235 PolarHBondContact N-O 3.42Å; N235-R488 PolarHBondContact OD1-NH2 3Å
236	F	84.9	Confident	69.5	Low	16 Å²	16	74.3 Å²	74.3	7%	0.07	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	134.7	171.3	-69.3	-69.7	0	0	0	110.9	M197 L199 P234 K403 K404 L407 Y489 L492	M197-F236 HydrophobicContact CB-CD1 3.61Å; M197-F236 HydrophobicContact CB-CE1 3.58Å; M197-F236 HydrophobicContact CG-CE1 4.34Å; M197-F236 VanDerWaalsContact O-CA 3.32Å; M197-F236 WeakPolarHBondContact O-CA 3.42Å; M197-F236 HydrophobicContact SD-CE1 3.92Å; M197-F236 HydrophobicContact SD-CZ 4.24Å; L199-F236 HydrophobicContact CD1-CB 3.7Å; L199-F236 HydrophobicContact CD1-CD1 4.37Å; L199-F236 HydrophobicContact CD1-CG 4.16Å; L199-F236 HydrophobicContact CD2-CD1 3.92Å; L199-F236 HydrophobicContact CD2-CE1 4.35Å; L199-F236 HydrophobicContact CD2-CG 4.41Å; L199-F236 HydrophobicContact CG-CB 3.99Å; L199-F236 HydrophobicContact CG-CD1 3.85Å; L199-F236 HydrophobicContact CG-CG 4.14Å; P234-F236 HydrophobicContact CB-CE2 4.27Å; P234-F236 HydrophobicContact CB-CZ 4.31Å; P234-F236 HydrophobicContact CG-CD2 4.24Å; P234-F236 HydrophobicContact CG-CE2 3.49Å; P234-F236 VanDerWaalsContact CG-CE2 3.49Å; P234-F236 HydrophobicContact CG-CZ 3.69Å; P234-F236 PolarHBondContact O-N 3Å; F236-K403 HydrophobicContact CE2-CB 4.46Å; F236-K403 HydrophobicContact CZ-CB 4.44Å; F236-K404 HydrophobicContact CE1-CB 4.01Å; F236-K404 HydrophobicContact CE1-CG 4.35Å; F236-K404 HydrophobicContact CZ-CB 4.01Å; F236-L407 HydrophobicContact CB-CD2 3.92Å; F236-L407 HydrophobicContact CD2-CD2 3.37Å; F236-L407 HydrophobicContact CE2-CD2 4.01Å; F236-L407 HydrophobicContact CG-CD2 3.74Å; F236-Y489 HydrophobicContact CB-CE1 4.38Å; F236-Y489 HydrophobicContact CD2-CD1 4.26Å; F236-Y489 AromaticContact CD2-CE1 3.58Å; F236-Y489 HydrophobicContact CD2-CE1 3.58Å; F236-Y489 HydrophobicContact CD2-CE2 4.48Å; F236-Y489 AromaticContact CD2-CZ 3.69Å; F236-Y489 HydrophobicContact CE2-CE1 4.41Å; F236-Y489 HydrophobicContact CG-CE1 4.45Å; F236-L492 HydrophobicContact CB-CD1 3.88Å
237	K	83	Confident	72.1	Confident	105 Å²	105	72.6 Å²	72.6	46%	0.457	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.5	167.7	-70.3	-178.1	-177	166.6	0	109.4	E196 M197 L199	E196-K237 WeakPolarHBondContact OE1-CE 3.26Å; E196-K237 IonicContact OE1-NZ 2.78Å; E196-K237 PolarHBondContact OE1-NZ 3.17Å; E196-K237 WeakPolarHBondContact OE2-CE 3.06Å; E196-K237 IonicContact OE2-NZ 2.98Å; E196-K237 PolarHBondContact OE2-NZ 2.71Å; M197-K237 PolarHBondContact O-N 2.93Å; M197-K237 VanDerWaalsContact O-N 3.1Å; L199-K237 PolarHBondContact N-O 2.83Å
238	L	80.4	Confident	74.6	Confident	26 Å²	26	65.6 Å²	65.6	14%	0.136	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	134.1	171	-150.7	86.2	0	0	0	108.5	V201 R240 Q245 L492 T495	V201-L238 HydrophobicContact CB-CD1 4.35Å; V201-L238 HydrophobicContact CG1-CD1 3.44Å; V201-L238 VanDerWaalsContact CG1-CD1 3.44Å; V201-L238 HydrophobicContact CG1-CG 4.22Å; V201-L238 HydrophobicContact CG2-CD1 4.04Å; V201-L238 HydrophobicContact CG2-CD2 4.09Å; V201-L238 HydrophobicContact CG2-CG 3.93Å; L238-R240 PolarHBondContact O-N 3.46Å; L238-R240 VanDerWaalsContact O-N 3.11Å; L238-Q245 HydrophobicContact CD2-CG 3.97Å; L238-L492 HydrophobicContact CB-CD2 4.32Å; L238-L492 HydrophobicContact CD1-CD2 4.45Å; L238-T495 HydrophobicContact CD2-CG2 4.29Å
239	L	75.8	Confident	77.2	Confident	69 Å²	69	63.5 Å²	63.5	36%	0.361	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-60.7	117.1	167	-174.7	67.3	0	0	0	107.8	L199 D241	L199-L239 PolarHBondContact O-N 3.01Å; L239-D241 PolarHBondContact O-N 2.8Å
240	R	70	Confident	80	Confident	175 Å²	175	61 Å²	61	66%	0.66	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-72.9	127	-178.2	-67.3	-167.9	-175.4	-159.2	3	109.2	L238 E609	L238-R240 PolarHBondContact O-N 3.46Å; L238-R240 VanDerWaalsContact O-N 3.11Å; R240-E609 IonicContact CZ-OE1 3.51Å; R240-E609 IonicContact CZ-OE2 2.93Å; R240-E609 IonicContact NH1-OE1 3.58Å; R240-E609 PolarHBondContact NH1-OE1 2.97Å; R240-E609 IonicContact NH1-OE2 3.67Å; R240-E609 PolarHBondContact NH1-OE2 3.07Å
241	D	80.1	Confident	82.4	Confident	46 Å²	46	58 Å²	58	25%	0.246	29%	0.291	C	S	.	.			trans	-106	150.9	176.2	178.9	44.5	0	0	0	110.8	L239 T243 G244 K498	L239-D241 PolarHBondContact O-N 2.8Å; D241-T243 PolarHBondContact O-N 2.89Å; D241-T243 WeakPolarHBondContact OD2-CB 3.35Å; D241-T243 PolarHBondContact OD2-N 3.36Å; D241-T243 PolarHBondContact OD2-OG1 2.63Å; D241-G244 PolarHBondContact O-N 2.93Å; D241-K498 HydrophobicContact CB-CD 4.14Å; D241-K498 IonicContact OD1-NZ 2.83Å; D241-K498 PolarHBondContact OD1-NZ 3.02Å; D241-K498 VanDerWaalsContact OD2-CD 3.31Å; D241-K498 WeakPolarHBondContact OD2-CD 3.35Å; D241-K498 WeakPolarHBondContact OD2-CE 3.19Å; D241-K498 IonicContact OD2-NZ 3.64Å; D241-K498 PolarHBondContact OD2-NZ 2.76Å
242	K	87.6	Confident	84.7	Confident	98 Å²	98	51.9 Å²	51.9	43%	0.426	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-23.2	179.7	-66.4	-170.4	175.4	-169.3	0	113.4	G244 Y611 D614	K242-G244 PolarHBondContact O-N 3.05Å; K242-Y611 HydrophobicContact CB-CD2 3.9Å; K242-Y611 HydrophobicContact CB-CG 4.46Å; K242-Y611 HydrophobicContact CG-CD2 4.12Å; K242-Y611 HydrophobicContact CG-CE2 4.49Å; K242-Y611 WeakPolarHBondContact O-CD2 3.38Å; K242-Y611 PolarHBondContact O-N 3.28Å; K242-D614 HydrophobicContact CB-CB 4.07Å; K242-D614 VanDerWaalsContact CD-CG 3.5Å; K242-D614 VanDerWaalsContact CD-OD1 3.24Å; K242-D614 WeakPolarHBondContact CD-OD1 3.43Å; K242-D614 WeakPolarHBondContact CD-OD2 3.49Å; K242-D614 IonicContact NZ-OD1 2.85Å
243	T	89.5	Confident	86	Confident	15 Å²	15	50 Å²	50	9%	0.092	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	8.7	179.7	73.7	0	0	0	0	114.2	D241 R604 D614 L618	D241-T243 PolarHBondContact O-N 2.89Å; D241-T243 WeakPolarHBondContact OD2-CB 3.35Å; D241-T243 PolarHBondContact OD2-N 3.36Å; D241-T243 PolarHBondContact OD2-OG1 2.63Å; T243-R604 PolarHBondContact O-NH1 3.15Å; T243-R604 VanDerWaalsContact O-NH1 3.13Å; T243-R604 PolarHBondContact O-NH2 3.42Å; T243-D614 HydrophobicContact CG2-CB 4.44Å; T243-L618 HydrophobicContact CG2-CD2 4.13Å
244	G	89.3	Confident	86.6	Confident	12 Å²	12	54.7 Å²	54.7	12%	0.124	29%	0.287	C	S	.	.			trans	74.5	164.3	176.9	0	0	0	0	0	113.6	D241 K242 R604 T610	D241-G244 PolarHBondContact O-N 2.93Å; K242-G244 PolarHBondContact O-N 3.05Å; G244-R604 PolarHBondContact O-NH2 2.98Å; G244-T610 WeakPolarHBondContact CA-OG1 3.49Å
245	Q	91.4	Very high	87.2	Confident	42 Å²	42	53.4 Å²	53.4	20%	0.196	28%	0.278	C	S	.	.			trans	-76.6	160.9	174.2	-62.9	-175	9.3	0	0	111	L238 R604 D607	L238-Q245 HydrophobicContact CD2-CG 3.97Å; Q245-R604 PolarHBondContact O-NH2 2.91Å; Q245-D607 PolarHBondContact N-OD2 3.19Å
246	T	93.6	Very high	87.7	Confident	4 Å²	4	53 Å²	53	3%	0.025	28%	0.275	C	S	.	.			trans	-131.8	122.5	171.1	-51	0	0	0	0	107.7	D250 L251 T495 I496 L501 R604	T246-D250 HydrophobicContact CG2-CB 3.99Å; T246-L251 HydrophobicContact CG2-CD1 4.2Å; T246-L251 HydrophobicContact CG2-CD2 3.86Å; T246-L251 HydrophobicContact CG2-CG 3.74Å; T246-T495 WeakPolarHBondContact O-CG2 3.4Å; T246-I496 HydrophobicContact CG2-CD1 4.1Å; T246-I496 PolarHBondContact O-N 3.03Å; T246-L501 WeakPolarHBondContact OG1-CD2 3.5Å; T246-R604 PolarHBondContact OG1-NE 3.3Å; T246-R604 PolarHBondContact OG1-NH2 3.1Å
247	R	92.2	Very high	88.1	Confident	101 Å²	101	59.3 Å²	59.3	38%	0.381	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-102.7	165.2	178.5	-60.6	179.6	-178.4	-126.9	1.5	110.2	G249 D250 W494	R247-G249 PolarHBondContact O-N 3.02Å; R247-D250 WeakPolarHBondContact CA-OD2 3.23Å; R247-D250 WeakPolarHBondContact CB-OD2 3.38Å; R247-D250 PolarHBondContact N-OD2 3.31Å; R247-D250 WeakPolarHBondContact O-CB 3.4Å; R247-D250 PolarHBondContact O-N 3.48Å; R247-D250 VanDerWaalsContact O-N 3.14Å; R247-W494 WeakPolarHBondContact CA-O 3.33Å
248	V	89.4	Confident	88.6	Confident	19 Å²	19	55.6 Å²	55.6	12%	0.115	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	130.5	167.5	-174	0	0	0	0	109.4	M256 L415 R422 W494	V248-M256 HydrophobicContact CG1-CE 4.09Å; V248-L415 HydrophobicContact CG2-CD2 3.24Å; V248-R422 VanDerWaalsContact CG1-CZ 3.44Å; V248-R422 VanDerWaalsContact CG1-NE 3.27Å; V248-W494 PolarHBondContact N-O 3.26Å
249	G	87.6	Confident	89.3	Confident	65 Å²	65	54.4 Å²	54.4	67%	0.67	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	103	-20.9	-171.7	0	0	0	0	0	113.3	R247	R247-G249 PolarHBondContact O-N 3.02Å
250	D	91.7	Very high	90.2	Very high	34 Å²	34	54.6 Å²	54.6	18%	0.182	28%	0.276	C	S	.	.	S	Bend	trans	-79.1	-22.8	-179.2	-63.4	-14.6	0	0	0	112.6	T246 R247 R604 C605	T246-D250 HydrophobicContact CG2-CB 3.99Å; R247-D250 WeakPolarHBondContact CA-OD2 3.23Å; R247-D250 WeakPolarHBondContact CB-OD2 3.38Å; R247-D250 PolarHBondContact N-OD2 3.31Å; R247-D250 WeakPolarHBondContact O-CB 3.4Å; R247-D250 PolarHBondContact O-N 3.48Å; R247-D250 VanDerWaalsContact O-N 3.14Å; D250-R604 CarbonylContact O-C 3.48Å; D250-R604 WeakPolarHBondContact O-CA 3.3Å; D250-C605 HydrophobicContact CB-CB 4.25Å; D250-C605 PolarHBondContact O-N 3.2Å
251	L	93.9	Very high	91.4	Very high	13 Å²	13	47.4 Å²	47.4	7%	0.068	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-100.7	151.8	-176	-65.5	-177.6	0	0	0	112.9	T246 D255 M256 V259 I496 L501 I601 R604	T246-L251 HydrophobicContact CG2-CD1 4.2Å; T246-L251 HydrophobicContact CG2-CD2 3.86Å; T246-L251 HydrophobicContact CG2-CG 3.74Å; L251-D255 HydrophobicContact CB-CB 4.4Å; L251-M256 HydrophobicContact CB-CG 3.92Å; L251-M256 HydrophobicContact CB-SD 3.93Å; L251-M256 HydrophobicContact CD1-SD 4.1Å; L251-M256 HydrophobicContact CG-SD 4.47Å; L251-V259 HydrophobicContact CD1-CG2 3.9Å; L251-I496 HydrophobicContact CD1-CD1 3.45Å; L251-I496 VanDerWaalsContact CD1-CD1 3.45Å; L251-I496 HydrophobicContact CG-CD1 4.05Å; L251-L501 HydrophobicContact CD1-CD1 4.11Å; L251-L501 HydrophobicContact CD2-CD1 4.09Å; L251-I601 HydrophobicContact CD2-CD1 4.22Å; L251-I601 HydrophobicContact CD2-CG1 4.41Å; L251-R604 HydrophobicContact CD2-CB 3.76Å; L251-R604 HydrophobicContact CD2-CG 3.78Å
252	S	92.9	Very high	92.2	Very high	10 Å²	10	45.2 Å²	45.2	7%	0.07	24%	0.237	C	C	.	.			trans	-56	151.5	171.3	78.4	0	0	0	0	113	L254 D255 M256 K602 E603	S252-L254 PolarHBondContact O-N 3.27Å; S252-L254 VanDerWaalsContact O-N 3.15Å; S252-D255 PolarHBondContact O-N 3.45Å; S252-D255 VanDerWaalsContact O-N 3.11Å; S252-D255 PolarHBondContact OG-N 3.32Å; S252-D255 VanDerWaalsContact OG-N 3.12Å; S252-D255 PolarHBondContact OG-OD2 3.42Å; S252-M256 PolarHBondContact O-N 2.85Å; S252-K602 WeakPolarHBondContact OG-CB 3.21Å; S252-E603 PolarHBondContact N-O 3.43Å
253	P	90.4	Very high	92.6	Very high	112 Å²	112	40.5 Å²	40.5	73%	0.727	22%	0.217	S	C	*	.	H	α-helix	trans	-56.7	-32.5	175.4	-26.7	34.7	0	0	0	113.8	K257	P253-K257 PolarHBondContact O-N 2.96Å
254	L	90.9	Very high	92.9	Very high	117 Å²	117	40 Å²	40	61%	0.613	21%	0.214	S	C	*	.	H	α-helix	trans	-68.2	-43	178	-65.7	177.1	0	0	0	111.9	S252 K257 K602	S252-L254 PolarHBondContact O-N 3.27Å; S252-L254 VanDerWaalsContact O-N 3.15Å; L254-K257 PolarHBondContact O-N 2.97Å; L254-K602 HydrophobicContact CB-CG 4.47Å
255	D	94.4	Very high	93.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-72.3	-36.9	176.3	-72	-35.4	0	0	0	111	L251 S252 K257 K258 V259 V504 N508 I601 K602	L251-D255 HydrophobicContact CB-CB 4.4Å; S252-D255 PolarHBondContact O-N 3.45Å; S252-D255 VanDerWaalsContact O-N 3.11Å; S252-D255 PolarHBondContact OG-N 3.32Å; S252-D255 VanDerWaalsContact OG-N 3.12Å; S252-D255 PolarHBondContact OG-OD2 3.42Å; D255-K257 VanDerWaalsContact C-N 3.27Å; D255-K257 PolarHBondContact O-N 3.02Å; D255-K258 WeakPolarHBondContact O-CA 3.05Å; D255-K258 WeakPolarHBondContact O-CB 3.48Å; D255-K258 PolarHBondContact O-N 3.36Å; D255-V259 WeakPolarHBondContact O-CG2 3.25Å; D255-V259 PolarHBondContact O-N 2.96Å; D255-V504 HydrophobicContact CB-CG1 4.04Å; D255-N508 PolarHBondContact OD1-ND2 3.17Å; D255-I601 HydrophobicContact CB-CD1 4.45Å; D255-I601 WeakPolarHBondContact OD2-CD1 3.44Å; D255-K602 WeakPolarHBondContact OD2-CA 3.34Å; D255-K602 WeakPolarHBondContact OD2-CB 3.49Å; D255-K602 PolarHBondContact OD2-N 3.26Å
256	M	93.9	Very high	93.5	Very high	33 Å²	33	37.5 Å²	37.5	16%	0.163	20%	0.199	C	C	.	.	H	α-helix	trans	-60.9	-34.3	174	-77	-56.8	-59.1	0	0	112.9	V248 L251 S252 K258 V259 R260 I496	V248-M256 HydrophobicContact CG1-CE 4.09Å; L251-M256 HydrophobicContact CB-CG 3.92Å; L251-M256 HydrophobicContact CB-SD 3.93Å; L251-M256 HydrophobicContact CD1-SD 4.1Å; L251-M256 HydrophobicContact CG-SD 4.47Å; S252-M256 PolarHBondContact O-N 2.85Å; M256-K258 VanDerWaalsContact C-N 3.28Å; M256-K258 PolarHBondContact O-N 3.22Å; M256-V259 HydrophobicContact CE-CG1 4.46Å; M256-V259 PolarHBondContact O-N 3.18Å; M256-V259 HydrophobicContact SD-CB 4.46Å; M256-V259 HydrophobicContact SD-CG2 4.39Å; M256-R260 PolarHBondContact O-N 2.98Å; M256-I496 HydrophobicContact SD-CD1 3.71Å
257	K	91.8	Very high	93.7	Very high	149 Å²	149	37.9 Å²	37.9	65%	0.648	20%	0.201	S	C	*	.	H	α-helix	trans	-60.7	-38.6	172	-170.4	179.7	-179.1	-178.2	0	111.8	P253 L254 D255 R261	P253-K257 PolarHBondContact O-N 2.96Å; L254-K257 PolarHBondContact O-N 2.97Å; D255-K257 VanDerWaalsContact C-N 3.27Å; D255-K257 PolarHBondContact O-N 3.02Å; K257-R261 WeakPolarHBondContact O-CG 3.42Å; K257-R261 PolarHBondContact O-N 3.2Å
258	K	94	Very high	93.8	Very high	28 Å²	28	33.7 Å²	33.7	12%	0.122	19%	0.186	C	C	.	.	H	α-helix	trans	-70.6	-42.6	176.1	-62.4	179.1	174.2	-165.5	0	111.7	D255 M256 R260 R261 L262 V504 Q507 N508	D255-K258 WeakPolarHBondContact O-CA 3.05Å; D255-K258 WeakPolarHBondContact O-CB 3.48Å; D255-K258 PolarHBondContact O-N 3.36Å; M256-K258 VanDerWaalsContact C-N 3.28Å; M256-K258 PolarHBondContact O-N 3.22Å; K258-R260 VanDerWaalsContact C-N 3.33Å; K258-R260 PolarHBondContact O-N 2.76Å; K258-R261 PolarHBondContact O-N 2.82Å; K258-L262 PolarHBondContact O-N 2.9Å; K258-V504 HydrophobicContact CB-CG1 4.43Å; K258-V504 HydrophobicContact CB-CG2 4Å; K258-V504 HydrophobicContact CD-CG1 4.29Å; K258-Q507 HydrophobicContact CD-CB 4.45Å; K258-N508 PolarHBondContact NZ-OD1 2.96Å
259	V	96.1	Very high	94.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-53.8	-50.9	173.1	172.1	0	0	0	0	110	L251 D255 M256 R261 L262 V263 I496 I500 V504	L251-V259 HydrophobicContact CD1-CG2 3.9Å; D255-V259 WeakPolarHBondContact O-CG2 3.25Å; D255-V259 PolarHBondContact O-N 2.96Å; M256-V259 HydrophobicContact CE-CG1 4.46Å; M256-V259 PolarHBondContact O-N 3.18Å; M256-V259 HydrophobicContact SD-CB 4.46Å; M256-V259 HydrophobicContact SD-CG2 4.39Å; V259-R261 VanDerWaalsContact C-N 3.33Å; V259-R261 PolarHBondContact O-N 3.39Å; V259-L262 PolarHBondContact O-N 3.47Å; V259-V263 HydrophobicContact CG1-CG2 3.93Å; V259-V263 WeakPolarHBondContact O-CB 3.48Å; V259-V263 WeakPolarHBondContact O-CG2 3.3Å; V259-V263 PolarHBondContact O-N 3.5Å; V259-I496 HydrophobicContact CG1-CD1 4.48Å; V259-I496 HydrophobicContact CG1-CG2 4.21Å; V259-I496 HydrophobicContact CG2-CD1 4.42Å; V259-I496 HydrophobicContact CG2-CG2 4.36Å; V259-I500 HydrophobicContact CB-CG2 4.34Å; V259-I500 HydrophobicContact CG1-CG2 4.01Å; V259-I500 HydrophobicContact CG2-CG2 4.22Å; V259-V504 HydrophobicContact CG2-CG2 3.8Å
260	R	94.4	Very high	94.6	Very high	74 Å²	74	29.8 Å²	29.8	28%	0.279	15%	0.149	S	C	.	.	H	α-helix	trans	-55.6	-45.1	-179.8	-171.7	-174	175.3	83.8	12.8	112.4	E90 M256 K258 V263 L264 Y390 L416	E90-R260 IonicContact OE1-CZ 2.79Å; E90-R260 IonicContact OE1-NE 2.78Å; E90-R260 IonicContact OE1-NH2 3.78Å; E90-R260 PolarHBondContact OE1-NH2 3.45Å; M256-R260 PolarHBondContact O-N 2.98Å; K258-R260 VanDerWaalsContact C-N 3.33Å; K258-R260 PolarHBondContact O-N 2.76Å; R260-V263 PolarHBondContact O-N 3.1Å; R260-L264 PolarHBondContact O-N 3.32Å; R260-Y390 PolarHBondContact NH2-OH 2.96Å; R260-L416 HydrophobicContact CG-CD2 4.18Å; R260-L416 PolarHBondContact NH1-O 3.23Å; R260-L416 PolarHBondContact NH2-O 3.34Å
261	R	93.9	Very high	94.7	Very high	23 Å²	23	28.3 Å²	28.3	9%	0.087	14%	0.141	C	C	.	.	H	α-helix	trans	-62.7	-47.1	177.6	-68.7	174.9	66	-173.8	4.8	112.1	A91 G92 D109 F113 K257 K258 V259 L264 V265	A91-R261 PolarHBondContact O-NE 2.86Å; A91-R261 PolarHBondContact O-NH2 2.83Å; A91-R261 VanDerWaalsContact O-NH2 3.13Å; G92-R261 PolarHBondContact O-NH2 3.44Å; D109-R261 IonicContact OD2-NH1 3.75Å; D109-R261 PolarHBondContact OD2-NH1 3.42Å; F113-R261 HydrophobicContact CD2-CB 4.43Å; F113-R261 HydrophobicContact CE2-CB 3.6Å; F113-R261 HydrophobicContact CZ-CB 4.04Å; K257-R261 WeakPolarHBondContact O-CG 3.42Å; K257-R261 PolarHBondContact O-N 3.2Å; K258-R261 PolarHBondContact O-N 2.82Å; V259-R261 VanDerWaalsContact C-N 3.33Å; V259-R261 PolarHBondContact O-N 3.39Å; R261-L264 PolarHBondContact O-N 3.5Å; R261-V265 PolarHBondContact O-N 3.46Å
262	L	96.8	Very high	94.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.4	-42.8	178.9	-73.6	166.9	0	0	0	111.7	F113 L117 K258 V259 L264 V265 E266 I500 Q503 V504	F113-L262 HydrophobicContact CD2-CD2 4.43Å; F113-L262 HydrophobicContact CE2-CD2 3.74Å; F113-L262 HydrophobicContact CE2-CG 3.91Å; F113-L262 HydrophobicContact CZ-CD2 4.22Å; L117-L262 HydrophobicContact CD2-CD2 3.8Å; K258-L262 PolarHBondContact O-N 2.9Å; V259-L262 PolarHBondContact O-N 3.47Å; L262-L264 VanDerWaalsContact C-N 3.32Å; L262-L264 PolarHBondContact O-N 2.7Å; L262-V265 PolarHBondContact O-N 2.88Å; L262-E266 WeakPolarHBondContact O-CB 3.36Å; L262-E266 PolarHBondContact O-N 3.36Å; L262-I500 HydrophobicContact CB-CD1 3.91Å; L262-I500 HydrophobicContact CB-CG2 4.15Å; L262-I500 HydrophobicContact CD1-CG2 4.14Å; L262-Q503 HydrophobicContact CD1-CB 3.61Å; L262-Q503 HydrophobicContact CD2-CB 4.1Å; L262-V504 HydrophobicContact CD1-CG2 3.73Å
263	V	97.1	Very high	94.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.9	-37.3	178.1	172.8	0	0	0	0	111.2	V259 R260 E266 M267 L412 L415 L416 I500	V259-V263 HydrophobicContact CG1-CG2 3.93Å; V259-V263 WeakPolarHBondContact O-CB 3.48Å; V259-V263 WeakPolarHBondContact O-CG2 3.3Å; V259-V263 PolarHBondContact O-N 3.5Å; R260-V263 PolarHBondContact O-N 3.1Å; V263-E266 PolarHBondContact O-N 2.88Å; V263-M267 VanDerWaalsContact O-CB 3.23Å; V263-M267 WeakPolarHBondContact O-CB 3.47Å; V263-M267 PolarHBondContact O-N 3.31Å; V263-L412 HydrophobicContact CB-CD2 4.47Å; V263-L412 HydrophobicContact CG1-CB 3.84Å; V263-L412 HydrophobicContact CG1-CD2 3.86Å; V263-L412 HydrophobicContact CG1-CG 4.45Å; V263-L412 WeakPolarHBondContact CG1-O 3.42Å; V263-L412 HydrophobicContact CG2-CD2 4.32Å; V263-L415 HydrophobicContact CG1-CB 3.94Å; V263-L415 HydrophobicContact CG2-CB 4.17Å; V263-L415 HydrophobicContact CG2-CD1 4Å; V263-L416 HydrophobicContact CB-CD2 4.22Å; V263-L416 HydrophobicContact CB-CG 4.46Å; V263-L416 HydrophobicContact CG1-CD1 4.17Å; V263-L416 HydrophobicContact CG1-CD2 3.91Å; V263-L416 HydrophobicContact CG1-CG 3.62Å; V263-I500 HydrophobicContact CG2-CD1 4.3Å; V263-I500 HydrophobicContact CG2-CG1 4.41Å; V263-I500 HydrophobicContact CG2-CG2 4.34Å
264	L	95.4	Very high	94.8	Very high	5 Å²	5	26.2 Å²	26.2	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-62.7	-46.5	176.7	178.9	63.7	0	0	0	111.2	E90 A91 R260 R261 L262 M267 T268 L416	E90-L264 HydrophobicContact CB-CD2 3.79Å; E90-L264 HydrophobicContact CG-CD2 3.76Å; A91-L264 HydrophobicContact CB-CD2 4.11Å; R260-L264 PolarHBondContact O-N 3.32Å; R261-L264 PolarHBondContact O-N 3.5Å; L262-L264 VanDerWaalsContact C-N 3.32Å; L262-L264 PolarHBondContact O-N 2.7Å; L264-M267 HydrophobicContact CD1-CE 4.11Å; L264-T268 WeakPolarHBondContact O-CB 3.48Å; L264-T268 PolarHBondContact O-N 3.3Å; L264-T268 VanDerWaalsContact O-N 3.1Å; L264-T268 PolarHBondContact O-OG1 3.23Å; L264-L416 HydrophobicContact CB-CD2 3.85Å; L264-L416 HydrophobicContact CD1-CD1 4.34Å; L264-L416 HydrophobicContact CD1-CD2 4.44Å
265	V	96.3	Very high	94.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64	-44.5	176.8	176.8	0	0	0	0	111	W87 F113 L117 Q121 V125 R261 L262 T268 A269	W87-V265 HydrophobicContact CH2-CG2 4Å; W87-V265 HydrophobicContact CZ2-CG2 4.13Å; F113-V265 HydrophobicContact CE1-CG2 4.01Å; F113-V265 HydrophobicContact CZ-CG2 3.79Å; L117-V265 HydrophobicContact CD1-CG1 4.36Å; L117-V265 HydrophobicContact CD2-CG1 4.33Å; Q121-V265 HydrophobicContact CB-CG1 3.7Å; Q121-V265 HydrophobicContact CG-CG1 4.06Å; V125-V265 HydrophobicContact CG2-CG1 3.84Å; V125-V265 HydrophobicContact CG2-CG2 4.18Å; R261-V265 PolarHBondContact O-N 3.46Å; L262-V265 PolarHBondContact O-N 2.88Å; V265-T268 PolarHBondContact O-N 2.68Å; V265-A269 WeakPolarHBondContact O-CB 3.26Å; V265-A269 PolarHBondContact O-N 2.95Å
266	E	97.8	Very high	94.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.5	-43.4	178.7	-179.7	65.4	-170.7	0	0	112.6	Q121 F205 S206 L262 V263 T268 A269 L270 L412 F499 I500	Q121-E266 VanDerWaalsContact CG-OE2 3.25Å; Q121-E266 WeakPolarHBondContact CG-OE2 3.45Å; Q121-E266 PolarHBondContact NE2-OE2 3.2Å; F205-E266 VanDerWaalsContact CA-OE1 3.31Å; F205-E266 WeakPolarHBondContact CA-OE1 3.18Å; F205-E266 WeakPolarHBondContact CB-OE1 3.41Å; F205-E266 PolarHBondContact N-OE1 3.27Å; S206-E266 PolarHBondContact N-OE1 3.36Å; S206-E266 PolarHBondContact OG-OE1 2.92Å; S206-E266 PolarHBondContact OG-OE2 3.4Å; L262-E266 WeakPolarHBondContact O-CB 3.36Å; L262-E266 PolarHBondContact O-N 3.36Å; V263-E266 PolarHBondContact O-N 2.88Å; E266-T268 VanDerWaalsContact C-N 3.31Å; E266-T268 PolarHBondContact O-N 2.7Å; E266-A269 PolarHBondContact O-N 3.3Å; E266-L270 WeakPolarHBondContact O-CB 3.25Å; E266-L270 PolarHBondContact O-N 3.46Å; E266-L412 HydrophobicContact CB-CD1 4.33Å; E266-L412 HydrophobicContact CB-CD2 4.32Å; E266-L412 HydrophobicContact CG-CD1 3.65Å; E266-L412 HydrophobicContact CG-CD2 3.89Å; E266-L412 HydrophobicContact CG-CG 4.45Å; E266-F499 HydrophobicContact CG-CE2 4Å; E266-F499 HydrophobicContact CG-CZ 3.81Å; E266-I500 HydrophobicContact CB-CD1 4.41Å
267	M	96.1	Very high	93.9	Very high	13 Å²	13	27.6 Å²	27.6	6%	0.064	15%	0.152	C	C	.	.	H	α-helix	trans	-60.5	-45.9	177.6	-177.8	-94.4	-73.8	0	0	110.2	V263 L264 L270 F271 Y390 L412 L413 L416	V263-M267 VanDerWaalsContact O-CB 3.23Å; V263-M267 WeakPolarHBondContact O-CB 3.47Å; V263-M267 PolarHBondContact O-N 3.31Å; L264-M267 HydrophobicContact CD1-CE 4.11Å; M267-L270 PolarHBondContact O-N 3.45Å; M267-F271 HydrophobicContact CG-CD2 4Å; M267-F271 HydrophobicContact CG-CE2 3.82Å; M267-F271 WeakPolarHBondContact O-CD2 3.38Å; M267-F271 PolarHBondContact O-N 3.39Å; M267-F271 VanDerWaalsContact O-N 3.11Å; M267-F271 HydrophobicContact SD-CD2 3.66Å; M267-F271 HydrophobicContact SD-CE2 3.7Å; M267-Y390 HydrophobicContact CE-CD1 4.22Å; M267-Y390 HydrophobicContact CE-CE1 4.27Å; M267-L412 HydrophobicContact CB-CB 4.19Å; M267-L412 HydrophobicContact CB-CD1 4.22Å; M267-L413 HydrophobicContact CE-CD2 4.22Å; M267-L413 HydrophobicContact CG-CD2 4.24Å; M267-L413 HydrophobicContact SD-CD2 4.4Å; M267-L416 HydrophobicContact CB-CD1 4.1Å; M267-L416 HydrophobicContact CE-CD1 3.35Å; M267-L416 HydrophobicContact CG-CD1 4.21Å
268	T	95.3	Very high	93.4	Very high	13 Å²	13	22.3 Å²	22.3	8%	0.08	13%	0.132	C	C	.	.	H	α-helix	trans	-60.9	-48.8	176.3	-50.7	0	0	0	0	110.9	W87 A124 L264 V265 E266 L270 F271 D272	W87-T268 HydrophobicContact CZ2-CG2 4.17Å; W87-T268 PolarHBondContact NE1-OG1 2.96Å; A124-T268 HydrophobicContact CB-CG2 4.43Å; L264-T268 WeakPolarHBondContact O-CB 3.48Å; L264-T268 PolarHBondContact O-N 3.3Å; L264-T268 VanDerWaalsContact O-N 3.1Å; L264-T268 PolarHBondContact O-OG1 3.23Å; V265-T268 PolarHBondContact O-N 2.68Å; E266-T268 VanDerWaalsContact C-N 3.31Å; E266-T268 PolarHBondContact O-N 2.7Å; T268-L270 VanDerWaalsContact C-N 3.32Å; T268-L270 PolarHBondContact O-N 2.86Å; T268-F271 PolarHBondContact O-N 3.4Å; T268-D272 WeakPolarHBondContact O-CB 3.34Å; T268-D272 PolarHBondContact O-N 3.45Å
269	A	96.7	Very high	92.3	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.008	15%	0.151	C	C	.	.	H	α-helix	trans	-60.9	-39	178.3	0	0	0	0	0	112.8	Q121 A124 V265 E266 D272 T273	Q121-A269 HydrophobicContact CG-CB 4.49Å; A124-A269 HydrophobicContact CB-CB 3.77Å; V265-A269 WeakPolarHBondContact O-CB 3.26Å; V265-A269 PolarHBondContact O-N 2.95Å; E266-A269 PolarHBondContact O-N 3.3Å; A269-D272 PolarHBondContact O-N 3.2Å; A269-T273 WeakPolarHBondContact O-CG2 3.08Å; A269-T273 PolarHBondContact O-N 2.89Å; A269-T273 PolarHBondContact O-OG1 3.48Å
270	L	96.5	Very high	90.9	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.4	-48.4	176.7	179.3	61.8	0	0	0	111.2	F205 A209 E266 M267 T268 T273 A274 Q408 A409 L412	F205-L270 HydrophobicContact CB-CD1 4.46Å; F205-L270 HydrophobicContact CB-CD2 4.45Å; A209-L270 HydrophobicContact CB-CD1 3.6Å; E266-L270 WeakPolarHBondContact O-CB 3.25Å; E266-L270 PolarHBondContact O-N 3.46Å; M267-L270 PolarHBondContact O-N 3.45Å; T268-L270 VanDerWaalsContact C-N 3.32Å; T268-L270 PolarHBondContact O-N 2.86Å; L270-T273 PolarHBondContact O-N 2.56Å; L270-T273 PolarHBondContact O-OG1 3Å; L270-A274 PolarHBondContact O-N 3.28Å; L270-Q408 HydrophobicContact CD2-CB 4.44Å; L270-A409 HydrophobicContact CD2-CB 3.85Å; L270-L412 HydrophobicContact CD2-CD1 4.1Å
271	F	95.2	Very high	89.4	Confident	3 Å²	3	27.9 Å²	27.9	1%	0.013	17%	0.171	C	C	.	.	H	α-helix	trans	-66.1	-39.7	177.1	-77.5	-70.8	0	0	0	112.4	M267 T268 T273 A274 G275 I276 V278 A396 V397 L400 A409	M267-F271 HydrophobicContact CG-CD2 4Å; M267-F271 HydrophobicContact CG-CE2 3.82Å; M267-F271 WeakPolarHBondContact O-CD2 3.38Å; M267-F271 PolarHBondContact O-N 3.39Å; M267-F271 VanDerWaalsContact O-N 3.11Å; M267-F271 HydrophobicContact SD-CD2 3.66Å; M267-F271 HydrophobicContact SD-CE2 3.7Å; T268-F271 PolarHBondContact O-N 3.4Å; F271-T273 PolarHBondContact O-N 3.5Å; F271-A274 CarbonylContact O-C 3.59Å; F271-A274 PolarHBondContact O-N 3.05Å; F271-A274 VanDerWaalsContact O-N 3.14Å; F271-G275 PolarHBondContact O-N 2.65Å; F271-I276 HydrophobicContact CB-CB 4.4Å; F271-I276 HydrophobicContact CD1-CB 3.9Å; F271-I276 HydrophobicContact CD1-CD1 3.97Å; F271-I276 HydrophobicContact CD1-CG2 3.82Å; F271-I276 HydrophobicContact CE1-CD1 4.4Å; F271-I276 HydrophobicContact CE1-CG2 4.4Å; F271-I276 PolarHBondContact O-N 3.4Å; F271-V278 HydrophobicContact CB-CG2 4.09Å; F271-V278 HydrophobicContact CD1-CG2 3.67Å; F271-V278 HydrophobicContact CD2-CG2 4.01Å; F271-V278 HydrophobicContact CE1-CG2 4.03Å; F271-V278 HydrophobicContact CE2-CG2 4.36Å; F271-V278 HydrophobicContact CG-CG2 3.66Å; F271-V278 HydrophobicContact CZ-CG2 4.37Å; F271-A396 HydrophobicContact CE1-CB 3.95Å; F271-A396 HydrophobicContact CZ-CB 4.46Å; F271-V397 HydrophobicContact CZ-CG2 4.31Å; F271-L400 HydrophobicContact CD1-CD2 4.49Å; F271-L400 HydrophobicContact CE1-CD1 4.26Å; F271-L400 HydrophobicContact CE1-CG 4.39Å; F271-A409 HydrophobicContact CZ-CB 4.31Å
272	D	94.6	Very high	87.6	Confident	38 Å²	38	31.9 Å²	31.9	20%	0.203	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-43	175.6	-70.8	-14.8	0	0	0	111.3	R128 T268 A269 A274 G275	R128-D272 IonicContact CZ-OD1 3.19Å; R128-D272 IonicContact NH2-OD1 2.85Å; R128-D272 PolarHBondContact NH2-OD1 3.31Å; R128-D272 IonicContact NH2-OD2 3.11Å; T268-D272 WeakPolarHBondContact O-CB 3.34Å; T268-D272 PolarHBondContact O-N 3.45Å; A269-D272 PolarHBondContact O-N 3.2Å; D272-A274 PolarHBondContact O-N 3Å; D272-G275 PolarHBondContact O-N 2.78Å
273	T	93.4	Very high	85.3	Confident	17 Å²	17	34.9 Å²	34.9	10%	0.104	21%	0.208	C	C	.	.	H	α-helix	trans	-63.9	-30.4	177.3	65.2	0	0	0	0	112.6	T120 L210 R213 A269 L270 F271 G275	T120-T273 HydrophobicContact CG2-CG2 4.06Å; L210-T273 HydrophobicContact CB-CG2 4.42Å; R213-T273 WeakPolarHBondContact CD-O 3.31Å; R213-T273 PolarHBondContact NH1-O 3.36Å; A269-T273 WeakPolarHBondContact O-CG2 3.08Å; A269-T273 PolarHBondContact O-N 2.89Å; A269-T273 PolarHBondContact O-OG1 3.48Å; L270-T273 PolarHBondContact O-N 2.56Å; L270-T273 PolarHBondContact O-OG1 3Å; F271-T273 PolarHBondContact O-N 3.5Å; T273-G275 VanDerWaalsContact C-N 3.33Å
274	A	90.5	Very high	82.9	Confident	36 Å²	36	36.3 Å²	36.3	30%	0.298	22%	0.223	S	C	.	.	H	α-helix	trans	-82.5	-7.5	173.6	0	0	0	0	0	113.5	L270 F271 D272 I276 L400	L270-A274 PolarHBondContact O-N 3.28Å; F271-A274 CarbonylContact O-C 3.59Å; F271-A274 PolarHBondContact O-N 3.05Å; F271-A274 VanDerWaalsContact O-N 3.14Å; D272-A274 PolarHBondContact O-N 3Å; A274-I276 VanDerWaalsContact C-N 3.35Å; A274-I276 HydrophobicContact CB-CD1 3.72Å; A274-I276 HydrophobicContact CB-CG1 4.02Å; A274-L400 HydrophobicContact CB-CD2 3.62Å
275	G	89.3	Confident	80.3	Confident	62 Å²	62	48.2 Å²	48.2	64%	0.639	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	27.9	-177	0	0	0	0	0	113.6	F271 D272 T273	F271-G275 PolarHBondContact O-N 2.65Å; D272-G275 PolarHBondContact O-N 2.78Å; T273-G275 VanDerWaalsContact C-N 3.33Å
276	I	89.6	Confident	77.8	Confident	19 Å²	19	52.5 Å²	52.5	10%	0.097	29%	0.293	C	S	.	.			trans	-103.5	115.1	-178.5	-60	165.3	0	0	0	108.6	F271 A274 V278 A396 K399 L400	F271-I276 HydrophobicContact CB-CB 4.4Å; F271-I276 HydrophobicContact CD1-CB 3.9Å; F271-I276 HydrophobicContact CD1-CD1 3.97Å; F271-I276 HydrophobicContact CD1-CG2 3.82Å; F271-I276 HydrophobicContact CE1-CD1 4.4Å; F271-I276 HydrophobicContact CE1-CG2 4.4Å; F271-I276 PolarHBondContact O-N 3.4Å; A274-I276 VanDerWaalsContact C-N 3.35Å; A274-I276 HydrophobicContact CB-CD1 3.72Å; A274-I276 HydrophobicContact CB-CG1 4.02Å; I276-V278 HydrophobicContact CG2-CG2 3.87Å; I276-V278 PolarHBondContact O-N 2.88Å; I276-A396 HydrophobicContact CG2-CB 4.11Å; I276-K399 HydrophobicContact CD1-CB 3.77Å; I276-K399 HydrophobicContact CG1-CB 4.27Å; I276-K399 HydrophobicContact CG2-CD 4.25Å; I276-L400 HydrophobicContact CD1-CD2 3.69Å; I276-L400 HydrophobicContact CD1-CG 4.04Å
277	D	81.6	Confident	74.9	Confident	99 Å²	99	62.6 Å²	62.6	53%	0.529	34%	0.337	S	S	.	.			trans	-81.3	114.8	172.9	-175.5	23.1	0	0	0	110.3	K279	D277-K279 WeakPolarHBondContact OD2-CE 3.24Å; D277-K279 IonicContact OD2-NZ 2.78Å
278	V	81.1	Confident	72.2	Confident	37 Å²	37	64.3 Å²	64.3	22%	0.224	35%	0.35	C	S	.	.			trans	-110.6	104.9	179.3	-177.3	0	0	0	0	109	F271 I276 A393 A396	F271-V278 HydrophobicContact CB-CG2 4.09Å; F271-V278 HydrophobicContact CD1-CG2 3.67Å; F271-V278 HydrophobicContact CD2-CG2 4.01Å; F271-V278 HydrophobicContact CE1-CG2 4.03Å; F271-V278 HydrophobicContact CE2-CG2 4.36Å; F271-V278 HydrophobicContact CG-CG2 3.66Å; F271-V278 HydrophobicContact CZ-CG2 4.37Å; I276-V278 HydrophobicContact CG2-CG2 3.87Å; I276-V278 PolarHBondContact O-N 2.88Å; V278-A393 HydrophobicContact CG1-CB 3.59Å; V278-A396 HydrophobicContact CG2-CB 3.93Å
279	K	71.4	Confident	69.7	Low	118 Å²	118	73.8 Å²	73.8	51%	0.513	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-90.4	127.5	175.1	-60.3	-175.2	-176.3	-175.9	0	110.3	D277 N392	D277-K279 WeakPolarHBondContact OD2-CE 3.24Å; D277-K279 IonicContact OD2-NZ 2.78Å; K279-N392 PolarHBondContact O-ND2 3.31Å
280	A	66	Low	67.2	Low	51 Å²	51	75.4 Å²	75.4	42%	0.421	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-68.8	139	172.4	0	0	0	0	0	110.5
281	N	63.5	Low	64.8	Low	51 Å²	51	76 Å²	76	27%	0.273	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-84.4	143.4	171.2	-61.9	-45.3	0	0	0	109.7	V388 N392	N281-V388 HydrophobicContact CB-CG1 3.51Å; N281-V388 WeakPolarHBondContact CB-O 3.49Å; N281-V388 PolarHBondContact ND2-O 3.14Å; N281-N392 VanDerWaalsContact ND2-CG 3.27Å; N281-N392 PolarHBondContact ND2-ND2 2.76Å; N281-N392 PolarHBondContact ND2-OD1 3.32Å; N281-N392 PolarHBondContact OD1-ND2 2.8Å
282	K	54.5	Low	62.4	Low	107 Å²	107	76.7 Å²	76.7	47%	0.465	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-78.2	135.6	171	-71.4	-171.6	178.9	175.3	0	110.3	P78 E82 G284	P78-K282 HydrophobicContact CG-CD 3.85Å; P78-K282 VanDerWaalsContact CG-CE 3.46Å; P78-K282 HydrophobicContact CG-CG 4.22Å; E82-K282 IonicContact OE2-NZ 3.22Å; E82-K282 PolarHBondContact OE2-NZ 2.97Å; K282-G284 PolarHBondContact O-N 3.2Å
283	P	49.7	Very low	60.2	Low	63 Å²	63	75.6 Å²	75.6	41%	0.409	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-68.6	123	170.6	27.5	-32.7	0	0	0	110	E389	P283-E389 WeakPolarHBondContact CG-OE1 3.2Å
284	G	47.2	Very low	58.3	Low	30 Å²	30	77.6 Å²	77.6	31%	0.309	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-71.1	149	168.8	0	0	0	0	0	111.1	K282 V286	K282-G284 PolarHBondContact O-N 3.2Å; G284-V286 PolarHBondContact O-N 2.89Å; G284-V286 VanDerWaalsContact O-N 3.12Å
285	R	39.9	Very low	56.3	Low	255 Å²	255	77 Å²	77	96%	0.962	41%	0.411	S	S	*	.			trans	-71	104.7	171.4	-79.4	-177.3	171.4	175	-2	109.3
286	V	44.9	Very low	54.4	Low	89 Å²	89	74.7 Å²	74.7	54%	0.539	38%	0.384	S	S	.	.			trans	-94.6	117.5	172.1	-175.8	0	0	0	0	108.5	G284	G284-V286 PolarHBondContact O-N 2.89Å; G284-V286 VanDerWaalsContact O-N 3.12Å
287	K	35.7	Very low	52.5	Low	212 Å²	212	78.8 Å²	78.8	92%	0.922	41%	0.406	S	S	*	.			trans	-90.4	116.9	165.4	-69.7	-179.6	-177.9	173.2	0	107.5
288	S	40.8	Very low	50.8	Low	49 Å²	49	77.6 Å²	77.6	34%	0.343	41%	0.405	S	S	.	.			trans	-135.6	137.4	178.5	38.3	0	0	0	0	111.7	A293	S288-A293 VanDerWaalsContact CB-CB 3.47Å; S288-A293 WeakPolarHBondContact CB-O 3.25Å; S288-A293 PolarHBondContact OG-O 3.15Å
289	K	41.4	Very low	49.3	Very low	213 Å²	213	76 Å²	76	93%	0.926	40%	0.395	S	S	*	.			trans	-102.5	142.1	171.6	-67.5	179.6	178.7	177.1	0	108.1
290	G	45.3	Very low	47.9	Very low	34 Å²	34	74.2 Å²	74.2	35%	0.351	39%	0.39	S	S	.	.	S	Bend	trans	112	159.7	177.1	0	0	0	0	0	113.3	A293 Q294	G290-A293 PolarHBondContact O-N 3.17Å; G290-Q294 WeakPolarHBondContact O-CG 3.33Å; G290-Q294 PolarHBondContact O-NE2 3.33Å
291	I	46	Very low	46.7	Very low	14 Å²	14	77.1 Å²	77.1	7%	0.072	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-71.1	-42.6	-173.3	-75	159.4	0	0	0	110.7	A293 Q294 M313 E352 F355	I291-A293 PolarHBondContact O-N 2.84Å; I291-A293 VanDerWaalsContact O-N 3.08Å; I291-Q294 PolarHBondContact O-N 2.87Å; I291-M313 HydrophobicContact CB-CE 4.43Å; I291-M313 HydrophobicContact CB-SD 4.4Å; I291-M313 HydrophobicContact CG2-CE 2.95Å; I291-M313 HydrophobicContact CG2-CG 4.16Å; I291-M313 HydrophobicContact CG2-SD 3.22Å; I291-M313 WeakPolarHBondContact CG2-SD 3.34Å; I291-E352 HydrophobicContact CB-CG 4.47Å; I291-E352 HydrophobicContact CD1-CB 4.29Å; I291-E352 HydrophobicContact CD1-CG 4.38Å; I291-F355 HydrophobicContact CD1-CB 3.61Å; I291-F355 HydrophobicContact CD1-CD1 3.52Å; I291-F355 HydrophobicContact CD1-CD2 3.97Å; I291-F355 HydrophobicContact CD1-CE1 4.03Å; I291-F355 HydrophobicContact CD1-CE2 4.45Å; I291-F355 HydrophobicContact CD1-CG 3.45Å; I291-F355 VanDerWaalsContact CD1-CG 3.45Å; I291-F355 HydrophobicContact CD1-CZ 4.42Å; I291-F355 HydrophobicContact CG1-CD1 4.19Å; I291-F355 HydrophobicContact CG1-CE1 4.2Å; I291-F355 HydrophobicContact CG1-CG 4.41Å; I291-F355 HydrophobicContact CG1-CZ 4.44Å; I291-F355 HydrophobicContact CG2-CD2 4.3Å; I291-F355 HydrophobicContact CG2-CE2 3.97Å; I291-F355 HydrophobicContact CG2-CZ 4.11Å
292	F	44.4	Very low	45.7	Very low	16 Å²	16	77.9 Å²	77.9	7%	0.07	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-64.9	-12.1	177.9	-72.6	-85.3	0	0	0	114.6	C348 L351 E352 F377 E380	F292-C348 HydrophobicContact CE2-CB 4.39Å; F292-L351 HydrophobicContact CZ-CD1 4.36Å; F292-E352 HydrophobicContact CD2-CG 4.01Å; F292-E352 WeakPolarHBondContact CD2-OE1 3.28Å; F292-E352 HydrophobicContact CE2-CG 3.92Å; F292-F377 HydrophobicContact CD1-CB 4.35Å; F292-F377 HydrophobicContact CD1-CD2 4.03Å; F292-F377 HydrophobicContact CE1-CB 4.21Å; F292-F377 HydrophobicContact CE1-CD2 4.01Å; F292-E380 HydrophobicContact CB-CB 3.98Å; F292-E380 CarbonylContact O-C 3.56Å; F292-E380 WeakPolarHBondContact O-CB 3.06Å
293	A	48.8	Very low	44.9	Very low	15 Å²	15	73.9 Å²	73.9	12%	0.124	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-122.6	26.4	-174	0	0	0	0	0	112.8	S288 G290 I291 P382	S288-A293 VanDerWaalsContact CB-CB 3.47Å; S288-A293 WeakPolarHBondContact CB-O 3.25Å; S288-A293 PolarHBondContact OG-O 3.15Å; G290-A293 PolarHBondContact O-N 3.17Å; I291-A293 PolarHBondContact O-N 2.84Å; I291-A293 VanDerWaalsContact O-N 3.08Å; A293-P382 VanDerWaalsContact O-CG 3.31Å; A293-P382 WeakPolarHBondContact O-CG 3.23Å
294	Q	52.5	Low	44.3	Very low	60 Å²	60	78.1 Å²	78.1	28%	0.28	40%	0.404	S	S	.	.	S	Bend	trans	-98.4	142.1	174.7	-79.1	177.6	59.2	0	0	113.2	G290 I291 L296 L299 P382	G290-Q294 WeakPolarHBondContact O-CG 3.33Å; G290-Q294 PolarHBondContact O-NE2 3.33Å; I291-Q294 PolarHBondContact O-N 2.87Å; Q294-L296 PolarHBondContact O-N 2.74Å; Q294-L299 HydrophobicContact CB-CD1 3.92Å; Q294-L299 HydrophobicContact CB-CD2 3.99Å; Q294-L299 HydrophobicContact CB-CG 4.03Å; Q294-P382 VanDerWaalsContact C-CD 3.49Å; Q294-P382 WeakPolarHBondContact O-CD 3.46Å; Q294-P382 VanDerWaalsContact O-CG 3.24Å; Q294-P382 WeakPolarHBondContact O-CG 3.49Å
295	S	48.8	Very low	44.1	Very low	22 Å²	22	83 Å²	83	15%	0.154	42%	0.422	C	S	.	.			trans	-67.5	132.2	-177.4	175.7	0	0	0	0	110.6	L297 S298 L299	S295-L297 PolarHBondContact O-N 2.72Å; S295-L297 PolarHBondContact OG-N 2.94Å; S295-S298 PolarHBondContact O-N 3.03Å; S295-L299 VanDerWaalsContact O-CD1 3.26Å; S295-L299 WeakPolarHBondContact O-CD1 3.27Å; S295-L299 VanDerWaalsContact O-CG 3.25Å; S295-L299 WeakPolarHBondContact O-CG 3.42Å; S295-L299 PolarHBondContact O-N 3.49Å
296	L	50	Low	44.1	Very low	14 Å²	14	79.8 Å²	79.8	7%	0.073	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-31.6	176.4	-67.5	173	0	0	0	112.2	Q294 L381 A420 N421	Q294-L296 PolarHBondContact O-N 2.74Å; L296-L381 HydrophobicContact CD1-CD1 4.46Å; L296-L381 HydrophobicContact CD2-CD2 4.12Å; L296-L381 HydrophobicContact CG-CD2 4.41Å; L296-A420 HydrophobicContact CB-CB 4.33Å; L296-N421 WeakPolarHBondContact CD1-OD1 3.49Å
297	L	48.8	Very low	43.7	Very low	106 Å²	106	81.8 Å²	81.8	56%	0.555	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-45.2	177.7	-77.9	153.1	0	0	0	113.8	S295 L299 L300	S295-L297 PolarHBondContact O-N 2.72Å; S295-L297 PolarHBondContact OG-N 2.94Å; L297-L299 PolarHBondContact O-N 3.13Å; L297-L299 VanDerWaalsContact O-N 3.15Å; L297-L300 WeakPolarHBondContact O-CB 3.47Å; L297-L300 PolarHBondContact O-N 3.07Å; L297-L300 VanDerWaalsContact O-N 3.16Å
298	S	46.8	Very low	43.8	Very low	73 Å²	73	76.1 Å²	76.1	51%	0.51	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.2	176.6	-54.4	0	0	0	0	112.8	S295	S295-S298 PolarHBondContact O-N 3.03Å
299	L	48.4	Very low	43.7	Very low	5 Å²	5	76.8 Å²	76.8	3%	0.026	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-21.2	178.6	-68.1	159.8	0	0	0	113.1	Q294 S295 L297 I302 I303 S311 M313	Q294-L299 HydrophobicContact CB-CD1 3.92Å; Q294-L299 HydrophobicContact CB-CD2 3.99Å; Q294-L299 HydrophobicContact CB-CG 4.03Å; S295-L299 VanDerWaalsContact O-CD1 3.26Å; S295-L299 WeakPolarHBondContact O-CD1 3.27Å; S295-L299 VanDerWaalsContact O-CG 3.25Å; S295-L299 WeakPolarHBondContact O-CG 3.42Å; S295-L299 PolarHBondContact O-N 3.49Å; L297-L299 PolarHBondContact O-N 3.13Å; L297-L299 VanDerWaalsContact O-N 3.15Å; L299-I302 HydrophobicContact CD2-CD1 4.43Å; L299-I302 PolarHBondContact O-N 3.21Å; L299-I303 WeakPolarHBondContact O-CG1 3.05Å; L299-S311 WeakPolarHBondContact CB-OG 3.34Å; L299-M313 HydrophobicContact CD1-CB 3.79Å; L299-M313 HydrophobicContact CD1-CG 3.7Å; L299-M313 HydrophobicContact CD2-CB 4.47Å; L299-M313 HydrophobicContact CD2-CG 3.96Å; L299-M313 HydrophobicContact CG-CG 4.5Å
300	L	42.4	Very low	43.7	Very low	79 Å²	79	70.6 Å²	70.6	41%	0.414	41%	0.413	S	S	.	.	H	α-helix	trans	-66.5	-36.6	171.9	-98.7	133.3	0	0	0	111.7	L297 I302 I303 A420	L297-L300 WeakPolarHBondContact O-CB 3.47Å; L297-L300 PolarHBondContact O-N 3.07Å; L297-L300 VanDerWaalsContact O-N 3.16Å; L300-I302 PolarHBondContact O-N 3.32Å; L300-I303 HydrophobicContact CB-CD1 4.35Å; L300-I303 HydrophobicContact CD2-CD1 4.02Å; L300-I303 HydrophobicContact CG-CD1 3.94Å; L300-I303 WeakPolarHBondContact O-CB 3.25Å; L300-I303 WeakPolarHBondContact O-CG1 3.42Å; L300-I303 PolarHBondContact O-N 3.42Å; L300-A420 HydrophobicContact CD1-CB 4.07Å
301	D	40.2	Very low	43.8	Very low	112 Å²	112	69.3 Å²	69.3	60%	0.599	40%	0.399	S	S	*	.	H	α-helix	trans	-67.4	-24.9	177.5	-69.7	-27.1	0	0	0	112.7	I303	D301-I303 VanDerWaalsContact C-N 3.35Å
302	I	42.9	Very low	43.9	Very low	67 Å²	67	70.8 Å²	70.8	34%	0.344	41%	0.408	S	S	.	.	H	α-helix	trans	-75.8	-23.7	173.6	-59.7	176.7	0	0	0	111.4	L299 L300 L304 L305 V312	L299-I302 HydrophobicContact CD2-CD1 4.43Å; L299-I302 PolarHBondContact O-N 3.21Å; L300-I302 PolarHBondContact O-N 3.32Å; I302-L304 VanDerWaalsContact C-N 3.34Å; I302-L304 PolarHBondContact O-N 3.12Å; I302-L305 PolarHBondContact O-N 3.07Å; I302-V312 HydrophobicContact CB-CG2 4.49Å; I302-V312 HydrophobicContact CG2-CG2 3.69Å
303	I	37.3	Very low	44.2	Very low	23 Å²	23	70.2 Å²	70.2	12%	0.118	41%	0.406	C	S	.	.	H	α-helix	trans	-64	-39.3	176.5	-57.8	175.1	0	0	0	111.3	L299 L300 D301 L305 Y306 G309 S311	L299-I303 WeakPolarHBondContact O-CG1 3.05Å; L300-I303 HydrophobicContact CB-CD1 4.35Å; L300-I303 HydrophobicContact CD2-CD1 4.02Å; L300-I303 HydrophobicContact CG-CD1 3.94Å; L300-I303 WeakPolarHBondContact O-CB 3.25Å; L300-I303 WeakPolarHBondContact O-CG1 3.42Å; L300-I303 PolarHBondContact O-N 3.42Å; D301-I303 VanDerWaalsContact C-N 3.35Å; I303-L305 PolarHBondContact O-N 3.43Å; I303-Y306 PolarHBondContact O-N 3.32Å; I303-G309 VanDerWaalsContact CG2-CA 3.48Å; I303-S311 VanDerWaalsContact CD1-CA 3.45Å; I303-S311 VanDerWaalsContact CG1-CA 3.43Å
304	L	38.5	Very low	44.6	Very low	152 Å²	152	70.4 Å²	70.4	80%	0.796	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-18.2	-177.3	-70.6	169.5	0	0	0	112.9	I302	I302-L304 VanDerWaalsContact C-N 3.34Å; I302-L304 PolarHBondContact O-N 3.12Å
305	L	41.6	Very low	45.2	Very low	132 Å²	132	71.3 Å²	71.3	69%	0.691	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-15.9	179.1	-83.6	153	0	0	0	114	I302 I303	I302-L305 PolarHBondContact O-N 3.07Å; I303-L305 PolarHBondContact O-N 3.43Å
306	Y	41.3	Very low	46.3	Very low	188 Å²	188	70.7 Å²	70.7	74%	0.737	41%	0.405	S	S	*	.	S	Bend	trans	-140.6	64.1	-174.6	-75.1	-86.5	0	0	0	112.9	I303 C308	I303-Y306 PolarHBondContact O-N 3.32Å; Y306-C308 VanDerWaalsContact C-N 3.27Å; Y306-C308 PolarHBondContact O-N 3.27Å
307	S	36.3	Very low	47.7	Very low	131 Å²	131	70 Å²	70	92%	0.916	40%	0.401	S	S	*	.	S	Bend	trans	34	19.7	150.8	-47.9	0	0	0	0	122.5
308	C	36.9	Very low	49.2	Very low	93 Å²	93	69 Å²	69	63%	0.628	39%	0.392	S	S	*	.	S	Bend	trans	-137.2	16.2	-179.4	-161.3	0	0	0	0	115.1	Y306 C310	Y306-C308 VanDerWaalsContact C-N 3.27Å; Y306-C308 PolarHBondContact O-N 3.27Å; C308-C310 PolarHBondContact O-N 2.85Å
309	G	40.4	Very low	50.9	Low	64 Å²	64	67.5 Å²	67.5	66%	0.66	38%	0.377	S	S	*	.	S	Bend	trans	65.3	-10.1	164.7	0	0	0	0	0	118	I303	I303-G309 VanDerWaalsContact CG2-CA 3.48Å
310	C	40.8	Very low	52.7	Low	82 Å²	82	67.2 Å²	67.2	55%	0.554	38%	0.376	S	S	*	.	S	Bend	trans	-109.7	134.9	179.9	-72.5	0	0	0	0	111.6	C308 V312	C308-C310 PolarHBondContact O-N 2.85Å; C310-V312 PolarHBondContact O-N 3.06Å
311	S	46.6	Very low	54.9	Low	7 Å²	7	63.9 Å²	63.9	5%	0.049	36%	0.358	C	S	.	.			trans	-55.7	137.5	171.6	164.3	0	0	0	0	110.1	L299 I303 M313 S314 F315	L299-S311 WeakPolarHBondContact CB-OG 3.34Å; I303-S311 VanDerWaalsContact CD1-CA 3.45Å; I303-S311 VanDerWaalsContact CG1-CA 3.43Å; S311-M313 PolarHBondContact O-N 3.12Å; S311-M313 VanDerWaalsContact O-N 3.14Å; S311-M313 PolarHBondContact OG-N 3.26Å; S311-S314 WeakPolarHBondContact CB-OG 3.38Å; S311-S314 WeakPolarHBondContact O-CA 3.44Å; S311-S314 WeakPolarHBondContact O-CB 3.34Å; S311-S314 PolarHBondContact O-N 3.31Å; S311-F315 PolarHBondContact O-N 3.28Å
312	V	49.3	Very low	57.2	Low	46 Å²	46	64.8 Å²	64.8	28%	0.279	35%	0.353	S	S	.	.	H	α-helix	trans	-61.2	-25.2	-177.8	-154.5	0	0	0	0	111.6	I302 C310 F355	I302-V312 HydrophobicContact CB-CG2 4.49Å; I302-V312 HydrophobicContact CG2-CG2 3.69Å; C310-V312 PolarHBondContact O-N 3.06Å; V312-F355 HydrophobicContact CB-CE1 4.16Å; V312-F355 HydrophobicContact CB-CE2 4.48Å; V312-F355 HydrophobicContact CB-CZ 3.61Å; V312-F355 HydrophobicContact CG1-CD1 4.42Å; V312-F355 HydrophobicContact CG1-CE1 3.44Å; V312-F355 VanDerWaalsContact CG1-CE1 3.44Å; V312-F355 HydrophobicContact CG1-CE2 3.77Å; V312-F355 HydrophobicContact CG1-CZ 3.06Å; V312-F355 WeakPolarHBondContact O-CE2 3.18Å
313	M	49.9	Very low	59.3	Low	4 Å²	4	62.4 Å²	62.4	2%	0.02	34%	0.341	C	S	.	.	H	α-helix	trans	-86.8	-33.8	171.8	-80.9	-85.6	77.6	0	0	114.2	I291 L299 S311 F315 V316 Y317 F355 F377	I291-M313 HydrophobicContact CB-CE 4.43Å; I291-M313 HydrophobicContact CB-SD 4.4Å; I291-M313 HydrophobicContact CG2-CE 2.95Å; I291-M313 HydrophobicContact CG2-CG 4.16Å; I291-M313 HydrophobicContact CG2-SD 3.22Å; I291-M313 WeakPolarHBondContact CG2-SD 3.34Å; L299-M313 HydrophobicContact CD1-CB 3.79Å; L299-M313 HydrophobicContact CD1-CG 3.7Å; L299-M313 HydrophobicContact CD2-CB 4.47Å; L299-M313 HydrophobicContact CD2-CG 3.96Å; L299-M313 HydrophobicContact CG-CG 4.5Å; S311-M313 PolarHBondContact O-N 3.12Å; S311-M313 VanDerWaalsContact O-N 3.14Å; S311-M313 PolarHBondContact OG-N 3.26Å; M313-F315 PolarHBondContact O-N 3.38Å; M313-V316 HydrophobicContact CE-CB 3.8Å; M313-V316 HydrophobicContact CE-CG1 4.38Å; M313-V316 HydrophobicContact CE-CG2 3.74Å; M313-V316 PolarHBondContact O-N 2.93Å; M313-Y317 WeakPolarHBondContact O-CB 3.41Å; M313-Y317 PolarHBondContact O-N 2.77Å; M313-Y317 VanDerWaalsContact O-N 3.13Å; M313-F355 HydrophobicContact CE-CE2 3.88Å; M313-F355 HydrophobicContact CE-CZ 4.4Å; M313-F377 HydrophobicContact CB-CE2 4.31Å; M313-F377 HydrophobicContact CB-CZ 4.2Å; M313-F377 HydrophobicContact CE-CE2 3.79Å; M313-F377 HydrophobicContact SD-CD2 4.39Å; M313-F377 HydrophobicContact SD-CE2 3.5Å; M313-F377 WeakPolarHBondContact SD-CE2 3.23Å; M313-F377 HydrophobicContact SD-CZ 4.21Å
314	S	57.4	Low	61.8	Low	18 Å²	18	61.3 Å²	61.3	13%	0.126	34%	0.335	C	S	.	.	H	α-helix	trans	-56.5	-37.2	167.7	-64.6	0	0	0	0	110	S311 Y317 F318	S311-S314 WeakPolarHBondContact CB-OG 3.38Å; S311-S314 WeakPolarHBondContact O-CA 3.44Å; S311-S314 WeakPolarHBondContact O-CB 3.34Å; S311-S314 PolarHBondContact O-N 3.31Å; S314-Y317 PolarHBondContact O-N 3.05Å; S314-F318 WeakPolarHBondContact O-CB 3.38Å; S314-F318 WeakPolarHBondContact O-CD2 3.14Å; S314-F318 WeakPolarHBondContact O-CG 3.3Å; S314-F318 PolarHBondContact O-N 3.11Å
315	F	65.8	Low	64.2	Low	79 Å²	79	56.5 Å²	56.5	35%	0.346	31%	0.308	S	S	.	.	H	α-helix	trans	-57.8	-54.9	175.1	-177.9	-98.1	0	0	0	113	S311 M313 Y317 F318 Q319	S311-F315 PolarHBondContact O-N 3.28Å; M313-F315 PolarHBondContact O-N 3.38Å; F315-Y317 VanDerWaalsContact C-N 3.3Å; F315-Y317 PolarHBondContact O-N 3.39Å; F315-F318 PolarHBondContact O-N 3.33Å; F315-Q319 HydrophobicContact CD1-CG 3.93Å; F315-Q319 HydrophobicContact CD2-CG 4.24Å; F315-Q319 HydrophobicContact CE1-CG 3.55Å; F315-Q319 HydrophobicContact CE2-CG 3.9Å; F315-Q319 HydrophobicContact CG-CG 4.26Å; F315-Q319 HydrophobicContact CZ-CG 3.53Å; F315-Q319 WeakPolarHBondContact O-CB 3.19Å; F315-Q319 VanDerWaalsContact O-CG 3.26Å; F315-Q319 WeakPolarHBondContact O-CG 3.36Å; F315-Q319 PolarHBondContact O-N 2.94Å
316	V	71.3	Confident	66.4	Low	9 Å²	9	55.9 Å²	55.9	6%	0.055	30%	0.302	C	S	.	.	H	α-helix	trans	-60.9	-41.6	-178.9	176.6	0	0	0	0	111.4	M313 Q319 L320 L351 F355 W362	M313-V316 HydrophobicContact CE-CB 3.8Å; M313-V316 HydrophobicContact CE-CG1 4.38Å; M313-V316 HydrophobicContact CE-CG2 3.74Å; M313-V316 PolarHBondContact O-N 2.93Å; V316-Q319 PolarHBondContact O-N 3.45Å; V316-L320 HydrophobicContact CG1-CD1 4.12Å; V316-L320 WeakPolarHBondContact O-CG 3.31Å; V316-L320 PolarHBondContact O-N 2.97Å; V316-L351 HydrophobicContact CG1-CD2 4.43Å; V316-F355 HydrophobicContact CG2-CD2 3.98Å; V316-F355 HydrophobicContact CG2-CE2 3.72Å; V316-W362 HydrophobicContact CG1-CH2 4.33Å
317	Y	78.3	Confident	68.3	Low	1 Å²	1	52.8 Å²	52.8	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-59.9	-50.2	175.5	175.4	-98.1	0	0	0	112.5	M313 S314 F315 Q319 L320 I321 L374 F377 I378 T424 A427 L428	M313-Y317 WeakPolarHBondContact O-CB 3.41Å; M313-Y317 PolarHBondContact O-N 2.77Å; M313-Y317 VanDerWaalsContact O-N 3.13Å; S314-Y317 PolarHBondContact O-N 3.05Å; F315-Y317 VanDerWaalsContact C-N 3.3Å; F315-Y317 PolarHBondContact O-N 3.39Å; Y317-Q319 VanDerWaalsContact C-N 3.33Å; Y317-Q319 PolarHBondContact O-N 3.32Å; Y317-L320 PolarHBondContact O-N 2.7Å; Y317-I321 HydrophobicContact CD1-CD1 4.06Å; Y317-I321 HydrophobicContact CE1-CD1 3.41Å; Y317-I321 VanDerWaalsContact CE1-CD1 3.41Å; Y317-I321 HydrophobicContact CE2-CD1 4.2Å; Y317-I321 VanDerWaalsContact CZ-CD1 3.49Å; Y317-I321 PolarHBondContact O-N 3.34Å; Y317-L374 HydrophobicContact CD2-CD1 3.57Å; Y317-L374 HydrophobicContact CE2-CD1 3.42Å; Y317-L374 VanDerWaalsContact CE2-CD1 3.42Å; Y317-F377 AromaticContact CD2-CD1 3.52Å; Y317-F377 HydrophobicContact CD2-CD1 3.52Å; Y317-F377 AromaticContact CD2-CE1 3.56Å; Y317-F377 HydrophobicContact CD2-CE1 3.56Å; Y317-F377 HydrophobicContact CD2-CG 4.38Å; Y317-F377 HydrophobicContact CD2-CZ 4.43Å; Y317-F377 HydrophobicContact CE2-CD1 4.31Å; Y317-F377 HydrophobicContact CE2-CE1 4.46Å; Y317-F377 HydrophobicContact CG-CD1 4.29Å; Y317-F377 AromaticContact CG-CE1 3.93Å; Y317-F377 HydrophobicContact CG-CE1 3.93Å; Y317-F377 HydrophobicContact CG-CZ 4.44Å; Y317-I378 HydrophobicContact CE2-CG1 4.24Å; Y317-T424 HydrophobicContact CD1-CG2 4.18Å; Y317-T424 HydrophobicContact CE1-CG2 3.73Å; Y317-T424 HydrophobicContact CE2-CG2 4.19Å; Y317-T424 PolarHBondContact OH-O 2.87Å; Y317-T424 VanDerWaalsContact OH-O 3.07Å; Y317-A427 HydrophobicContact CE1-CB 4.16Å; Y317-L428 WeakPolarHBondContact OH-CA 3.45Å; Y317-L428 WeakPolarHBondContact OH-CB 3.31Å; Y317-L428 WeakPolarHBondContact OH-CD1 3.39Å; Y317-L428 PolarHBondContact OH-N 3.4Å
318	F	80.9	Confident	70.7	Confident	83 Å²	83	46.6 Å²	46.6	36%	0.364	25%	0.251	S	S	.	.	H	α-helix	trans	-65.7	-34.8	177.2	-76.2	-62.9	0	0	0	112.2	S314 F315 R322 A427	S314-F318 WeakPolarHBondContact O-CB 3.38Å; S314-F318 WeakPolarHBondContact O-CD2 3.14Å; S314-F318 WeakPolarHBondContact O-CG 3.3Å; S314-F318 PolarHBondContact O-N 3.11Å; F315-F318 PolarHBondContact O-N 3.33Å; F318-R322 WeakPolarHBondContact O-CB 3.21Å; F318-R322 PolarHBondContact O-N 2.85Å; F318-A427 HydrophobicContact CD1-CB 4.31Å; F318-A427 HydrophobicContact CE1-CB 3.42Å; F318-A427 VanDerWaalsContact CE1-CB 3.42Å; F318-A427 HydrophobicContact CZ-CB 4.07Å
319	Q	82.3	Confident	73.4	Confident	42 Å²	42	43.2 Å²	43.2	20%	0.196	23%	0.226	C	C	.	.	H	α-helix	trans	-67.1	-39.4	173.8	-69.4	-51.1	-40	0	0	112.1	F315 V316 Y317 R322 H323 W362	F315-Q319 HydrophobicContact CD1-CG 3.93Å; F315-Q319 HydrophobicContact CD2-CG 4.24Å; F315-Q319 HydrophobicContact CE1-CG 3.55Å; F315-Q319 HydrophobicContact CE2-CG 3.9Å; F315-Q319 HydrophobicContact CG-CG 4.26Å; F315-Q319 HydrophobicContact CZ-CG 3.53Å; F315-Q319 WeakPolarHBondContact O-CB 3.19Å; F315-Q319 VanDerWaalsContact O-CG 3.26Å; F315-Q319 WeakPolarHBondContact O-CG 3.36Å; F315-Q319 PolarHBondContact O-N 2.94Å; V316-Q319 PolarHBondContact O-N 3.45Å; Y317-Q319 VanDerWaalsContact C-N 3.33Å; Y317-Q319 PolarHBondContact O-N 3.32Å; Q319-R322 PolarHBondContact O-N 3.47Å; Q319-H323 VanDerWaalsContact O-CB 3.26Å; Q319-H323 WeakPolarHBondContact O-CB 3.49Å; Q319-H323 PolarHBondContact O-N 3.14Å; Q319-W362 HydrophobicContact CB-CD2 4.46Å; Q319-W362 HydrophobicContact CB-CH2 3.65Å; Q319-W362 HydrophobicContact CB-CZ2 3.46Å; Q319-W362 VanDerWaalsContact CB-CZ2 3.46Å; Q319-W362 HydrophobicContact CB-CZ3 4.22Å; Q319-W362 HydrophobicContact CG-CZ2 4.13Å
320	L	86.4	Confident	75.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.4	-47	174.3	-79.3	163.7	0	0	0	111.4	V316 Y317 H323 V324 W362 A370 L373 L374	V316-L320 HydrophobicContact CG1-CD1 4.12Å; V316-L320 WeakPolarHBondContact O-CG 3.31Å; V316-L320 PolarHBondContact O-N 2.97Å; Y317-L320 PolarHBondContact O-N 2.7Å; L320-H323 PolarHBondContact O-N 2.74Å; L320-V324 WeakPolarHBondContact O-CG2 3.39Å; L320-V324 PolarHBondContact O-N 3.3Å; L320-V324 VanDerWaalsContact O-N 3.12Å; L320-W362 HydrophobicContact CD2-CH2 4.25Å; L320-W362 HydrophobicContact CD2-CZ3 3.72Å; L320-W362 HydrophobicContact CG-CH2 3.97Å; L320-W362 HydrophobicContact CG-CZ3 3.85Å; L320-A370 HydrophobicContact CD2-CB 4.35Å; L320-L373 HydrophobicContact CD1-CB 4.26Å; L320-L373 HydrophobicContact CD2-CB 3.8Å; L320-L373 HydrophobicContact CD2-CD1 4.22Å; L320-L374 HydrophobicContact CB-CD1 4.38Å
321	I	88.9	Confident	78.5	Confident	8 Å²	8	40.8 Å²	40.8	4%	0.041	19%	0.194	C	C	.	.	H	α-helix	trans	-58.5	-51.9	174.9	-72.8	177	0	0	0	110	Y317 H323 V324 E325 L374 A427 F431	Y317-I321 HydrophobicContact CD1-CD1 4.06Å; Y317-I321 HydrophobicContact CE1-CD1 3.41Å; Y317-I321 VanDerWaalsContact CE1-CD1 3.41Å; Y317-I321 HydrophobicContact CE2-CD1 4.2Å; Y317-I321 VanDerWaalsContact CZ-CD1 3.49Å; Y317-I321 PolarHBondContact O-N 3.34Å; I321-H323 PolarHBondContact O-N 3.23Å; I321-V324 PolarHBondContact O-N 3.08Å; I321-E325 HydrophobicContact CG2-CG 4.25Å; I321-E325 WeakPolarHBondContact CG2-OE1 3.41Å; I321-E325 WeakPolarHBondContact O-CB 3.43Å; I321-E325 WeakPolarHBondContact O-CG 3.4Å; I321-E325 PolarHBondContact O-N 2.82Å; I321-L374 HydrophobicContact CG1-CD1 4.03Å; I321-L374 HydrophobicContact CG1-CD2 4.17Å; I321-A427 HydrophobicContact CD1-CB 4.45Å; I321-F431 HydrophobicContact CD1-CB 4.3Å; I321-F431 HydrophobicContact CG1-CB 4.45Å; I321-F431 HydrophobicContact CG1-CG 4.29Å; I321-F431 HydrophobicContact CG2-CB 3.98Å; I321-F431 HydrophobicContact CG2-CD2 3.85Å; I321-F431 HydrophobicContact CG2-CG 4.06Å
322	R	87.6	Confident	80.7	Confident	132 Å²	132	46.3 Å²	46.3	50%	0.498	22%	0.219	S	C	.	.	H	α-helix	trans	-59.2	-44.1	-178.2	-175.7	-178.4	169	176.7	-3.3	112.5	F318 Q319 V324 E325 E326	F318-R322 WeakPolarHBondContact O-CB 3.21Å; F318-R322 PolarHBondContact O-N 2.85Å; Q319-R322 PolarHBondContact O-N 3.47Å; R322-V324 VanDerWaalsContact C-N 3.33Å; R322-V324 PolarHBondContact O-N 2.95Å; R322-E325 PolarHBondContact O-N 2.94Å; R322-E325 VanDerWaalsContact O-N 3.15Å; R322-E326 HydrophobicContact CG-CG 4.38Å; R322-E326 IonicContact CZ-OE1 2.85Å; R322-E326 VanDerWaalsContact CZ-OE1 3.29Å; R322-E326 IonicContact NE-OE1 3.85Å; R322-E326 PolarHBondContact NE-OE1 3.48Å; R322-E326 IonicContact NH2-OE1 3.79Å; R322-E326 PolarHBondContact NH2-OE1 2.8Å; R322-E326 WeakPolarHBondContact O-CG 3.44Å; R322-E326 PolarHBondContact O-N 3.03Å
323	H	87.8	Confident	82.7	Confident	16 Å²	16	44.1 Å²	44.1	7%	0.074	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-42.7	177.8	-177.6	72.9	0	0	0	111.8	Q319 L320 I321 E325 E327 W362 V365	Q319-H323 VanDerWaalsContact O-CB 3.26Å; Q319-H323 WeakPolarHBondContact O-CB 3.49Å; Q319-H323 PolarHBondContact O-N 3.14Å; L320-H323 PolarHBondContact O-N 2.74Å; I321-H323 PolarHBondContact O-N 3.23Å; H323-E325 VanDerWaalsContact C-N 3.32Å; H323-E327 PolarHBondContact O-N 3.23Å; H323-W362 HydrophobicContact CB-CE3 4.17Å; H323-W362 PolarHBondContact CE1-O 2.73Å; H323-W362 PolarHBondContact NE2-O 2.8Å; H323-V365 PolarHBondContact NE2-O 2.9Å
324	V	89.6	Confident	84.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-69.1	-32.9	175.7	179	0	0	0	0	111.5	L320 I321 R322 G328 L329 L334 A370 F431	L320-V324 WeakPolarHBondContact O-CG2 3.39Å; L320-V324 PolarHBondContact O-N 3.3Å; L320-V324 VanDerWaalsContact O-N 3.12Å; I321-V324 PolarHBondContact O-N 3.08Å; R322-V324 VanDerWaalsContact C-N 3.33Å; R322-V324 PolarHBondContact O-N 2.95Å; V324-G328 CarbonylContact O-C 3.37Å; V324-G328 WeakPolarHBondContact O-CA 3.46Å; V324-G328 PolarHBondContact O-N 3.36Å; V324-L329 PolarHBondContact O-N 2.81Å; V324-L334 HydrophobicContact CG1-CD1 3.88Å; V324-L334 HydrophobicContact CG1-CD2 3.74Å; V324-L334 HydrophobicContact CG1-CG 4.32Å; V324-A370 HydrophobicContact CG2-CB 3.63Å; V324-F431 HydrophobicContact CB-CE2 4.06Å; V324-F431 HydrophobicContact CB-CZ 4.22Å; V324-F431 HydrophobicContact CG1-CE2 3.74Å; V324-F431 HydrophobicContact CG1-CZ 3.72Å
325	E	89.6	Confident	86.5	Confident	51 Å²	51	43 Å²	43	24%	0.238	20%	0.198	C	C	.	.	H	α-helix	trans	-70.8	-39.4	177.9	-75.6	177.8	170.3	0	0	113.7	I321 R322 H323 L329 F431 R434	I321-E325 HydrophobicContact CG2-CG 4.25Å; I321-E325 WeakPolarHBondContact CG2-OE1 3.41Å; I321-E325 WeakPolarHBondContact O-CB 3.43Å; I321-E325 WeakPolarHBondContact O-CG 3.4Å; I321-E325 PolarHBondContact O-N 2.82Å; R322-E325 PolarHBondContact O-N 2.94Å; R322-E325 VanDerWaalsContact O-N 3.15Å; H323-E325 VanDerWaalsContact C-N 3.32Å; E325-L329 HydrophobicContact CB-CD1 4.5Å; E325-L329 HydrophobicContact CG-CD2 4.33Å; E325-F431 HydrophobicContact CG-CD2 3.88Å; E325-F431 HydrophobicContact CG-CE2 4.16Å; E325-R434 WeakPolarHBondContact OE1-CD 3.48Å; E325-R434 IonicContact OE1-CZ 2.64Å; E325-R434 IonicContact OE1-NE 2.9Å; E325-R434 IonicContact OE1-NH1 3.64Å; E325-R434 PolarHBondContact OE1-NH1 3.11Å; E325-R434 IonicContact OE2-NH1 2.8Å
326	E	87.7	Confident	87.8	Confident	119 Å²	119	43 Å²	43	56%	0.556	20%	0.196	S	C	*	.	H	α-helix	trans	-69.4	-38.7	-177.1	-74.9	178.3	175.5	0	0	112.3	R322	R322-E326 HydrophobicContact CG-CG 4.38Å; R322-E326 IonicContact CZ-OE1 2.85Å; R322-E326 VanDerWaalsContact CZ-OE1 3.29Å; R322-E326 IonicContact NE-OE1 3.85Å; R322-E326 PolarHBondContact NE-OE1 3.48Å; R322-E326 IonicContact NH2-OE1 3.79Å; R322-E326 PolarHBondContact NH2-OE1 2.8Å; R322-E326 WeakPolarHBondContact O-CG 3.44Å; R322-E326 PolarHBondContact O-N 3.03Å
327	E	80.6	Confident	88.8	Confident	124 Å²	124	45.9 Å²	45.9	58%	0.579	21%	0.21	S	C	*	.	H	α-helix	trans	-129.1	-12.6	-172.3	-62.4	-172	172.5	0	0	114.7	H323 Q367	H323-E327 PolarHBondContact O-N 3.23Å; E327-Q367 PolarHBondContact O-NE2 2.92Å
328	G	86.4	Confident	89.4	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.23	C	C	.	.			trans	-110.6	-7.5	-164.8	0	0	0	0	0	117.7	V324 D330 T331 L334	V324-G328 CarbonylContact O-C 3.37Å; V324-G328 WeakPolarHBondContact O-CA 3.46Å; V324-G328 PolarHBondContact O-N 3.36Å; G328-D330 VanDerWaalsContact C-N 3.25Å; G328-D330 PolarHBondContact O-N 2.88Å; G328-T331 VanDerWaalsContact O-CB 3.31Å; G328-T331 WeakPolarHBondContact O-CB 3.49Å; G328-T331 PolarHBondContact O-N 3.45Å; G328-T331 VanDerWaalsContact O-N 3.17Å; G328-T331 PolarHBondContact O-OG1 2.89Å; G328-T331 VanDerWaalsContact O-OG1 3.09Å; G328-L334 WeakPolarHBondContact O-CD2 3.26Å
329	L	93.3	Very high	89.8	Confident	22 Å²	22	45.4 Å²	45.4	12%	0.115	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-26.4	-172.9	-65.7	178	0	0	0	114.1	V324 E325 F431 V435 H438 N442	V324-L329 PolarHBondContact O-N 2.81Å; E325-L329 HydrophobicContact CB-CD1 4.5Å; E325-L329 HydrophobicContact CG-CD2 4.33Å; L329-F431 HydrophobicContact CD2-CE2 4.37Å; L329-V435 HydrophobicContact CD2-CG2 3.93Å; L329-H438 HydrophobicContact CB-CB 4.41Å; L329-H438 WeakPolarHBondContact O-CB 3.42Å; L329-N442 WeakPolarHBondContact O-CB 3.49Å; L329-N442 PolarHBondContact O-ND2 2.87Å
330	D	94.1	Very high	90.2	Very high	75 Å²	75	45.1 Å²	45.1	40%	0.401	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-5.2	-179.6	-76.1	-14.6	0	0	0	113.4	G328 E332 H438 K441	G328-D330 VanDerWaalsContact C-N 3.25Å; G328-D330 PolarHBondContact O-N 2.88Å; D330-E332 PolarHBondContact O-N 2.87Å; D330-H438 IonicContact OD1-CD2 3.24Å; D330-H438 PolarHBondContact OD1-CD2 3.46Å; D330-H438 VanDerWaalsContact OD1-CD2 3.24Å; D330-H438 IonicContact OD1-CG 3.94Å; D330-K441 HydrophobicContact CB-CB 4.36Å; D330-K441 HydrophobicContact CB-CD 4.02Å; D330-K441 WeakPolarHBondContact OD1-CD 3.31Å; D330-K441 IonicContact OD1-NZ 3.48Å; D330-K441 PolarHBondContact OD1-NZ 3.36Å; D330-K441 WeakPolarHBondContact OD2-CD 3.3Å; D330-K441 IonicContact OD2-NZ 2.68Å; D330-K441 PolarHBondContact OD2-NZ 3.14Å
331	T	94.4	Very high	90.2	Very high	21 Å²	21	48.1 Å²	48.1	13%	0.129	25%	0.248	C	C	.	.	S	Bend	trans	-71.5	123.5	-173.5	-55.2	0	0	0	0	112.1	G328 G333 L334 Q367 N442	G328-T331 VanDerWaalsContact O-CB 3.31Å; G328-T331 WeakPolarHBondContact O-CB 3.49Å; G328-T331 PolarHBondContact O-N 3.45Å; G328-T331 VanDerWaalsContact O-N 3.17Å; G328-T331 PolarHBondContact O-OG1 2.89Å; G328-T331 VanDerWaalsContact O-OG1 3.09Å; T331-G333 PolarHBondContact O-N 3.41Å; T331-L334 WeakPolarHBondContact O-CB 3.47Å; T331-L334 PolarHBondContact O-N 3.07Å; T331-Q367 HydrophobicContact CG2-CB 4.42Å; T331-Q367 VanDerWaalsContact CG2-OE1 3.25Å; T331-Q367 PolarHBondContact OG1-NE2 3.38Å; T331-Q367 PolarHBondContact OG1-OE1 3.15Å; T331-N442 WeakPolarHBondContact O-CB 3.47Å
332	E	94.1	Very high	90.1	Very high	122 Å²	122	53.4 Å²	53.4	57%	0.57	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	129.4	-179.7	-170.9	174.7	168.5	0	0	112.3	D330 L334 H368 N442 K443	D330-E332 PolarHBondContact O-N 2.87Å; E332-L334 VanDerWaalsContact C-N 3.3Å; E332-L334 PolarHBondContact O-N 2.83Å; E332-H368 PolarHBondContact O-CE1 3.35Å; E332-N442 WeakPolarHBondContact CA-O 3.3Å; E332-K443 HydrophobicContact CG-CG 4.1Å
333	G	91.5	Very high	90.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	26.6	178.8	0	0	0	0	0	114.2	T331 L335 R336 I337 N442	T331-G333 PolarHBondContact O-N 3.41Å; G333-L335 PolarHBondContact O-N 3.43Å; G333-R336 PolarHBondContact O-N 2.69Å; G333-R336 VanDerWaalsContact O-N 3.11Å; G333-I337 PolarHBondContact O-N 3.03Å; G333-N442 PolarHBondContact N-O 2.76Å
334	L	92.9	Very high	90.2	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	137.6	172.5	-171.8	69.6	0	0	0	111	V324 G328 T331 E332 R336 Q367 A371 V435 M444	V324-L334 HydrophobicContact CG1-CD1 3.88Å; V324-L334 HydrophobicContact CG1-CD2 3.74Å; V324-L334 HydrophobicContact CG1-CG 4.32Å; G328-L334 WeakPolarHBondContact O-CD2 3.26Å; T331-L334 WeakPolarHBondContact O-CB 3.47Å; T331-L334 PolarHBondContact O-N 3.07Å; E332-L334 VanDerWaalsContact C-N 3.3Å; E332-L334 PolarHBondContact O-N 2.83Å; L334-R336 PolarHBondContact O-N 3.03Å; L334-Q367 HydrophobicContact CD1-CB 4.45Å; L334-A371 HydrophobicContact CD1-CB 4.17Å; L334-V435 HydrophobicContact CD2-CG1 4.1Å; L334-V435 HydrophobicContact CD2-CG2 3.77Å; L334-M444 WeakPolarHBondContact O-CE 3.46Å; L334-M444 VanDerWaalsContact O-CG 3.3Å; L334-M444 WeakPolarHBondContact O-CG 3.36Å
335	L	93.3	Very high	90	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	-38.2	-170.3	-54.6	165.9	0	0	0	115.5	G333 A371 K375 F431 F432 V449 V452 M453	G333-L335 PolarHBondContact O-N 3.43Å; L335-A371 HydrophobicContact CD2-CB 4.06Å; L335-K375 PolarHBondContact O-NZ 3.29Å; L335-F431 HydrophobicContact CD1-CE1 4.28Å; L335-F431 HydrophobicContact CD2-CE1 4.23Å; L335-F432 HydrophobicContact CD1-CD1 4.08Å; L335-F432 HydrophobicContact CD1-CE1 4.12Å; L335-V449 HydrophobicContact CD1-CG1 4.21Å; L335-V452 HydrophobicContact CB-CG1 4.46Å; L335-V452 WeakPolarHBondContact O-CG1 3.4Å; L335-M453 HydrophobicContact CD1-CG 4.41Å; L335-M453 HydrophobicContact CD1-SD 4.45Å; L335-M453 HydrophobicContact CD2-SD 4.18Å
336	R	93.7	Very high	89.9	Confident	77 Å²	77	57 Å²	57	29%	0.291	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-47.4	179.6	-179	176.4	65.7	176.4	1.4	112.8	D45 G333 L334 P338 M444 V452	D45-R336 WeakPolarHBondContact OD2-CD 3.32Å; G333-R336 PolarHBondContact O-N 2.69Å; G333-R336 VanDerWaalsContact O-N 3.11Å; L334-R336 PolarHBondContact O-N 3.03Å; R336-P338 WeakPolarHBondContact O-CD 3.4Å; R336-M444 HydrophobicContact CB-CE 3.85Å; R336-M444 HydrophobicContact CB-SD 3.73Å; R336-V452 HydrophobicContact CB-CG2 4.23Å; R336-V452 HydrophobicContact CG-CG2 4.33Å
337	I	92.6	Very high	89.9	Confident	70 Å²	70	52.1 Å²	52.1	36%	0.359	28%	0.283	S	S	.	.	S	Bend	trans	-80.5	120.7	180	-61.6	175.9	0	0	0	108.6	G333	G333-I337 PolarHBondContact O-N 3.03Å
338	P	90.4	Very high	90.1	Very high	63 Å²	63	47 Å²	47	41%	0.409	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-71.2	146.1	178.8	29.8	-34.4	0	0	0	111.4	R336	R336-P338 WeakPolarHBondContact O-CD 3.4Å
339	G	89.6	Confident	89.9	Confident	12 Å²	12	53.1 Å²	53.1	12%	0.124	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-67.2	165.6	168.6	0	0	0	0	0	111.6	A341 D369 S372	G339-A341 PolarHBondContact O-N 3.48Å; G339-A341 VanDerWaalsContact O-N 3.15Å; G339-D369 VanDerWaalsContact CA-OD1 3.24Å; G339-D369 WeakPolarHBondContact CA-OD1 3.32Å; G339-S372 PolarHBondContact N-OG 3.48Å
340	A	90.1	Very high	89.4	Confident	36 Å²	36	55.5 Å²	55.5	30%	0.298	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-70	116.1	180	0	0	0	0	0	109.5	T342 R343 V344 D369	A340-T342 VanDerWaalsContact C-N 3.27Å; A340-T342 PolarHBondContact O-N 3.01Å; A340-T342 VanDerWaalsContact O-N 3.11Å; A340-R343 HydrophobicContact CB-CB 4.14Å; A340-R343 WeakPolarHBondContact O-CA 3.38Å; A340-R343 WeakPolarHBondContact O-CB 3.43Å; A340-R343 PolarHBondContact O-N 3.14Å; A340-V344 PolarHBondContact O-N 3.28Å; A340-D369 PolarHBondContact N-OD1 3.23Å
341	A	85.9	Confident	88.9	Confident	63 Å²	63	52.3 Å²	52.3	52%	0.521	28%	0.283	S	S	.	.	H	α-helix	trans	-53.2	-39.5	-170.2	0	0	0	0	0	114.3	G339 K345	G339-A341 PolarHBondContact O-N 3.48Å; G339-A341 VanDerWaalsContact O-N 3.15Å; A341-K345 WeakPolarHBondContact O-CB 3.37Å; A341-K345 VanDerWaalsContact O-CG 3.3Å; A341-K345 WeakPolarHBondContact O-CG 3.22Å; A341-K345 PolarHBondContact O-N 2.92Å
342	T	87.8	Confident	88	Confident	118 Å²	118	54.9 Å²	54.9	72%	0.724	29%	0.294	S	S	*	.	H	α-helix	trans	-64.5	-40.6	176	49.6	0	0	0	0	112.4	A340 S346	A340-T342 VanDerWaalsContact C-N 3.27Å; A340-T342 PolarHBondContact O-N 3.01Å; A340-T342 VanDerWaalsContact O-N 3.11Å; T342-S346 PolarHBondContact O-N 2.98Å
343	R	90.3	Very high	87.3	Confident	95 Å²	95	53.2 Å²	53.2	36%	0.358	30%	0.295	S	S	.	.	H	α-helix	trans	-72.6	-42.6	178.6	-167.7	163.8	61.5	-116.7	-12	111.4	A340 K345 S346 L347 D369	A340-R343 HydrophobicContact CB-CB 4.14Å; A340-R343 WeakPolarHBondContact O-CA 3.38Å; A340-R343 WeakPolarHBondContact O-CB 3.43Å; A340-R343 PolarHBondContact O-N 3.14Å; R343-K345 VanDerWaalsContact C-N 3.33Å; R343-K345 PolarHBondContact O-N 3.22Å; R343-S346 PolarHBondContact O-N 2.82Å; R343-L347 HydrophobicContact CG-CD1 4.13Å; R343-L347 HydrophobicContact CG-CG 4.46Å; R343-L347 WeakPolarHBondContact O-CB 3.5Å; R343-L347 VanDerWaalsContact O-CG 3.25Å; R343-L347 WeakPolarHBondContact O-CG 3.43Å; R343-L347 PolarHBondContact O-N 3.08Å; R343-D369 IonicContact CZ-OD1 3.33Å; R343-D369 IonicContact CZ-OD2 3.82Å; R343-D369 IonicContact NE-OD1 2.72Å; R343-D369 IonicContact NE-OD2 2.7Å; R343-D369 PolarHBondContact NE-OD2 2.94Å; R343-D369 VanDerWaalsContact NH2-CG 3.29Å; R343-D369 IonicContact NH2-OD1 3.18Å; R343-D369 PolarHBondContact NH2-OD1 3.1Å; R343-D369 IonicContact NH2-OD2 2.67Å; R343-D369 PolarHBondContact NH2-OD2 3.49Å
344	V	87.4	Confident	86.4	Confident	16 Å²	16	53.8 Å²	53.8	10%	0.097	30%	0.299	C	S	.	.	H	α-helix	trans	-57.7	-46.1	173.7	174.6	0	0	0	0	110.6	A340 S346 L347 C348 D369 L373	A340-V344 PolarHBondContact O-N 3.28Å; V344-S346 PolarHBondContact O-N 2.82Å; V344-L347 PolarHBondContact O-N 3.45Å; V344-C348 PolarHBondContact O-N 3.4Å; V344-C348 PolarHBondContact O-SG 2.98Å; V344-D369 HydrophobicContact CG2-CB 4.1Å; V344-L373 HydrophobicContact CG1-CD2 3.89Å; V344-L373 HydrophobicContact CG1-CG 4.29Å
345	K	85.5	Confident	85	Confident	97 Å²	97	55.2 Å²	55.2	42%	0.422	31%	0.306	S	S	.	.	H	α-helix	trans	-60.5	-44.1	175.7	-75.5	179.1	-179.2	-176.5	0	112.9	A341 R343 C348 Q349	A341-K345 WeakPolarHBondContact O-CB 3.37Å; A341-K345 VanDerWaalsContact O-CG 3.3Å; A341-K345 WeakPolarHBondContact O-CG 3.22Å; A341-K345 PolarHBondContact O-N 2.92Å; R343-K345 VanDerWaalsContact C-N 3.33Å; R343-K345 PolarHBondContact O-N 3.22Å; K345-C348 WeakPolarHBondContact O-CB 3.36Å; K345-C348 PolarHBondContact O-N 2.75Å; K345-Q349 PolarHBondContact O-N 2.86Å
346	S	86.8	Confident	83.7	Confident	66 Å²	66	63.9 Å²	63.9	46%	0.462	34%	0.34	S	S	.	.	H	α-helix	trans	-61.8	-43.5	176.2	-171.5	0	0	0	0	111.8	T342 R343 V344 C348 Q349 E350	T342-S346 PolarHBondContact O-N 2.98Å; R343-S346 PolarHBondContact O-N 2.82Å; V344-S346 PolarHBondContact O-N 2.82Å; S346-C348 VanDerWaalsContact C-N 3.33Å; S346-C348 PolarHBondContact O-N 2.91Å; S346-Q349 PolarHBondContact O-N 2.87Å; S346-E350 WeakPolarHBondContact O-CB 3.42Å; S346-E350 PolarHBondContact O-N 2.87Å
347	L	87.4	Confident	82.5	Confident	17 Å²	17	65.9 Å²	65.9	9%	0.089	36%	0.356	C	S	.	.	H	α-helix	trans	-65.9	-35.5	178.1	-69.8	168.4	0	0	0	111.8	R343 V344 E350 L351 F360 V365 D369 L373	R343-L347 HydrophobicContact CG-CD1 4.13Å; R343-L347 HydrophobicContact CG-CG 4.46Å; R343-L347 WeakPolarHBondContact O-CB 3.5Å; R343-L347 VanDerWaalsContact O-CG 3.25Å; R343-L347 WeakPolarHBondContact O-CG 3.43Å; R343-L347 PolarHBondContact O-N 3.08Å; V344-L347 PolarHBondContact O-N 3.45Å; L347-E350 PolarHBondContact O-N 2.69Å; L347-L351 VanDerWaalsContact O-CB 3.3Å; L347-L351 WeakPolarHBondContact O-CB 3.27Å; L347-L351 VanDerWaalsContact O-CG 3.27Å; L347-L351 WeakPolarHBondContact O-CG 3.32Å; L347-L351 PolarHBondContact O-N 3.12Å; L347-F360 HydrophobicContact CD2-CE2 4.26Å; L347-F360 HydrophobicContact CD2-CZ 3.99Å; L347-V365 HydrophobicContact CD1-CG1 4.06Å; L347-V365 HydrophobicContact CD2-CG2 4.03Å; L347-D369 HydrophobicContact CD1-CB 3.83Å; L347-L373 HydrophobicContact CB-CD1 3.92Å; L347-L373 HydrophobicContact CB-CD2 4.42Å; L347-L373 HydrophobicContact CD1-CD1 4.14Å
348	C	84	Confident	81.2	Confident	16 Å²	16	71.4 Å²	71.4	11%	0.108	37%	0.373	C	S	.	.	H	α-helix	trans	-59.3	-49.3	171.6	-67.7	0	0	0	0	111.5	F292 V344 K345 S346 E350 L351 E352 L373 L376	F292-C348 HydrophobicContact CE2-CB 4.39Å; V344-C348 PolarHBondContact O-N 3.4Å; V344-C348 PolarHBondContact O-SG 2.98Å; K345-C348 WeakPolarHBondContact O-CB 3.36Å; K345-C348 PolarHBondContact O-N 2.75Å; S346-C348 VanDerWaalsContact C-N 3.33Å; S346-C348 PolarHBondContact O-N 2.91Å; C348-E350 VanDerWaalsContact C-N 3.33Å; C348-E350 PolarHBondContact O-N 3.07Å; C348-L351 PolarHBondContact O-N 3.29Å; C348-E352 WeakPolarHBondContact O-CG 3.32Å; C348-E352 PolarHBondContact O-N 2.92Å; C348-L373 WeakPolarHBondContact SG-CD2 3.37Å; C348-L376 WeakPolarHBondContact SG-CD2 3.49Å
349	Q	82.8	Confident	80.4	Confident	129 Å²	129	72.7 Å²	72.7	60%	0.603	38%	0.379	S	S	*	.	H	α-helix	trans	-64.5	-38.4	-179.9	-68.8	176.1	-12.3	0	0	112	K345 S346 E352 S353	K345-Q349 PolarHBondContact O-N 2.86Å; S346-Q349 PolarHBondContact O-N 2.87Å; Q349-E352 PolarHBondContact O-N 2.81Å; Q349-S353 WeakPolarHBondContact O-CB 3.46Å; Q349-S353 PolarHBondContact O-N 3.19Å; Q349-S353 PolarHBondContact O-OG 3.14Å
350	E	83.9	Confident	79.9	Confident	72 Å²	72	73 Å²	73	34%	0.336	38%	0.377	S	S	.	.	H	α-helix	trans	-66	-43.7	174.7	-169.1	-175	165.6	0	0	111.4	S346 L347 C348 E352 S353 S354 F360	S346-E350 WeakPolarHBondContact O-CB 3.42Å; S346-E350 PolarHBondContact O-N 2.87Å; L347-E350 PolarHBondContact O-N 2.69Å; C348-E350 VanDerWaalsContact C-N 3.33Å; C348-E350 PolarHBondContact O-N 3.07Å; E350-E352 VanDerWaalsContact C-N 3.3Å; E350-E352 PolarHBondContact O-N 3.49Å; E350-S353 WeakPolarHBondContact CA-OG 3.45Å; E350-S353 PolarHBondContact O-N 3.4Å; E350-S353 PolarHBondContact O-OG 2.78Å; E350-S353 VanDerWaalsContact O-OG 3.13Å; E350-S354 WeakPolarHBondContact O-CB 3.49Å; E350-S354 PolarHBondContact O-N 2.85Å; E350-S354 PolarHBondContact O-OG 2.64Å; E350-F360 HydrophobicContact CB-CD2 4.4Å; E350-F360 HydrophobicContact CB-CE2 4.1Å; E350-F360 HydrophobicContact CG-CD2 3.91Å; E350-F360 HydrophobicContact CG-CE2 3.96Å
351	L	81.8	Confident	79.5	Confident	8 Å²	8	76.4 Å²	76.4	4%	0.042	39%	0.387	C	S	.	.	H	α-helix	trans	-59.9	-40.8	174.8	-80.9	169.5	0	0	0	111.6	F292 V316 L347 C348 F355 F360 W362 L373	F292-L351 HydrophobicContact CZ-CD1 4.36Å; V316-L351 HydrophobicContact CG1-CD2 4.43Å; L347-L351 VanDerWaalsContact O-CB 3.3Å; L347-L351 WeakPolarHBondContact O-CB 3.27Å; L347-L351 VanDerWaalsContact O-CG 3.27Å; L347-L351 WeakPolarHBondContact O-CG 3.32Å; L347-L351 PolarHBondContact O-N 3.12Å; C348-L351 PolarHBondContact O-N 3.29Å; L351-F355 VanDerWaalsContact O-CB 3.3Å; L351-F355 WeakPolarHBondContact O-CB 3.27Å; L351-F355 PolarHBondContact O-N 2.98Å; L351-F360 HydrophobicContact CB-CE2 4.46Å; L351-F360 HydrophobicContact CD1-CZ 4.3Å; L351-F360 HydrophobicContact CD2-CB 4.36Å; L351-F360 HydrophobicContact CD2-CD1 3.64Å; L351-F360 HydrophobicContact CD2-CD2 3.58Å; L351-F360 HydrophobicContact CD2-CE1 3.66Å; L351-F360 HydrophobicContact CD2-CE2 3.64Å; L351-F360 HydrophobicContact CD2-CG 3.57Å; L351-F360 HydrophobicContact CD2-CZ 3.65Å; L351-F360 HydrophobicContact CG-CD2 3.87Å; L351-F360 HydrophobicContact CG-CE1 4.22Å; L351-F360 HydrophobicContact CG-CE2 3.52Å; L351-F360 HydrophobicContact CG-CG 4.36Å; L351-F360 HydrophobicContact CG-CZ 3.69Å; L351-W362 HydrophobicContact CD2-CH2 4.04Å; L351-W362 HydrophobicContact CD2-CZ2 4.11Å; L351-L373 HydrophobicContact CD1-CD1 4.08Å; L351-L373 HydrophobicContact CD1-CD2 4.4Å
352	E	77.1	Confident	79.4	Confident	76 Å²	76	75.6 Å²	75.6	36%	0.355	37%	0.371	S	S	.	.	H	α-helix	trans	-68.8	-39.7	178.5	-72.5	-176.5	154.2	0	0	112.8	I291 F292 C348 Q349 E350 F355	I291-E352 HydrophobicContact CB-CG 4.47Å; I291-E352 HydrophobicContact CD1-CB 4.29Å; I291-E352 HydrophobicContact CD1-CG 4.38Å; F292-E352 HydrophobicContact CD2-CG 4.01Å; F292-E352 WeakPolarHBondContact CD2-OE1 3.28Å; F292-E352 HydrophobicContact CE2-CG 3.92Å; C348-E352 WeakPolarHBondContact O-CG 3.32Å; C348-E352 PolarHBondContact O-N 2.92Å; Q349-E352 PolarHBondContact O-N 2.81Å; E350-E352 VanDerWaalsContact C-N 3.3Å; E350-E352 PolarHBondContact O-N 3.49Å; E352-F355 WeakPolarHBondContact O-CB 3.38Å
353	S	77.9	Confident	79.2	Confident	87 Å²	87	79.1 Å²	79.1	61%	0.608	38%	0.376	S	S	*	.	H	α-helix	trans	-79.3	-38.3	-177.3	52.5	0	0	0	0	113.1	Q349 E350 F355	Q349-S353 WeakPolarHBondContact O-CB 3.46Å; Q349-S353 PolarHBondContact O-N 3.19Å; Q349-S353 PolarHBondContact O-OG 3.14Å; E350-S353 WeakPolarHBondContact CA-OG 3.45Å; E350-S353 PolarHBondContact O-N 3.4Å; E350-S353 PolarHBondContact O-OG 2.78Å; E350-S353 VanDerWaalsContact O-OG 3.13Å; S353-F355 VanDerWaalsContact C-N 3.3Å
354	S	73.5	Confident	78.9	Confident	12 Å²	12	81.3 Å²	81.3	8%	0.084	39%	0.39	C	S	.	.	S	Bend	trans	-86.6	1.1	179.1	64.8	0	0	0	0	113.9	E350 Y356 D357 R358	E350-S354 WeakPolarHBondContact O-CB 3.49Å; E350-S354 PolarHBondContact O-N 2.85Å; E350-S354 PolarHBondContact O-OG 2.64Å; S354-Y356 PolarHBondContact O-N 2.93Å; S354-D357 PolarHBondContact O-N 3.38Å; S354-R358 PolarHBondContact O-N 2.97Å
355	F	64	Low	79	Confident	30 Å²	30	80.9 Å²	80.9	13%	0.132	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-48	-173.7	-176.3	-111.8	0	0	0	113.9	I291 V312 M313 V316 L351 E352 S353	I291-F355 HydrophobicContact CD1-CB 3.61Å; I291-F355 HydrophobicContact CD1-CD1 3.52Å; I291-F355 HydrophobicContact CD1-CD2 3.97Å; I291-F355 HydrophobicContact CD1-CE1 4.03Å; I291-F355 HydrophobicContact CD1-CE2 4.45Å; I291-F355 HydrophobicContact CD1-CG 3.45Å; I291-F355 VanDerWaalsContact CD1-CG 3.45Å; I291-F355 HydrophobicContact CD1-CZ 4.42Å; I291-F355 HydrophobicContact CG1-CD1 4.19Å; I291-F355 HydrophobicContact CG1-CE1 4.2Å; I291-F355 HydrophobicContact CG1-CG 4.41Å; I291-F355 HydrophobicContact CG1-CZ 4.44Å; I291-F355 HydrophobicContact CG2-CD2 4.3Å; I291-F355 HydrophobicContact CG2-CE2 3.97Å; I291-F355 HydrophobicContact CG2-CZ 4.11Å; V312-F355 HydrophobicContact CB-CE1 4.16Å; V312-F355 HydrophobicContact CB-CE2 4.48Å; V312-F355 HydrophobicContact CB-CZ 3.61Å; V312-F355 HydrophobicContact CG1-CD1 4.42Å; V312-F355 HydrophobicContact CG1-CE1 3.44Å; V312-F355 VanDerWaalsContact CG1-CE1 3.44Å; V312-F355 HydrophobicContact CG1-CE2 3.77Å; V312-F355 HydrophobicContact CG1-CZ 3.06Å; V312-F355 WeakPolarHBondContact O-CE2 3.18Å; M313-F355 HydrophobicContact CE-CE2 3.88Å; M313-F355 HydrophobicContact CE-CZ 4.4Å; V316-F355 HydrophobicContact CG2-CD2 3.98Å; V316-F355 HydrophobicContact CG2-CE2 3.72Å; L351-F355 VanDerWaalsContact O-CB 3.3Å; L351-F355 WeakPolarHBondContact O-CB 3.27Å; L351-F355 PolarHBondContact O-N 2.98Å; E352-F355 WeakPolarHBondContact O-CB 3.38Å; S353-F355 VanDerWaalsContact C-N 3.3Å
356	Y	65.1	Low	79.3	Confident	181 Å²	181	82.3 Å²	82.3	71%	0.71	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-29.1	-177.1	-67.3	-74.8	0	0	0	112.3	S354	S354-Y356 PolarHBondContact O-N 2.93Å
357	D	67.9	Low	79.5	Confident	120 Å²	120	81.9 Å²	81.9	64%	0.642	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-7.3	-175.7	-61.4	-27.6	0	0	0	113.2	S354 T359	S354-D357 PolarHBondContact O-N 3.38Å; D357-T359 HydrophobicContact CB-CG2 4.05Å; D357-T359 WeakPolarHBondContact O-CG2 3.41Å; D357-T359 PolarHBondContact O-N 2.9Å; D357-T359 VanDerWaalsContact O-N 3.13Å
358	R	66.9	Low	79.8	Confident	186 Å²	186	83.3 Å²	83.3	70%	0.702	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	29.6	-178.4	-57.5	-174.3	-177	-168.3	1	114.1	S354	S354-R358 PolarHBondContact O-N 2.97Å
359	T	71.8	Confident	80.2	Confident	90 Å²	90	82.5 Å²	82.5	55%	0.552	39%	0.385	S	S	*	.			trans	-93.6	2.9	-174.6	48	0	0	0	0	113.7	D357 Q361	D357-T359 HydrophobicContact CB-CG2 4.05Å; D357-T359 WeakPolarHBondContact O-CG2 3.41Å; D357-T359 PolarHBondContact O-N 2.9Å; D357-T359 VanDerWaalsContact O-N 3.13Å; T359-Q361 PolarHBondContact O-N 3.49Å
360	F	79.8	Confident	80.6	Confident	18 Å²	18	76.4 Å²	76.4	8%	0.079	36%	0.357	C	S	.	.			trans	-59.7	129.2	-177.3	-172.9	-99.8	0	0	0	112.8	L347 E350 L351 W362 V365	L347-F360 HydrophobicContact CD2-CE2 4.26Å; L347-F360 HydrophobicContact CD2-CZ 3.99Å; E350-F360 HydrophobicContact CB-CD2 4.4Å; E350-F360 HydrophobicContact CB-CE2 4.1Å; E350-F360 HydrophobicContact CG-CD2 3.91Å; E350-F360 HydrophobicContact CG-CE2 3.96Å; L351-F360 HydrophobicContact CB-CE2 4.46Å; L351-F360 HydrophobicContact CD1-CZ 4.3Å; L351-F360 HydrophobicContact CD2-CB 4.36Å; L351-F360 HydrophobicContact CD2-CD1 3.64Å; L351-F360 HydrophobicContact CD2-CD2 3.58Å; L351-F360 HydrophobicContact CD2-CE1 3.66Å; L351-F360 HydrophobicContact CD2-CE2 3.64Å; L351-F360 HydrophobicContact CD2-CG 3.57Å; L351-F360 HydrophobicContact CD2-CZ 3.65Å; L351-F360 HydrophobicContact CG-CD2 3.87Å; L351-F360 HydrophobicContact CG-CE1 4.22Å; L351-F360 HydrophobicContact CG-CE2 3.52Å; L351-F360 HydrophobicContact CG-CG 4.36Å; L351-F360 HydrophobicContact CG-CZ 3.69Å; F360-W362 AromaticContact CD1-CD1 3.89Å; F360-W362 AromaticContact CD1-CD2 3.57Å; F360-W362 HydrophobicContact CD1-CD2 3.57Å; F360-W362 AromaticContact CD1-CE2 3.47Å; F360-W362 VanDerWaalsContact CD1-CE2 3.47Å; F360-W362 HydrophobicContact CD1-CE3 4.07Å; F360-W362 AromaticContact CD1-CG 3.85Å; F360-W362 HydrophobicContact CD1-CG 3.85Å; F360-W362 HydrophobicContact CD1-CH2 4.35Å; F360-W362 AromaticContact CD1-CZ2 3.89Å; F360-W362 HydrophobicContact CD1-CZ2 3.89Å; F360-W362 HydrophobicContact CD1-CZ3 4.42Å; F360-W362 AromaticContact CD1-NE1 3.68Å; F360-W362 AromaticContact CE1-CD2 3.77Å; F360-W362 HydrophobicContact CE1-CD2 3.77Å; F360-W362 AromaticContact CE1-CE3 3.79Å; F360-W362 HydrophobicContact CE1-CE3 3.79Å; F360-W362 HydrophobicContact CE1-CG 4.25Å; F360-W362 HydrophobicContact CE1-CH2 4.3Å; F360-W362 HydrophobicContact CE1-CZ2 4.29Å; F360-W362 HydrophobicContact CE1-CZ3 4.05Å; F360-W362 PolarHBondContact O-N 2.92Å; F360-W362 VanDerWaalsContact O-N 3.14Å; F360-V365 HydrophobicContact CE1-CG2 3.59Å; F360-V365 HydrophobicContact CZ-CG2 3.62Å
361	Q	82.4	Confident	81	Confident	107 Å²	107	73 Å²	73	50%	0.5	34%	0.341	S	S	.	.			trans	-90.1	77.5	-174	-60.6	-166.7	17.6	0	0	112.4	T359 K363 Q364	T359-Q361 PolarHBondContact O-N 3.49Å; Q361-K363 PolarHBondContact O-N 3.44Å; Q361-K363 VanDerWaalsContact O-N 3.13Å; Q361-Q364 HydrophobicContact CB-CG 4.31Å; Q361-Q364 PolarHBondContact O-N 2.97Å; Q361-Q364 VanDerWaalsContact OE1-CD 3.32Å
362	W	82.8	Confident	81.5	Confident	47 Å²	47	73.3 Å²	73.3	18%	0.178	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-50.3	-39.8	-179.8	-66.6	96.6	0	0	0	114.2	V316 Q319 L320 H323 L351 F360 Q364 V365	V316-W362 HydrophobicContact CG1-CH2 4.33Å; Q319-W362 HydrophobicContact CB-CD2 4.46Å; Q319-W362 HydrophobicContact CB-CH2 3.65Å; Q319-W362 HydrophobicContact CB-CZ2 3.46Å; Q319-W362 VanDerWaalsContact CB-CZ2 3.46Å; Q319-W362 HydrophobicContact CB-CZ3 4.22Å; Q319-W362 HydrophobicContact CG-CZ2 4.13Å; L320-W362 HydrophobicContact CD2-CH2 4.25Å; L320-W362 HydrophobicContact CD2-CZ3 3.72Å; L320-W362 HydrophobicContact CG-CH2 3.97Å; L320-W362 HydrophobicContact CG-CZ3 3.85Å; H323-W362 HydrophobicContact CB-CE3 4.17Å; H323-W362 PolarHBondContact CE1-O 2.73Å; H323-W362 PolarHBondContact NE2-O 2.8Å; L351-W362 HydrophobicContact CD2-CH2 4.04Å; L351-W362 HydrophobicContact CD2-CZ2 4.11Å; F360-W362 AromaticContact CD1-CD1 3.89Å; F360-W362 AromaticContact CD1-CD2 3.57Å; F360-W362 HydrophobicContact CD1-CD2 3.57Å; F360-W362 AromaticContact CD1-CE2 3.47Å; F360-W362 VanDerWaalsContact CD1-CE2 3.47Å; F360-W362 HydrophobicContact CD1-CE3 4.07Å; F360-W362 AromaticContact CD1-CG 3.85Å; F360-W362 HydrophobicContact CD1-CG 3.85Å; F360-W362 HydrophobicContact CD1-CH2 4.35Å; F360-W362 AromaticContact CD1-CZ2 3.89Å; F360-W362 HydrophobicContact CD1-CZ2 3.89Å; F360-W362 HydrophobicContact CD1-CZ3 4.42Å; F360-W362 AromaticContact CD1-NE1 3.68Å; F360-W362 AromaticContact CE1-CD2 3.77Å; F360-W362 HydrophobicContact CE1-CD2 3.77Å; F360-W362 AromaticContact CE1-CE3 3.79Å; F360-W362 HydrophobicContact CE1-CE3 3.79Å; F360-W362 HydrophobicContact CE1-CG 4.25Å; F360-W362 HydrophobicContact CE1-CH2 4.3Å; F360-W362 HydrophobicContact CE1-CZ2 4.29Å; F360-W362 HydrophobicContact CE1-CZ3 4.05Å; F360-W362 PolarHBondContact O-N 2.92Å; F360-W362 VanDerWaalsContact O-N 3.14Å; W362-Q364 PolarHBondContact O-N 2.93Å; W362-V365 WeakPolarHBondContact O-CB 3.44Å; W362-V365 WeakPolarHBondContact O-CG2 3.43Å; W362-V365 PolarHBondContact O-N 3.05Å
363	K	83.6	Confident	82.1	Confident	191 Å²	191	69.8 Å²	69.8	83%	0.83	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-59.3	-20.4	-179.3	-65.8	-174	177	-175.9	0	114.8	Q361	Q361-K363 PolarHBondContact O-N 3.44Å; Q361-K363 VanDerWaalsContact O-N 3.13Å
364	Q	85.3	Confident	82.7	Confident	141 Å²	141	65.6 Å²	65.6	66%	0.659	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-90.2	-9.8	179.1	-60.4	-170.4	2.6	0	0	112.8	Q361 W362 K366	Q361-Q364 HydrophobicContact CB-CG 4.31Å; Q361-Q364 PolarHBondContact O-N 2.97Å; Q361-Q364 VanDerWaalsContact OE1-CD 3.32Å; W362-Q364 PolarHBondContact O-N 2.93Å; Q364-K366 PolarHBondContact O-N 3.19Å
365	V	88.8	Confident	83.5	Confident	8 Å²	8	65.4 Å²	65.4	5%	0.048	30%	0.296	C	S	.	.	S	Bend	trans	-80.5	119.5	-177.3	-174.5	0	0	0	0	110.1	H323 L347 F360 W362 D369 A370	H323-V365 PolarHBondContact NE2-O 2.9Å; L347-V365 HydrophobicContact CD1-CG1 4.06Å; L347-V365 HydrophobicContact CD2-CG2 4.03Å; F360-V365 HydrophobicContact CE1-CG2 3.59Å; F360-V365 HydrophobicContact CZ-CG2 3.62Å; W362-V365 WeakPolarHBondContact O-CB 3.44Å; W362-V365 WeakPolarHBondContact O-CG2 3.43Å; W362-V365 PolarHBondContact O-N 3.05Å; V365-D369 HydrophobicContact CG1-CB 4.38Å; V365-A370 HydrophobicContact CG1-CB 3.85Å
366	K	91.4	Very high	84.6	Confident	126 Å²	126	65.4 Å²	65.4	55%	0.548	30%	0.297	S	S	.	.			trans	-71.3	151.3	175.7	-52.5	-175.6	176.7	-177	0	110.6	Q364 H368 D369 A370	Q364-K366 PolarHBondContact O-N 3.19Å; K366-H368 PolarHBondContact O-N 2.9Å; K366-D369 WeakPolarHBondContact CB-OD2 3.35Å; K366-D369 PolarHBondContact O-N 3.13Å; K366-A370 PolarHBondContact O-N 3.35Å
367	Q	91.5	Very high	85.5	Confident	57 Å²	57	57 Å²	57	27%	0.266	26%	0.264	S	S	.	.	H	α-helix	trans	-60	-42.1	-172.9	-57	145	-21.8	0	0	112.9	E327 T331 L334 D369 A370 A371	E327-Q367 PolarHBondContact O-NE2 2.92Å; T331-Q367 HydrophobicContact CG2-CB 4.42Å; T331-Q367 VanDerWaalsContact CG2-OE1 3.25Å; T331-Q367 PolarHBondContact OG1-NE2 3.38Å; T331-Q367 PolarHBondContact OG1-OE1 3.15Å; L334-Q367 HydrophobicContact CD1-CB 4.45Å; Q367-D369 VanDerWaalsContact C-N 3.31Å; Q367-D369 PolarHBondContact O-N 3.1Å; Q367-A370 PolarHBondContact O-N 3.31Å; Q367-A371 WeakPolarHBondContact O-CB 3.47Å; Q367-A371 PolarHBondContact O-N 3Å
368	H	93.1	Very high	86.4	Confident	47 Å²	47	51.5 Å²	51.5	22%	0.218	24%	0.235	C	C	.	.	H	α-helix	trans	-65.9	-32.4	175.9	-65.1	-60.7	0	0	0	113.1	E332 K366 S372	E332-H368 PolarHBondContact O-CE1 3.35Å; K366-H368 PolarHBondContact O-N 2.9Å; H368-S372 WeakPolarHBondContact O-CB 3.48Å; H368-S372 PolarHBondContact O-N 2.82Å; H368-S372 PolarHBondContact O-OG 3.46Å
369	D	92.6	Very high	87.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-74.2	-43.4	176.6	-51.5	-46.6	0	0	0	110.2	G339 A340 R343 V344 L347 V365 K366 Q367 A371 S372 L373	G339-D369 VanDerWaalsContact CA-OD1 3.24Å; G339-D369 WeakPolarHBondContact CA-OD1 3.32Å; A340-D369 PolarHBondContact N-OD1 3.23Å; R343-D369 IonicContact CZ-OD1 3.33Å; R343-D369 IonicContact CZ-OD2 3.82Å; R343-D369 IonicContact NE-OD1 2.72Å; R343-D369 IonicContact NE-OD2 2.7Å; R343-D369 PolarHBondContact NE-OD2 2.94Å; R343-D369 VanDerWaalsContact NH2-CG 3.29Å; R343-D369 IonicContact NH2-OD1 3.18Å; R343-D369 PolarHBondContact NH2-OD1 3.1Å; R343-D369 IonicContact NH2-OD2 2.67Å; R343-D369 PolarHBondContact NH2-OD2 3.49Å; V344-D369 HydrophobicContact CG2-CB 4.1Å; L347-D369 HydrophobicContact CD1-CB 3.83Å; V365-D369 HydrophobicContact CG1-CB 4.38Å; K366-D369 WeakPolarHBondContact CB-OD2 3.35Å; K366-D369 PolarHBondContact O-N 3.13Å; Q367-D369 VanDerWaalsContact C-N 3.31Å; Q367-D369 PolarHBondContact O-N 3.1Å; D369-A371 VanDerWaalsContact C-N 3.34Å; D369-A371 PolarHBondContact O-N 3.11Å; D369-S372 WeakPolarHBondContact O-CB 3.5Å; D369-S372 PolarHBondContact O-N 3.04Å; D369-S372 VanDerWaalsContact O-N 3.1Å; D369-L373 VanDerWaalsContact O-CG 3.29Å; D369-L373 WeakPolarHBondContact O-CG 3.41Å; D369-L373 PolarHBondContact O-N 2.78Å
370	A	91.8	Very high	87.6	Confident	0 Å²	0	42 Å²	42	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57.9	-45.3	173.4	0	0	0	0	0	111.9	L320 V324 V365 K366 Q367 S372 L373 L374	L320-A370 HydrophobicContact CD2-CB 4.35Å; V324-A370 HydrophobicContact CG2-CB 3.63Å; V365-A370 HydrophobicContact CG1-CB 3.85Å; K366-A370 PolarHBondContact O-N 3.35Å; Q367-A370 PolarHBondContact O-N 3.31Å; A370-S372 VanDerWaalsContact C-N 3.32Å; A370-S372 PolarHBondContact O-N 3.27Å; A370-L373 PolarHBondContact O-N 3.34Å; A370-L374 PolarHBondContact O-N 3.4Å
371	A	92.6	Very high	87.5	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.1	-40.6	173.8	0	0	0	0	0	112.2	L334 L335 Q367 D369 L374 K375	L334-A371 HydrophobicContact CD1-CB 4.17Å; L335-A371 HydrophobicContact CD2-CB 4.06Å; Q367-A371 WeakPolarHBondContact O-CB 3.47Å; Q367-A371 PolarHBondContact O-N 3Å; D369-A371 VanDerWaalsContact C-N 3.34Å; D369-A371 PolarHBondContact O-N 3.11Å; A371-L374 PolarHBondContact O-N 3.47Å; A371-K375 WeakPolarHBondContact O-CG 3.45Å; A371-K375 PolarHBondContact O-N 2.94Å; A371-K375 VanDerWaalsContact O-N 3.08Å
372	S	91.6	Very high	87	Confident	16 Å²	16	37.7 Å²	37.7	11%	0.112	17%	0.173	C	C	.	.	H	α-helix	trans	-69.4	-37.3	177.7	-59	0	0	0	0	112.6	G339 H368 D369 A370 K375 L376	G339-S372 PolarHBondContact N-OG 3.48Å; H368-S372 WeakPolarHBondContact O-CB 3.48Å; H368-S372 PolarHBondContact O-N 2.82Å; H368-S372 PolarHBondContact O-OG 3.46Å; D369-S372 WeakPolarHBondContact O-CB 3.5Å; D369-S372 PolarHBondContact O-N 3.04Å; D369-S372 VanDerWaalsContact O-N 3.1Å; A370-S372 VanDerWaalsContact C-N 3.32Å; A370-S372 PolarHBondContact O-N 3.27Å; S372-K375 PolarHBondContact O-N 2.57Å; S372-L376 WeakPolarHBondContact O-CB 3.4Å; S372-L376 PolarHBondContact O-N 3.31Å
373	L	89.9	Confident	86.6	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-64.4	-40.8	173.4	-71.7	169.3	0	0	0	111.4	L320 V344 L347 C348 L351 D369 A370 L376 F377	L320-L373 HydrophobicContact CD1-CB 4.26Å; L320-L373 HydrophobicContact CD2-CB 3.8Å; L320-L373 HydrophobicContact CD2-CD1 4.22Å; V344-L373 HydrophobicContact CG1-CD2 3.89Å; V344-L373 HydrophobicContact CG1-CG 4.29Å; L347-L373 HydrophobicContact CB-CD1 3.92Å; L347-L373 HydrophobicContact CB-CD2 4.42Å; L347-L373 HydrophobicContact CD1-CD1 4.14Å; C348-L373 WeakPolarHBondContact SG-CD2 3.37Å; L351-L373 HydrophobicContact CD1-CD1 4.08Å; L351-L373 HydrophobicContact CD1-CD2 4.4Å; D369-L373 VanDerWaalsContact O-CG 3.29Å; D369-L373 WeakPolarHBondContact O-CG 3.41Å; D369-L373 PolarHBondContact O-N 2.78Å; A370-L373 PolarHBondContact O-N 3.34Å; L373-L376 PolarHBondContact O-N 2.91Å; L373-F377 WeakPolarHBondContact O-CB 3.35Å; L373-F377 PolarHBondContact O-N 2.72Å
374	L	90.2	Very high	86.6	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61	-46.8	174.6	-179.6	65.3	0	0	0	111.6	Y317 L320 I321 A370 A371 F377 I378 F431	Y317-L374 HydrophobicContact CD2-CD1 3.57Å; Y317-L374 HydrophobicContact CE2-CD1 3.42Å; Y317-L374 VanDerWaalsContact CE2-CD1 3.42Å; L320-L374 HydrophobicContact CB-CD1 4.38Å; I321-L374 HydrophobicContact CG1-CD1 4.03Å; I321-L374 HydrophobicContact CG1-CD2 4.17Å; A370-L374 PolarHBondContact O-N 3.4Å; A371-L374 PolarHBondContact O-N 3.47Å; L374-F377 WeakPolarHBondContact O-CB 3.31Å; L374-F377 PolarHBondContact O-N 2.9Å; L374-I378 WeakPolarHBondContact O-CG1 3.41Å; L374-I378 PolarHBondContact O-N 3.1Å; L374-F431 HydrophobicContact CD2-CD1 4.02Å; L374-F431 HydrophobicContact CD2-CE1 3.61Å; L374-F431 HydrophobicContact CD2-CZ 4.26Å
375	K	90.6	Very high	86.6	Confident	7 Å²	7	23.1 Å²	23.1	3%	0.03	11%	0.11	C	C	.	.	H	α-helix	trans	-60.7	-44.5	175.6	-69.4	-170.1	-56.8	174.3	0	111.8	E49 L335 A371 S372 I378 R379 M453	E49-K375 WeakPolarHBondContact OE1-CD 3.44Å; E49-K375 VanDerWaalsContact OE1-CE 3.29Å; E49-K375 WeakPolarHBondContact OE1-CE 3.46Å; E49-K375 IonicContact OE1-NZ 3.96Å; E49-K375 PolarHBondContact OE1-NZ 3.47Å; E49-K375 IonicContact OE2-NZ 2.74Å; E49-K375 PolarHBondContact OE2-NZ 3.34Å; L335-K375 PolarHBondContact O-NZ 3.29Å; A371-K375 WeakPolarHBondContact O-CG 3.45Å; A371-K375 PolarHBondContact O-N 2.94Å; A371-K375 VanDerWaalsContact O-N 3.08Å; S372-K375 PolarHBondContact O-N 2.57Å; K375-I378 PolarHBondContact O-N 3.36Å; K375-R379 PolarHBondContact O-N 2.95Å; K375-M453 HydrophobicContact CD-SD 3.79Å; K375-M453 HydrophobicContact CG-CE 3.95Å; K375-M453 HydrophobicContact CG-SD 3.74Å
376	L	86.8	Confident	86.6	Confident	31 Å²	31	22.7 Å²	22.7	16%	0.162	11%	0.108	C	C	.	.	H	α-helix	trans	-62.6	-42.5	177.3	-179.4	65.8	0	0	0	111.7	C348 S372 L373 I378 R379 E380	C348-L376 WeakPolarHBondContact SG-CD2 3.49Å; S372-L376 WeakPolarHBondContact O-CB 3.4Å; S372-L376 PolarHBondContact O-N 3.31Å; L373-L376 PolarHBondContact O-N 2.91Å; L376-I378 PolarHBondContact O-N 3.14Å; L376-R379 VanDerWaalsContact CD1-NH2 3.29Å; L376-R379 PolarHBondContact O-N 3.04Å; L376-E380 HydrophobicContact CD1-CG 3.68Å; L376-E380 HydrophobicContact CG-CG 4.14Å; L376-E380 WeakPolarHBondContact O-CB 3.31Å; L376-E380 WeakPolarHBondContact O-CG 3.29Å; L376-E380 PolarHBondContact O-N 3.32Å
377	F	84.6	Confident	86.3	Confident	3 Å²	3	17 Å²	17	1%	0.013	8%	0.084	C	C	.	.	H	α-helix	trans	-56.1	-49.4	178.2	177.9	-84.5	0	0	0	111.8	F292 M313 Y317 L373 L374 R379 E380 L381	F292-F377 HydrophobicContact CD1-CB 4.35Å; F292-F377 HydrophobicContact CD1-CD2 4.03Å; F292-F377 HydrophobicContact CE1-CB 4.21Å; F292-F377 HydrophobicContact CE1-CD2 4.01Å; M313-F377 HydrophobicContact CB-CE2 4.31Å; M313-F377 HydrophobicContact CB-CZ 4.2Å; M313-F377 HydrophobicContact CE-CE2 3.79Å; M313-F377 HydrophobicContact SD-CD2 4.39Å; M313-F377 HydrophobicContact SD-CE2 3.5Å; M313-F377 WeakPolarHBondContact SD-CE2 3.23Å; M313-F377 HydrophobicContact SD-CZ 4.21Å; Y317-F377 AromaticContact CD2-CD1 3.52Å; Y317-F377 HydrophobicContact CD2-CD1 3.52Å; Y317-F377 AromaticContact CD2-CE1 3.56Å; Y317-F377 HydrophobicContact CD2-CE1 3.56Å; Y317-F377 HydrophobicContact CD2-CG 4.38Å; Y317-F377 HydrophobicContact CD2-CZ 4.43Å; Y317-F377 HydrophobicContact CE2-CD1 4.31Å; Y317-F377 HydrophobicContact CE2-CE1 4.46Å; Y317-F377 HydrophobicContact CG-CD1 4.29Å; Y317-F377 AromaticContact CG-CE1 3.93Å; Y317-F377 HydrophobicContact CG-CE1 3.93Å; Y317-F377 HydrophobicContact CG-CZ 4.44Å; L373-F377 WeakPolarHBondContact O-CB 3.35Å; L373-F377 PolarHBondContact O-N 2.72Å; L374-F377 WeakPolarHBondContact O-CB 3.31Å; L374-F377 PolarHBondContact O-N 2.9Å; F377-R379 VanDerWaalsContact C-N 3.27Å; F377-R379 PolarHBondContact O-N 3.19Å; F377-E380 PolarHBondContact O-N 3.43Å; F377-L381 HydrophobicContact CD1-CD2 4.49Å; F377-L381 HydrophobicContact CE1-CD2 3.95Å; F377-L381 HydrophobicContact CZ-CD2 4.24Å; F377-L381 WeakPolarHBondContact O-CG 3.4Å; F377-L381 PolarHBondContact O-N 3.42Å
378	I	85.6	Confident	85.9	Confident	6 Å²	6	14.9 Å²	14.9	3%	0.031	7%	0.074	C	C	.	.	H	α-helix	trans	-61.2	-39.8	-179.8	-62.8	161.6	0	0	0	110.9	Y317 L374 K375 L376 L381 L428 M453 N456 I457	Y317-I378 HydrophobicContact CE2-CG1 4.24Å; L374-I378 WeakPolarHBondContact O-CG1 3.41Å; L374-I378 PolarHBondContact O-N 3.1Å; K375-I378 PolarHBondContact O-N 3.36Å; L376-I378 PolarHBondContact O-N 3.14Å; I378-L381 WeakPolarHBondContact O-CG 3.43Å; I378-L428 HydrophobicContact CD1-CD1 3.72Å; I378-L428 HydrophobicContact CD1-CD2 3.7Å; I378-L428 HydrophobicContact CD1-CG 4.38Å; I378-M453 HydrophobicContact CD1-CE 3.96Å; I378-N456 WeakPolarHBondContact CG2-O 3.43Å; I378-I457 HydrophobicContact CG2-CG1 4.48Å
379	R	84.9	Confident	85.4	Confident	31 Å²	31	15.6 Å²	15.6	12%	0.117	8%	0.078	C	C	.	.	H	α-helix	trans	-74.8	-32.2	-176.6	-173.9	173.3	66	-122	13.3	113.7	S56 K375 L376 F377 N456	S56-R379 PolarHBondContact OG-NH2 3.47Å; K375-R379 PolarHBondContact O-N 2.95Å; L376-R379 VanDerWaalsContact CD1-NH2 3.29Å; L376-R379 PolarHBondContact O-N 3.04Å; F377-R379 VanDerWaalsContact C-N 3.27Å; F377-R379 PolarHBondContact O-N 3.19Å; R379-N456 PolarHBondContact NH1-OD1 3.26Å
380	E	80.1	Confident	85.2	Confident	45 Å²	45	16.2 Å²	16.2	21%	0.21	8%	0.08	C	C	.	.	H	α-helix	trans	-86.2	-7.4	-177.4	-71.3	-65.1	141.7	0	0	113.5	F292 L376 F377 K461	F292-E380 HydrophobicContact CB-CB 3.98Å; F292-E380 CarbonylContact O-C 3.56Å; F292-E380 WeakPolarHBondContact O-CB 3.06Å; L376-E380 HydrophobicContact CD1-CG 3.68Å; L376-E380 HydrophobicContact CG-CG 4.14Å; L376-E380 WeakPolarHBondContact O-CB 3.31Å; L376-E380 WeakPolarHBondContact O-CG 3.29Å; L376-E380 PolarHBondContact O-N 3.32Å; F377-E380 PolarHBondContact O-N 3.43Å; E380-K461 WeakPolarHBondContact OE1-CE 3.44Å; E380-K461 IonicContact OE1-NZ 3.76Å; E380-K461 PolarHBondContact OE1-NZ 3.48Å; E380-K461 IonicContact OE2-NZ 3.83Å; E380-K461 PolarHBondContact OE2-NZ 3.35Å
381	L	77.3	Confident	84.9	Confident	13 Å²	13	16.2 Å²	16.2	7%	0.068	8%	0.08	C	C	.	.			trans	-48.8	131	171.3	-65.6	176.8	0	0	0	110.1	L296 F377 I378 H383 L385	L296-L381 HydrophobicContact CD1-CD1 4.46Å; L296-L381 HydrophobicContact CD2-CD2 4.12Å; L296-L381 HydrophobicContact CG-CD2 4.41Å; F377-L381 HydrophobicContact CD1-CD2 4.49Å; F377-L381 HydrophobicContact CE1-CD2 3.95Å; F377-L381 HydrophobicContact CZ-CD2 4.24Å; F377-L381 WeakPolarHBondContact O-CG 3.4Å; F377-L381 PolarHBondContact O-N 3.42Å; I378-L381 WeakPolarHBondContact O-CG 3.43Å; L381-H383 VanDerWaalsContact CB-O 3.23Å; L381-H383 WeakPolarHBondContact CB-O 3.35Å; L381-H383 PolarHBondContact O-N 2.88Å; L381-L385 HydrophobicContact CD1-CB 4.25Å
382	P	72.6	Confident	84.6	Confident	21 Å²	21	18.4 Å²	18.4	14%	0.136	9%	0.092	C	C	.	.	S	Bend	trans	-69.3	-19.3	-176.4	24.4	-31	0	0	0	113.2	A293 Q294	A293-P382 VanDerWaalsContact O-CG 3.31Å; A293-P382 WeakPolarHBondContact O-CG 3.23Å; Q294-P382 VanDerWaalsContact C-CD 3.49Å; Q294-P382 WeakPolarHBondContact O-CD 3.46Å; Q294-P382 VanDerWaalsContact O-CG 3.24Å; Q294-P382 WeakPolarHBondContact O-CG 3.49Å
383	H	74.2	Confident	84.6	Confident	67 Å²	67	17.7 Å²	17.7	31%	0.31	9%	0.087	S	C	.	.	S	Bend	trans	-123.1	138.1	162.8	-60.4	-51	0	0	0	108.6	L381	L381-H383 VanDerWaalsContact CB-O 3.23Å; L381-H383 WeakPolarHBondContact CB-O 3.35Å; L381-H383 PolarHBondContact O-N 2.88Å
384	P	83.1	Confident	84.8	Confident	5 Å²	5	17.7 Å²	17.7	3%	0.032	9%	0.087	C	C	.	.			trans	-57.6	150.2	-179.7	24.8	-33.9	0	0	0	110.9	L386 T387 V388 F460	P384-L386 PolarHBondContact O-N 3.4Å; P384-L386 VanDerWaalsContact O-N 3.17Å; P384-T387 WeakPolarHBondContact O-CA 3.41Å; P384-T387 PolarHBondContact O-N 2.82Å; P384-V388 HydrophobicContact CG-CG2 3.84Å; P384-F460 HydrophobicContact CB-CB 4.19Å; P384-F460 HydrophobicContact CB-CD1 4.05Å; P384-F460 HydrophobicContact CB-CG 4.12Å; P384-F460 HydrophobicContact CG-CD1 3.97Å; P384-F460 HydrophobicContact CG-CD2 4.41Å; P384-F460 HydrophobicContact CG-CE1 4.27Å; P384-F460 HydrophobicContact CG-CG 4.06Å
385	L	86.2	Confident	84.8	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-37.2	-178.5	-179.2	61.6	0	0	0	112.4	L381 T387 N421 T424 L425 L428	L381-L385 HydrophobicContact CD1-CB 4.25Å; L385-T387 PolarHBondContact O-N 2.81Å; L385-N421 WeakPolarHBondContact O-CB 3.42Å; L385-N421 PolarHBondContact O-ND2 3.4Å; L385-T424 HydrophobicContact CD1-CG2 3.67Å; L385-L425 HydrophobicContact CD2-CB 4.21Å; L385-L425 HydrophobicContact CD2-CD1 3.9Å; L385-L425 HydrophobicContact CG-CB 4.36Å; L385-L428 HydrophobicContact CD2-CD2 3.88Å
386	L	88.8	Confident	84.8	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	8.6	177.8	-56.8	-176.3	0	0	0	114.3	P384 L391 F394 L417 L425 I457 F458	P384-L386 PolarHBondContact O-N 3.4Å; P384-L386 VanDerWaalsContact O-N 3.17Å; L386-L391 HydrophobicContact CB-CD1 4.24Å; L386-L391 HydrophobicContact CD1-CD1 4.34Å; L386-F394 HydrophobicContact CB-CD2 3.96Å; L386-F394 HydrophobicContact CB-CE2 3.92Å; L386-F394 HydrophobicContact CD1-CB 4.49Å; L386-F394 HydrophobicContact CD1-CD1 4.29Å; L386-F394 HydrophobicContact CD1-CD2 4.12Å; L386-F394 HydrophobicContact CD1-CE2 4.43Å; L386-F394 HydrophobicContact CD1-CG 4.05Å; L386-F394 HydrophobicContact CD2-CE1 4.35Å; L386-F394 HydrophobicContact CD2-CE2 4.13Å; L386-F394 HydrophobicContact CD2-CZ 3.98Å; L386-F394 HydrophobicContact CG-CD2 4.46Å; L386-F394 HydrophobicContact CG-CE2 4.38Å; L386-L417 HydrophobicContact CD2-CD1 4.42Å; L386-L425 HydrophobicContact CD2-CD1 4.14Å; L386-L425 HydrophobicContact CD2-CD2 3.76Å; L386-I457 HydrophobicContact CD1-CG2 3.69Å; L386-I457 HydrophobicContact CG-CG2 3.89Å; L386-F458 HydrophobicContact CD1-CD1 4.38Å; L386-F458 HydrophobicContact CD1-CE1 3.74Å; L386-F458 HydrophobicContact CD1-CE2 4.04Å; L386-F458 HydrophobicContact CD1-CZ 3.54Å
387	T	85.3	Confident	85.2	Confident	7 Å²	7	17.6 Å²	17.6	4%	0.043	9%	0.088	C	C	.	.			trans	58.9	159.5	-172.2	93.5	0	0	0	0	114.6	P384 L385 E389 Y390 L391 L417 P418	P384-T387 WeakPolarHBondContact O-CA 3.41Å; P384-T387 PolarHBondContact O-N 2.82Å; L385-T387 PolarHBondContact O-N 2.81Å; T387-E389 WeakPolarHBondContact CB-OE2 3.32Å; T387-E389 PolarHBondContact OG1-OE2 3.06Å; T387-Y390 VanDerWaalsContact OG1-CD2 3.25Å; T387-Y390 WeakPolarHBondContact OG1-CD2 3.43Å; T387-L391 PolarHBondContact O-N 3.3Å; T387-L417 HydrophobicContact CG2-CD2 3.87Å; T387-P418 HydrophobicContact CG2-CG 4.03Å
388	V	81.2	Confident	85.4	Confident	11 Å²	11	18.8 Å²	18.8	7%	0.067	9%	0.094	C	C	.	.	H	α-helix	trans	-72.6	-38.2	-177.8	177.6	0	0	0	0	109.8	N281 P384 Y390 F460	N281-V388 HydrophobicContact CB-CG1 3.51Å; N281-V388 WeakPolarHBondContact CB-O 3.49Å; N281-V388 PolarHBondContact ND2-O 3.14Å; P384-V388 HydrophobicContact CG-CG2 3.84Å; V388-Y390 PolarHBondContact O-N 2.86Å; V388-F460 HydrophobicContact CG2-CE2 4.39Å
389	E	82.9	Confident	85.7	Confident	63 Å²	63	25.3 Å²	25.3	29%	0.294	12%	0.122	S	C	.	.	H	α-helix	trans	-63	-43.9	-174.3	-57.2	76.5	-166.7	0	0	111.8	P283 T387	P283-E389 WeakPolarHBondContact CG-OE1 3.2Å; T387-E389 WeakPolarHBondContact CB-OE2 3.32Å; T387-E389 PolarHBondContact OG1-OE2 3.06Å
390	Y	88.1	Confident	86	Confident	13 Å²	13	24 Å²	24	5%	0.051	12%	0.117	C	C	.	.	H	α-helix	trans	-98.2	-5.8	-174.2	-55	-58	0	0	0	114.6	E90 R260 M267 T387 V388 N392 A393 F394 L416 L417	E90-Y390 PolarHBondContact OE1-OH 3.35Å; R260-Y390 PolarHBondContact NH2-OH 2.96Å; M267-Y390 HydrophobicContact CE-CD1 4.22Å; M267-Y390 HydrophobicContact CE-CE1 4.27Å; T387-Y390 VanDerWaalsContact OG1-CD2 3.25Å; T387-Y390 WeakPolarHBondContact OG1-CD2 3.43Å; V388-Y390 PolarHBondContact O-N 2.86Å; Y390-N392 VanDerWaalsContact C-N 3.31Å; Y390-N392 PolarHBondContact O-N 3.32Å; Y390-A393 WeakPolarHBondContact O-CA 3.47Å; Y390-A393 VanDerWaalsContact O-CB 3.23Å; Y390-A393 WeakPolarHBondContact O-CB 3.46Å; Y390-A393 PolarHBondContact O-N 3.11Å; Y390-F394 WeakPolarHBondContact O-CD2 3.43Å; Y390-F394 PolarHBondContact O-N 2.81Å; Y390-L416 HydrophobicContact CE1-CB 4.18Å; Y390-L416 HydrophobicContact CE1-CD1 4.08Å; Y390-L416 HydrophobicContact CE2-CB 4Å; Y390-L416 WeakPolarHBondContact CE2-O 3.42Å; Y390-L417 HydrophobicContact CD2-CD2 4.33Å
391	L	86.5	Confident	86.4	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.4	-43.3	-176.5	-169	70.2	0	0	0	112.9	L386 T387 A393 F394 I395 F458 F460 F463	L386-L391 HydrophobicContact CB-CD1 4.24Å; L386-L391 HydrophobicContact CD1-CD1 4.34Å; T387-L391 PolarHBondContact O-N 3.3Å; L391-A393 PolarHBondContact O-N 3.05Å; L391-F394 PolarHBondContact O-N 2.93Å; L391-I395 HydrophobicContact CG-CD1 4.4Å; L391-I395 WeakPolarHBondContact O-CG1 3.27Å; L391-I395 PolarHBondContact O-N 3.21Å; L391-F458 HydrophobicContact CD1-CD1 3.57Å; L391-F458 HydrophobicContact CD1-CE1 3.97Å; L391-F458 HydrophobicContact CD1-CG 4.46Å; L391-F458 HydrophobicContact CG-CD1 4.48Å; L391-F460 HydrophobicContact CD2-CD1 3.93Å; L391-F460 HydrophobicContact CD2-CE1 3.34Å; L391-F460 HydrophobicContact CD2-CZ 4.39Å; L391-F463 HydrophobicContact CD2-CD2 3.99Å; L391-F463 HydrophobicContact CD2-CE2 4.02Å; L391-F463 HydrophobicContact CD2-CG 4.46Å; L391-F463 HydrophobicContact CD2-CZ 4.49Å
392	N	86.8	Confident	87	Confident	45 Å²	45	25.9 Å²	25.9	24%	0.241	13%	0.134	C	C	.	.	H	α-helix	trans	-62.9	-35.8	176	-70	-9.7	0	0	0	111.4	K279 N281 Y390 I395 A396	K279-N392 PolarHBondContact O-ND2 3.31Å; N281-N392 VanDerWaalsContact ND2-CG 3.27Å; N281-N392 PolarHBondContact ND2-ND2 2.76Å; N281-N392 PolarHBondContact ND2-OD1 3.32Å; N281-N392 PolarHBondContact OD1-ND2 2.8Å; Y390-N392 VanDerWaalsContact C-N 3.31Å; Y390-N392 PolarHBondContact O-N 3.32Å; N392-I395 PolarHBondContact O-N 3Å; N392-A396 WeakPolarHBondContact O-CB 3.41Å; N392-A396 PolarHBondContact O-N 2.93Å
393	A	91.3	Very high	87.8	Confident	2 Å²	2	27.5 Å²	27.5	2%	0.017	14%	0.139	C	C	.	.	H	α-helix	trans	-66.2	-43.7	176.9	0	0	0	0	0	111	V278 Y390 L391 I395 A396 V397 L413	V278-A393 HydrophobicContact CG1-CB 3.59Å; Y390-A393 WeakPolarHBondContact O-CA 3.47Å; Y390-A393 VanDerWaalsContact O-CB 3.23Å; Y390-A393 WeakPolarHBondContact O-CB 3.46Å; Y390-A393 PolarHBondContact O-N 3.11Å; L391-A393 PolarHBondContact O-N 3.05Å; A393-I395 VanDerWaalsContact C-N 3.34Å; A393-I395 PolarHBondContact O-N 3.03Å; A393-A396 PolarHBondContact O-N 3.49Å; A393-V397 WeakPolarHBondContact O-CG2 3.06Å; A393-V397 PolarHBondContact O-N 3.08Å; A393-V397 VanDerWaalsContact O-N 3.1Å; A393-L413 HydrophobicContact CB-CD1 4.31Å; A393-L413 HydrophobicContact CB-CD2 3.54Å
394	F	93.4	Very high	88.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-58	-43.7	173.2	-83.6	-78.6	0	0	0	112.3	L386 Y390 L391 V397 L410 L413 L417 F458 I482	L386-F394 HydrophobicContact CB-CD2 3.96Å; L386-F394 HydrophobicContact CB-CE2 3.92Å; L386-F394 HydrophobicContact CD1-CB 4.49Å; L386-F394 HydrophobicContact CD1-CD1 4.29Å; L386-F394 HydrophobicContact CD1-CD2 4.12Å; L386-F394 HydrophobicContact CD1-CE2 4.43Å; L386-F394 HydrophobicContact CD1-CG 4.05Å; L386-F394 HydrophobicContact CD2-CE1 4.35Å; L386-F394 HydrophobicContact CD2-CE2 4.13Å; L386-F394 HydrophobicContact CD2-CZ 3.98Å; L386-F394 HydrophobicContact CG-CD2 4.46Å; L386-F394 HydrophobicContact CG-CE2 4.38Å; Y390-F394 WeakPolarHBondContact O-CD2 3.43Å; Y390-F394 PolarHBondContact O-N 2.81Å; L391-F394 PolarHBondContact O-N 2.93Å; F394-V397 WeakPolarHBondContact O-CB 3.28Å; F394-V397 PolarHBondContact O-N 2.87Å; F394-L410 HydrophobicContact CD1-CD2 3.74Å; F394-L410 HydrophobicContact CE1-CD2 3.95Å; F394-L413 HydrophobicContact CD1-CB 4.44Å; F394-L413 HydrophobicContact CD1-CD1 3.92Å; F394-L413 HydrophobicContact CD2-CD1 4.32Å; F394-L413 HydrophobicContact CE1-CB 3.85Å; F394-L413 HydrophobicContact CE1-CD1 4.17Å; F394-L413 HydrophobicContact CE2-CB 4.02Å; F394-L413 HydrophobicContact CG-CD1 4Å; F394-L413 HydrophobicContact CZ-CB 3.61Å; F394-L413 HydrophobicContact CZ-CD1 4.47Å; F394-L417 HydrophobicContact CE2-CD2 4.25Å; F394-L417 HydrophobicContact CZ-CD1 4.27Å; F394-F458 HydrophobicContact CB-CE1 4.06Å; F394-F458 HydrophobicContact CB-CZ 4.46Å; F394-I482 HydrophobicContact CD1-CG2 4.24Å; F394-I482 WeakPolarHBondContact O-CD1 3.32Å
395	I	89.9	Confident	89.1	Confident	32 Å²	32	27.4 Å²	27.4	16%	0.164	14%	0.137	C	C	.	.	H	α-helix	trans	-67	-40.6	177.1	-64.6	167.4	0	0	0	110.7	L391 N392 A393 V397 N398 F458 F463 T479	L391-I395 HydrophobicContact CG-CD1 4.4Å; L391-I395 WeakPolarHBondContact O-CG1 3.27Å; L391-I395 PolarHBondContact O-N 3.21Å; N392-I395 PolarHBondContact O-N 3Å; A393-I395 VanDerWaalsContact C-N 3.34Å; A393-I395 PolarHBondContact O-N 3.03Å; I395-V397 PolarHBondContact O-N 3.44Å; I395-N398 PolarHBondContact O-N 3.44Å; I395-F458 HydrophobicContact CG1-CD1 4.23Å; I395-F458 HydrophobicContact CG1-CE1 4.19Å; I395-F463 HydrophobicContact CD1-CE1 4.43Å; I395-F463 HydrophobicContact CD1-CE2 4.31Å; I395-F463 HydrophobicContact CD1-CZ 3.62Å; I395-T479 HydrophobicContact CG1-CG2 4.47Å
396	A	91.2	Very high	89.5	Confident	5 Å²	5	28 Å²	28	4%	0.041	14%	0.14	C	C	.	.	H	α-helix	trans	-65.8	-19.5	-179.9	0	0	0	0	0	113.6	F271 I276 V278 N392 A393 N398 K399	F271-A396 HydrophobicContact CE1-CB 3.95Å; F271-A396 HydrophobicContact CZ-CB 4.46Å; I276-A396 HydrophobicContact CG2-CB 4.11Å; V278-A396 HydrophobicContact CG2-CB 3.93Å; N392-A396 WeakPolarHBondContact O-CB 3.41Å; N392-A396 PolarHBondContact O-N 2.93Å; A393-A396 PolarHBondContact O-N 3.49Å; A396-N398 PolarHBondContact O-N 3.24Å; A396-K399 VanDerWaalsContact O-CB 3.27Å; A396-K399 WeakPolarHBondContact O-CB 3.46Å; A396-K399 PolarHBondContact O-N 3.07Å
397	V	94.4	Very high	89.7	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-50.7	-42.2	173.2	170.2	0	0	0	0	111.3	F271 A393 F394 I395 K399 L400 Q406 A409 L410 L413 I482	F271-V397 HydrophobicContact CZ-CG2 4.31Å; A393-V397 WeakPolarHBondContact O-CG2 3.06Å; A393-V397 PolarHBondContact O-N 3.08Å; A393-V397 VanDerWaalsContact O-N 3.1Å; F394-V397 WeakPolarHBondContact O-CB 3.28Å; F394-V397 PolarHBondContact O-N 2.87Å; I395-V397 PolarHBondContact O-N 3.44Å; V397-K399 PolarHBondContact O-N 3.38Å; V397-L400 WeakPolarHBondContact O-CB 3.44Å; V397-L400 PolarHBondContact O-N 3.06Å; V397-Q406 HydrophobicContact CG1-CB 3.68Å; V397-Q406 HydrophobicContact CG1-CG 3.98Å; V397-Q406 WeakPolarHBondContact O-CG 3.39Å; V397-A409 HydrophobicContact CG2-CB 4.02Å; V397-L410 HydrophobicContact CG1-CD1 4.37Å; V397-L410 HydrophobicContact CG1-CD2 4.31Å; V397-L410 HydrophobicContact CG1-CG 3.96Å; V397-L410 HydrophobicContact CG2-CD2 4.02Å; V397-L410 HydrophobicContact CG2-CG 4.26Å; V397-L413 HydrophobicContact CG2-CD1 3.63Å; V397-I482 HydrophobicContact CB-CD1 3.71Å; V397-I482 HydrophobicContact CG1-CD1 3.74Å
398	N	90.6	Very high	90.2	Very high	28 Å²	28	28.1 Å²	28.1	15%	0.15	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-61.6	-19	-179.6	-70.4	-60.8	0	0	0	113.7	I395 A396 L400 N478 N481 I482	I395-N398 PolarHBondContact O-N 3.44Å; A396-N398 PolarHBondContact O-N 3.24Å; N398-L400 VanDerWaalsContact C-N 3.28Å; N398-N478 WeakPolarHBondContact ND2-CB 3.47Å; N398-N478 PolarHBondContact ND2-O 3.16Å; N398-N481 PolarHBondContact OD1-ND2 3.22Å; N398-I482 WeakPolarHBondContact ND2-CD1 3.49Å; N398-I482 WeakPolarHBondContact ND2-CG1 3.46Å
399	K	91.3	Very high	91	Very high	143 Å²	143	27.6 Å²	27.6	62%	0.622	14%	0.137	S	C	*	.	G	3₁₀ helix	trans	-78.9	-10.9	176.9	-56.2	177.7	179.7	178.2	0	112.8	I276 A396 V397	I276-K399 HydrophobicContact CD1-CB 3.77Å; I276-K399 HydrophobicContact CG1-CB 4.27Å; I276-K399 HydrophobicContact CG2-CD 4.25Å; A396-K399 VanDerWaalsContact O-CB 3.27Å; A396-K399 WeakPolarHBondContact O-CB 3.46Å; A396-K399 PolarHBondContact O-N 3.07Å; V397-K399 PolarHBondContact O-N 3.38Å
400	L	91.4	Very high	91.6	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.016	12%	0.123	C	C	.	.	S	Bend	trans	-72.5	137.6	177	-67.7	165.6	0	0	0	110.6	F271 A274 I276 V397 N398 T402 Q405 Q406 A409	F271-L400 HydrophobicContact CD1-CD2 4.49Å; F271-L400 HydrophobicContact CE1-CD1 4.26Å; F271-L400 HydrophobicContact CE1-CG 4.39Å; A274-L400 HydrophobicContact CB-CD2 3.62Å; I276-L400 HydrophobicContact CD1-CD2 3.69Å; I276-L400 HydrophobicContact CD1-CG 4.04Å; V397-L400 WeakPolarHBondContact O-CB 3.44Å; V397-L400 PolarHBondContact O-N 3.06Å; N398-L400 VanDerWaalsContact C-N 3.28Å; L400-T402 VanDerWaalsContact C-N 3.32Å; L400-T402 PolarHBondContact O-N 3.43Å; L400-Q405 HydrophobicContact CB-CB 4.15Å; L400-Q405 HydrophobicContact CD1-CB 4.43Å; L400-Q406 HydrophobicContact CB-CG 3.98Å; L400-Q406 PolarHBondContact O-NE2 2.87Å; L400-A409 HydrophobicContact CD1-CB 3.44Å; L400-A409 VanDerWaalsContact CD1-CB 3.44Å
401	P	88.1	Confident	92.1	Very high	68 Å²	68	24.4 Å²	24.4	44%	0.442	12%	0.123	S	C	.	.	S	Bend	trans	-69.2	-22.7	-167.3	25.6	-36.7	0	0	0	114.8	Y212	Y212-P401 HydrophobicContact CE1-CB 4.34Å; Y212-P401 HydrophobicContact CE1-CG 4.12Å
402	T	89.9	Confident	92.6	Very high	30 Å²	30	24.4 Å²	24.4	18%	0.184	12%	0.123	C	C	.	.	S	Bend	trans	-128.4	144.8	-177.3	67.4	0	0	0	0	111.7	Y212 L400 K404 Q405 Q406	Y212-T402 HydrophobicContact CE1-CG2 3.87Å; Y212-T402 HydrophobicContact CE2-CG2 3.85Å; Y212-T402 VanDerWaalsContact CZ-CG2 3.41Å; Y212-T402 WeakPolarHBondContact OH-CG2 3.37Å; L400-T402 VanDerWaalsContact C-N 3.32Å; L400-T402 PolarHBondContact O-N 3.43Å; T402-K404 PolarHBondContact O-N 3.46Å; T402-Q405 PolarHBondContact O-N 3.13Å; T402-Q405 WeakPolarHBondContact OG1-CB 3.45Å; T402-Q405 VanDerWaalsContact OG1-CG 3.28Å; T402-Q405 WeakPolarHBondContact OG1-CG 3.48Å; T402-Q405 PolarHBondContact OG1-N 2.82Å; T402-Q405 VanDerWaalsContact OG1-N 3.16Å; T402-Q406 WeakPolarHBondContact O-CG 3.32Å; T402-Q406 PolarHBondContact O-N 3.02Å
403	K	89.1	Confident	93.1	Very high	55 Å²	55	22.3 Å²	22.3	24%	0.239	11%	0.111	C	C	.	.	H	α-helix	trans	-57.4	-30.8	174.2	-58.3	-69	-167.9	172	0	112.1	D230 P234 F236 Q406 L407	D230-K403 VanDerWaalsContact OD1-CE 3.24Å; D230-K403 WeakPolarHBondContact OD1-CE 3.32Å; D230-K403 IonicContact OD1-NZ 2.65Å; D230-K403 PolarHBondContact OD1-NZ 3.43Å; D230-K403 IonicContact OD2-NZ 3.87Å; D230-K403 PolarHBondContact OD2-NZ 2.81Å; P234-K403 HydrophobicContact CG-CB 4.45Å; F236-K403 HydrophobicContact CE2-CB 4.46Å; F236-K403 HydrophobicContact CZ-CB 4.44Å; K403-Q406 VanDerWaalsContact CD-OE1 3.32Å; K403-Q406 WeakPolarHBondContact O-CB 3.41Å; K403-Q406 PolarHBondContact O-N 3.31Å; K403-L407 WeakPolarHBondContact O-CB 3.43Å; K403-L407 PolarHBondContact O-N 2.9Å
404	K	91	Very high	93.3	Very high	61 Å²	61	22.2 Å²	22.2	27%	0.265	11%	0.111	S	C	.	.	H	α-helix	trans	-60.7	-50.7	172.9	-179.3	177.6	173.2	-175.6	0	111.3	L199 F236 T402 Q406 L407 Q408	L199-K404 HydrophobicContact CD2-CD 4.34Å; L199-K404 HydrophobicContact CD2-CG 3.76Å; F236-K404 HydrophobicContact CE1-CB 4.01Å; F236-K404 HydrophobicContact CE1-CG 4.35Å; F236-K404 HydrophobicContact CZ-CB 4.01Å; T402-K404 PolarHBondContact O-N 3.46Å; K404-Q406 VanDerWaalsContact C-N 3.32Å; K404-Q406 PolarHBondContact O-N 3.13Å; K404-L407 PolarHBondContact O-N 3.3Å; K404-Q408 WeakPolarHBondContact O-CG 3.44Å; K404-Q408 PolarHBondContact O-N 3.33Å
405	Q	93	Very high	93.4	Very high	8 Å²	8	22.3 Å²	22.3	4%	0.037	11%	0.111	C	C	.	.	H	α-helix	trans	-65.5	-36.4	176.8	-72.7	173.5	14.9	0	0	111.7	A209 L400 T402 L407 Q408 A409	A209-Q405 HydrophobicContact CB-CG 4.5Å; L400-Q405 HydrophobicContact CB-CB 4.15Å; L400-Q405 HydrophobicContact CD1-CB 4.43Å; T402-Q405 PolarHBondContact O-N 3.13Å; T402-Q405 WeakPolarHBondContact OG1-CB 3.45Å; T402-Q405 VanDerWaalsContact OG1-CG 3.28Å; T402-Q405 WeakPolarHBondContact OG1-CG 3.48Å; T402-Q405 PolarHBondContact OG1-N 2.82Å; T402-Q405 VanDerWaalsContact OG1-N 3.16Å; Q405-L407 VanDerWaalsContact C-N 3.34Å; Q405-L407 PolarHBondContact O-N 3.27Å; Q405-Q408 PolarHBondContact O-N 3.25Å; Q405-A409 WeakPolarHBondContact O-CB 3.32Å; Q405-A409 PolarHBondContact O-N 2.64Å
406	Q	94.6	Very high	93.6	Very high	15 Å²	15	20.8 Å²	20.8	7%	0.07	10%	0.104	C	C	.	.	H	α-helix	trans	-58.7	-46.3	173.5	-67	178.9	-3.9	0	0	111.6	V397 L400 T402 K403 K404 A409 L410 L485	V397-Q406 HydrophobicContact CG1-CB 3.68Å; V397-Q406 HydrophobicContact CG1-CG 3.98Å; V397-Q406 WeakPolarHBondContact O-CG 3.39Å; L400-Q406 HydrophobicContact CB-CG 3.98Å; L400-Q406 PolarHBondContact O-NE2 2.87Å; T402-Q406 WeakPolarHBondContact O-CG 3.32Å; T402-Q406 PolarHBondContact O-N 3.02Å; K403-Q406 VanDerWaalsContact CD-OE1 3.32Å; K403-Q406 WeakPolarHBondContact O-CB 3.41Å; K403-Q406 PolarHBondContact O-N 3.31Å; K404-Q406 VanDerWaalsContact C-N 3.32Å; K404-Q406 PolarHBondContact O-N 3.13Å; Q406-A409 PolarHBondContact O-N 3.01Å; Q406-L410 WeakPolarHBondContact O-CG 3.3Å; Q406-L410 PolarHBondContact O-N 2.92Å; Q406-L485 HydrophobicContact CB-CD1 4.34Å
407	L	94.6	Very high	93.6	Very high	4 Å²	4	20.6 Å²	20.6	2%	0.021	10%	0.102	C	C	.	.	H	α-helix	trans	-65.9	-41.4	177.3	179.7	55.6	0	0	0	112.4	L199 F236 K403 K404 Q405 L410 N411 Y489 L492 L493	L199-L407 HydrophobicContact CD1-CD2 3.72Å; L199-L407 HydrophobicContact CD1-CG 4.47Å; F236-L407 HydrophobicContact CB-CD2 3.92Å; F236-L407 HydrophobicContact CD2-CD2 3.37Å; F236-L407 HydrophobicContact CE2-CD2 4.01Å; F236-L407 HydrophobicContact CG-CD2 3.74Å; K403-L407 WeakPolarHBondContact O-CB 3.43Å; K403-L407 PolarHBondContact O-N 2.9Å; K404-L407 PolarHBondContact O-N 3.3Å; Q405-L407 VanDerWaalsContact C-N 3.34Å; Q405-L407 PolarHBondContact O-N 3.27Å; L407-L410 PolarHBondContact O-N 3.45Å; L407-N411 PolarHBondContact O-N 3.46Å; L407-Y489 VanDerWaalsContact CD1-CB 3.45Å; L407-Y489 HydrophobicContact CD1-CD2 3.88Å; L407-Y489 HydrophobicContact CD1-CG 3.77Å; L407-Y489 HydrophobicContact CD2-CD1 4.06Å; L407-Y489 HydrophobicContact CD2-CD2 4.26Å; L407-Y489 HydrophobicContact CD2-CE1 4.46Å; L407-Y489 HydrophobicContact CD2-CG 3.94Å; L407-L492 HydrophobicContact CD2-CD1 4.04Å; L407-L493 HydrophobicContact CD1-CD2 3.62Å; L407-L493 HydrophobicContact CD1-CG 4.22Å
408	Q	95.4	Very high	93.4	Very high	5 Å²	5	22.2 Å²	22.2	2%	0.023	11%	0.112	C	C	.	.	H	α-helix	trans	-58.8	-46.2	174.1	-75.8	172.7	-35.2	0	0	111.5	F205 L270 K404 Q405 N411 L412	F205-Q408 HydrophobicContact CB-CB 4.12Å; F205-Q408 HydrophobicContact CB-CG 4.29Å; F205-Q408 HydrophobicContact CD1-CB 4.37Å; F205-Q408 HydrophobicContact CD1-CG 3.77Å; F205-Q408 HydrophobicContact CD2-CB 3.51Å; F205-Q408 HydrophobicContact CD2-CG 3.78Å; F205-Q408 HydrophobicContact CE1-CG 3.92Å; F205-Q408 HydrophobicContact CE2-CB 3.91Å; F205-Q408 HydrophobicContact CE2-CG 3.94Å; F205-Q408 HydrophobicContact CG-CB 3.76Å; F205-Q408 HydrophobicContact CG-CG 3.69Å; F205-Q408 HydrophobicContact CZ-CB 4.47Å; F205-Q408 HydrophobicContact CZ-CG 4Å; L270-Q408 HydrophobicContact CD2-CB 4.44Å; K404-Q408 WeakPolarHBondContact O-CG 3.44Å; K404-Q408 PolarHBondContact O-N 3.33Å; Q405-Q408 PolarHBondContact O-N 3.25Å; Q408-N411 PolarHBondContact O-N 3.43Å; Q408-L412 WeakPolarHBondContact O-CG 3.46Å; Q408-L412 PolarHBondContact O-N 2.84Å; Q408-L412 VanDerWaalsContact O-N 3.14Å
409	A	96.8	Very high	93.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.7	-41.8	176.8	0	0	0	0	0	112.4	L270 F271 V397 L400 Q405 Q406 N411 L412 L413	L270-A409 HydrophobicContact CD2-CB 3.85Å; F271-A409 HydrophobicContact CZ-CB 4.31Å; V397-A409 HydrophobicContact CG2-CB 4.02Å; L400-A409 HydrophobicContact CD1-CB 3.44Å; L400-A409 VanDerWaalsContact CD1-CB 3.44Å; Q405-A409 WeakPolarHBondContact O-CB 3.32Å; Q405-A409 PolarHBondContact O-N 2.64Å; Q406-A409 PolarHBondContact O-N 3.01Å; A409-N411 VanDerWaalsContact C-N 3.34Å; A409-N411 PolarHBondContact O-N 2.94Å; A409-L412 PolarHBondContact O-N 3.41Å; A409-L413 VanDerWaalsContact O-CG 3.3Å; A409-L413 WeakPolarHBondContact O-CG 3.41Å; A409-L413 PolarHBondContact O-N 3.28Å
410	L	97.3	Very high	92.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.6	-39.8	175.8	-73.2	171.6	0	0	0	112.4	F394 V397 Q406 L407 L413 V414 I482 L485 L486 L493	F394-L410 HydrophobicContact CD1-CD2 3.74Å; F394-L410 HydrophobicContact CE1-CD2 3.95Å; V397-L410 HydrophobicContact CG1-CD1 4.37Å; V397-L410 HydrophobicContact CG1-CD2 4.31Å; V397-L410 HydrophobicContact CG1-CG 3.96Å; V397-L410 HydrophobicContact CG2-CD2 4.02Å; V397-L410 HydrophobicContact CG2-CG 4.26Å; Q406-L410 WeakPolarHBondContact O-CG 3.3Å; Q406-L410 PolarHBondContact O-N 2.92Å; L407-L410 PolarHBondContact O-N 3.45Å; L410-L413 PolarHBondContact O-N 3.12Å; L410-V414 WeakPolarHBondContact O-CG2 3.25Å; L410-V414 PolarHBondContact O-N 3.17Å; L410-I482 HydrophobicContact CD2-CD1 4.42Å; L410-I482 HydrophobicContact CD2-CG2 3.93Å; L410-L485 HydrophobicContact CD1-CB 3.61Å; L410-L485 HydrophobicContact CD1-CD1 3.9Å; L410-L485 HydrophobicContact CD1-CG 4.42Å; L410-L486 HydrophobicContact CD2-CD2 4.15Å; L410-L493 HydrophobicContact CB-CD2 3.52Å
411	N	97.2	Very high	92.4	Very high	9 Å²	9	21.7 Å²	21.7	5%	0.048	12%	0.115	C	C	.	.	H	α-helix	trans	-58.5	-50.3	174.5	169.8	-102.7	0	0	0	110.5	L407 Q408 A409 L413 V414 L415 L492 L493 T495 P497	L407-N411 PolarHBondContact O-N 3.46Å; Q408-N411 PolarHBondContact O-N 3.43Å; A409-N411 VanDerWaalsContact C-N 3.34Å; A409-N411 PolarHBondContact O-N 2.94Å; N411-L413 VanDerWaalsContact C-N 3.34Å; N411-L413 PolarHBondContact O-N 2.87Å; N411-V414 PolarHBondContact O-N 3.25Å; N411-L415 VanDerWaalsContact O-CG 3.31Å; N411-L415 WeakPolarHBondContact O-CG 3.47Å; N411-L415 PolarHBondContact O-N 2.86Å; N411-L415 VanDerWaalsContact O-N 3.1Å; N411-L492 PolarHBondContact ND2-O 3.41Å; N411-L492 VanDerWaalsContact ND2-O 3.11Å; N411-L493 HydrophobicContact CB-CD2 4.13Å; N411-L493 VanDerWaalsContact N-CD2 3.34Å; N411-L493 PolarHBondContact ND2-O 3.25Å; N411-T495 PolarHBondContact ND2-O 3.34Å; N411-P497 VanDerWaalsContact OD1-CG 3.29Å; N411-P497 WeakPolarHBondContact OD1-CG 3.19Å
412	L	97.6	Very high	92.5	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.5	-42.5	177.7	-61.8	172.3	0	0	0	112	F205 V263 E266 M267 L270 Q408 A409 V414 L415 L416	F205-L412 HydrophobicContact CD2-CD1 3.96Å; F205-L412 HydrophobicContact CD2-CD2 4.14Å; F205-L412 HydrophobicContact CD2-CG 3.99Å; F205-L412 HydrophobicContact CE2-CD2 4.24Å; F205-L412 HydrophobicContact CE2-CG 4.27Å; V263-L412 HydrophobicContact CB-CD2 4.47Å; V263-L412 HydrophobicContact CG1-CB 3.84Å; V263-L412 HydrophobicContact CG1-CD2 3.86Å; V263-L412 HydrophobicContact CG1-CG 4.45Å; V263-L412 WeakPolarHBondContact CG1-O 3.42Å; V263-L412 HydrophobicContact CG2-CD2 4.32Å; E266-L412 HydrophobicContact CB-CD1 4.33Å; E266-L412 HydrophobicContact CB-CD2 4.32Å; E266-L412 HydrophobicContact CG-CD1 3.65Å; E266-L412 HydrophobicContact CG-CD2 3.89Å; E266-L412 HydrophobicContact CG-CG 4.45Å; M267-L412 HydrophobicContact CB-CB 4.19Å; M267-L412 HydrophobicContact CB-CD1 4.22Å; L270-L412 HydrophobicContact CD2-CD1 4.1Å; Q408-L412 WeakPolarHBondContact O-CG 3.46Å; Q408-L412 PolarHBondContact O-N 2.84Å; Q408-L412 VanDerWaalsContact O-N 3.14Å; A409-L412 PolarHBondContact O-N 3.41Å; L412-V414 PolarHBondContact O-N 3.26Å; L412-L415 PolarHBondContact O-N 3.37Å; L412-L416 WeakPolarHBondContact O-CG 3.49Å; L412-L416 PolarHBondContact O-N 3.44Å; L412-L416 VanDerWaalsContact O-N 3.07Å
413	L	96.6	Very high	92.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.7	-41.6	178.6	-72.4	168.9	0	0	0	112.7	M267 A393 F394 V397 A409 L410 N411 L415 L416 L417	M267-L413 HydrophobicContact CE-CD2 4.22Å; M267-L413 HydrophobicContact CG-CD2 4.24Å; M267-L413 HydrophobicContact SD-CD2 4.4Å; A393-L413 HydrophobicContact CB-CD1 4.31Å; A393-L413 HydrophobicContact CB-CD2 3.54Å; F394-L413 HydrophobicContact CD1-CB 4.44Å; F394-L413 HydrophobicContact CD1-CD1 3.92Å; F394-L413 HydrophobicContact CD2-CD1 4.32Å; F394-L413 HydrophobicContact CE1-CB 3.85Å; F394-L413 HydrophobicContact CE1-CD1 4.17Å; F394-L413 HydrophobicContact CE2-CB 4.02Å; F394-L413 HydrophobicContact CG-CD1 4Å; F394-L413 HydrophobicContact CZ-CB 3.61Å; F394-L413 HydrophobicContact CZ-CD1 4.47Å; V397-L413 HydrophobicContact CG2-CD1 3.63Å; A409-L413 VanDerWaalsContact O-CG 3.3Å; A409-L413 WeakPolarHBondContact O-CG 3.41Å; A409-L413 PolarHBondContact O-N 3.28Å; L410-L413 PolarHBondContact O-N 3.12Å; N411-L413 VanDerWaalsContact C-N 3.34Å; N411-L413 PolarHBondContact O-N 2.87Å; L413-L415 VanDerWaalsContact C-N 3.29Å; L413-L415 PolarHBondContact O-N 2.94Å; L413-L416 PolarHBondContact O-N 3.13Å; L413-L416 VanDerWaalsContact O-N 3.12Å; L413-L417 PolarHBondContact O-N 2.8Å
414	V	96.3	Very high	92.3	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.2	-38.7	175.2	167.8	0	0	0	0	111.2	L410 N411 L412 L416 L417 R422 L425 L486 L493 W494	L410-V414 WeakPolarHBondContact O-CG2 3.25Å; L410-V414 PolarHBondContact O-N 3.17Å; N411-V414 PolarHBondContact O-N 3.25Å; L412-V414 PolarHBondContact O-N 3.26Å; V414-L416 VanDerWaalsContact C-N 3.27Å; V414-L416 PolarHBondContact O-N 3.3Å; V414-L417 PolarHBondContact O-N 3.3Å; V414-R422 HydrophobicContact CG1-CG 4.12Å; V414-R422 WeakPolarHBondContact O-CD 3.34Å; V414-L425 HydrophobicContact CG2-CD2 4.42Å; V414-L486 HydrophobicContact CG2-CD2 4.29Å; V414-L493 HydrophobicContact CG2-CB 4.35Å; V414-W494 HydrophobicContact CG1-CD2 3.64Å; V414-W494 VanDerWaalsContact CG1-CE2 3.47Å; V414-W494 HydrophobicContact CG1-CE3 4.01Å; V414-W494 HydrophobicContact CG1-CG 4.13Å; V414-W494 HydrophobicContact CG1-CH2 4.08Å; V414-W494 HydrophobicContact CG1-CZ2 3.71Å; V414-W494 HydrophobicContact CG1-CZ3 4.22Å; V414-W494 HydrophobicContact CG2-CH2 4.32Å; V414-W494 HydrophobicContact CG2-CZ3 4.48Å
415	L	95.6	Very high	92.3	Very high	3 Å²	3	15.9 Å²	15.9	2%	0.016	8%	0.083	C	C	.	.	H	α-helix	trans	-69	-22.7	175.7	-64.8	177.6	0	0	0	113.3	V248 V263 N411 L412 L413 I496	V248-L415 HydrophobicContact CG2-CD2 3.24Å; V263-L415 HydrophobicContact CG1-CB 3.94Å; V263-L415 HydrophobicContact CG2-CB 4.17Å; V263-L415 HydrophobicContact CG2-CD1 4Å; N411-L415 VanDerWaalsContact O-CG 3.31Å; N411-L415 WeakPolarHBondContact O-CG 3.47Å; N411-L415 PolarHBondContact O-N 2.86Å; N411-L415 VanDerWaalsContact O-N 3.1Å; L412-L415 PolarHBondContact O-N 3.37Å; L413-L415 VanDerWaalsContact C-N 3.29Å; L413-L415 PolarHBondContact O-N 2.94Å; L415-I496 HydrophobicContact CD2-CG1 4.25Å
416	L	94.5	Very high	92.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-85.1	-15.5	174.9	-71.7	172.2	0	0	0	114.2	R260 V263 L264 M267 Y390 L412 L413 V414	R260-L416 HydrophobicContact CG-CD2 4.18Å; R260-L416 PolarHBondContact NH1-O 3.23Å; R260-L416 PolarHBondContact NH2-O 3.34Å; V263-L416 HydrophobicContact CB-CD2 4.22Å; V263-L416 HydrophobicContact CB-CG 4.46Å; V263-L416 HydrophobicContact CG1-CD1 4.17Å; V263-L416 HydrophobicContact CG1-CD2 3.91Å; V263-L416 HydrophobicContact CG1-CG 3.62Å; L264-L416 HydrophobicContact CB-CD2 3.85Å; L264-L416 HydrophobicContact CD1-CD1 4.34Å; L264-L416 HydrophobicContact CD1-CD2 4.44Å; M267-L416 HydrophobicContact CB-CD1 4.1Å; M267-L416 HydrophobicContact CE-CD1 3.35Å; M267-L416 HydrophobicContact CG-CD1 4.21Å; Y390-L416 HydrophobicContact CE1-CB 4.18Å; Y390-L416 HydrophobicContact CE1-CD1 4.08Å; Y390-L416 HydrophobicContact CE2-CB 4Å; Y390-L416 WeakPolarHBondContact CE2-O 3.42Å; L412-L416 WeakPolarHBondContact O-CG 3.49Å; L412-L416 PolarHBondContact O-N 3.44Å; L412-L416 VanDerWaalsContact O-N 3.07Å; L413-L416 PolarHBondContact O-N 3.13Å; L413-L416 VanDerWaalsContact O-N 3.12Å; V414-L416 VanDerWaalsContact C-N 3.27Å; V414-L416 PolarHBondContact O-N 3.3Å
417	L	91.2	Very high	91.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.098	C	C	.	.	S	Bend	trans	-63.6	141.9	176.5	-70.1	174.5	0	0	0	110.7	L386 T387 Y390 F394 L413 V414 N421 R422 L425	L386-L417 HydrophobicContact CD2-CD1 4.42Å; T387-L417 HydrophobicContact CG2-CD2 3.87Å; Y390-L417 HydrophobicContact CD2-CD2 4.33Å; F394-L417 HydrophobicContact CE2-CD2 4.25Å; F394-L417 HydrophobicContact CZ-CD1 4.27Å; L413-L417 PolarHBondContact O-N 2.8Å; V414-L417 PolarHBondContact O-N 3.3Å; L417-N421 HydrophobicContact CB-CB 4.46Å; L417-R422 HydrophobicContact CB-CB 3.87Å; L417-R422 PolarHBondContact O-NH1 3.27Å; L417-R422 VanDerWaalsContact O-NH1 3.15Å; L417-L425 HydrophobicContact CD1-CD2 3.64Å
418	P	88.9	Confident	91.9	Very high	35 Å²	35	18.6 Å²	18.6	23%	0.227	10%	0.097	C	C	.	.			trans	-52.4	150.2	166.9	-24.3	33.6	0	0	0	111	T387 A420 N421 R422	T387-P418 HydrophobicContact CG2-CG 4.03Å; P418-A420 PolarHBondContact O-N 2.82Å; P418-N421 HydrophobicContact CB-CB 4.39Å; P418-N421 WeakPolarHBondContact O-CB 3.23Å; P418-N421 PolarHBondContact O-N 3.33Å; P418-N421 VanDerWaalsContact O-N 3.12Å; P418-R422 WeakPolarHBondContact O-CB 3.34Å; P418-R422 PolarHBondContact O-N 3.49Å
419	E	84.3	Confident	91.9	Very high	134 Å²	134	18.5 Å²	18.5	63%	0.626	10%	0.096	S	C	*	.	H	α-helix	trans	-52.8	-52.9	-174.6	179.5	169.1	-170.5	0	0	113.1	N421 R422 D423	E419-N421 VanDerWaalsContact C-N 3.33Å; E419-N421 PolarHBondContact O-N 3.36Å; E419-R422 PolarHBondContact O-N 2.06Å; E419-D423 WeakPolarHBondContact CG-OD2 2.93Å; E419-D423 PolarHBondContact O-N 3.4Å
420	A	82.5	Confident	91.7	Very high	21 Å²	21	21.2 Å²	21.2	17%	0.174	11%	0.109	C	C	.	.	H	α-helix	trans	-56.9	-43.5	177.7	0	0	0	0	0	113.3	L296 L300 P418 T424	L296-A420 HydrophobicContact CB-CB 4.33Å; L300-A420 HydrophobicContact CD1-CB 4.07Å; P418-A420 PolarHBondContact O-N 2.82Å; A420-T424 VanDerWaalsContact O-CB 3.27Å; A420-T424 WeakPolarHBondContact O-CB 3.48Å; A420-T424 PolarHBondContact O-N 3.17Å; A420-T424 VanDerWaalsContact O-N 3.07Å; A420-T424 PolarHBondContact O-OG1 2.81Å
421	N	86.6	Confident	91.6	Very high	8 Å²	8	21.2 Å²	21.2	4%	0.043	11%	0.109	C	C	.	.	H	α-helix	trans	-65.8	-45.9	178.7	-71.7	68.1	0	0	0	111.5	L296 L385 L417 P418 E419 T424 L425	L296-N421 WeakPolarHBondContact CD1-OD1 3.49Å; L385-N421 WeakPolarHBondContact O-CB 3.42Å; L385-N421 PolarHBondContact O-ND2 3.4Å; L417-N421 HydrophobicContact CB-CB 4.46Å; P418-N421 HydrophobicContact CB-CB 4.39Å; P418-N421 WeakPolarHBondContact O-CB 3.23Å; P418-N421 PolarHBondContact O-N 3.33Å; P418-N421 VanDerWaalsContact O-N 3.12Å; E419-N421 VanDerWaalsContact C-N 3.33Å; E419-N421 PolarHBondContact O-N 3.36Å; N421-T424 PolarHBondContact O-N 2.67Å; N421-L425 WeakPolarHBondContact O-CB 3.16Å; N421-L425 PolarHBondContact O-N 3.37Å
422	R	88.6	Confident	91.5	Very high	21 Å²	21	20.8 Å²	20.8	8%	0.079	11%	0.107	C	C	.	.	H	α-helix	trans	-63.6	-42.7	-178.9	-177.2	-176.1	60.3	-119	3.6	111.8	V248 V414 L417 P418 E419 L425 K426 W494	V248-R422 VanDerWaalsContact CG1-CZ 3.44Å; V248-R422 VanDerWaalsContact CG1-NE 3.27Å; V414-R422 HydrophobicContact CG1-CG 4.12Å; V414-R422 WeakPolarHBondContact O-CD 3.34Å; L417-R422 HydrophobicContact CB-CB 3.87Å; L417-R422 PolarHBondContact O-NH1 3.27Å; L417-R422 VanDerWaalsContact O-NH1 3.15Å; P418-R422 WeakPolarHBondContact O-CB 3.34Å; P418-R422 PolarHBondContact O-N 3.49Å; E419-R422 PolarHBondContact O-N 2.06Å; R422-L425 PolarHBondContact O-N 3.41Å; R422-K426 WeakPolarHBondContact O-CB 3.45Å; R422-K426 PolarHBondContact O-N 3.07Å; R422-W494 HydrophobicContact CG-CZ2 4.49Å; R422-W494 VanDerWaalsContact CG-NE1 3.28Å; R422-W494 WeakPolarHBondContact O-CZ2 3.38Å; R422-W494 PolarHBondContact O-NE1 3Å
423	D	86.6	Confident	91.4	Very high	65 Å²	65	23.2 Å²	23.2	35%	0.348	12%	0.118	S	C	.	.	H	α-helix	trans	-74.2	-37.2	-178.5	-60.2	-19.4	0	0	0	111.2	E419 K426 A427	E419-D423 WeakPolarHBondContact CG-OD2 2.93Å; E419-D423 PolarHBondContact O-N 3.4Å; D423-K426 WeakPolarHBondContact O-CB 3.47Å; D423-K426 PolarHBondContact O-N 3.39Å; D423-A427 PolarHBondContact O-N 2.99Å
424	T	88.3	Confident	91.3	Very high	6 Å²	6	27.5 Å²	27.5	4%	0.037	13%	0.134	C	C	.	.	H	α-helix	trans	-61.3	-44.2	171.3	-58.3	0	0	0	0	111.2	Y317 L385 A420 N421 A427 L428	Y317-T424 HydrophobicContact CD1-CG2 4.18Å; Y317-T424 HydrophobicContact CE1-CG2 3.73Å; Y317-T424 HydrophobicContact CE2-CG2 4.19Å; Y317-T424 PolarHBondContact OH-O 2.87Å; Y317-T424 VanDerWaalsContact OH-O 3.07Å; L385-T424 HydrophobicContact CD1-CG2 3.67Å; A420-T424 VanDerWaalsContact O-CB 3.27Å; A420-T424 WeakPolarHBondContact O-CB 3.48Å; A420-T424 PolarHBondContact O-N 3.17Å; A420-T424 VanDerWaalsContact O-N 3.07Å; A420-T424 PolarHBondContact O-OG1 2.81Å; N421-T424 PolarHBondContact O-N 2.67Å; T424-A427 PolarHBondContact O-N 2.94Å; T424-L428 PolarHBondContact O-N 3.45Å
425	L	91.8	Very high	91.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.1	-41.6	175.4	-179.8	65.3	0	0	0	111.7	L385 L386 V414 L417 N421 R422 L428 V429 W494	L385-L425 HydrophobicContact CD2-CB 4.21Å; L385-L425 HydrophobicContact CD2-CD1 3.9Å; L385-L425 HydrophobicContact CG-CB 4.36Å; L386-L425 HydrophobicContact CD2-CD1 4.14Å; L386-L425 HydrophobicContact CD2-CD2 3.76Å; V414-L425 HydrophobicContact CG2-CD2 4.42Å; L417-L425 HydrophobicContact CD1-CD2 3.64Å; N421-L425 WeakPolarHBondContact O-CB 3.16Å; N421-L425 PolarHBondContact O-N 3.37Å; R422-L425 PolarHBondContact O-N 3.41Å; L425-L428 VanDerWaalsContact O-CB 3.31Å; L425-L428 WeakPolarHBondContact O-CB 3.35Å; L425-L428 PolarHBondContact O-N 3.41Å; L425-V429 HydrophobicContact CD1-CG1 4.2Å; L425-V429 WeakPolarHBondContact O-CG2 3.37Å; L425-V429 PolarHBondContact O-N 3.45Å; L425-W494 HydrophobicContact CB-CZ2 4.31Å; L425-W494 HydrophobicContact CD2-CH2 4.12Å; L425-W494 HydrophobicContact CD2-CZ2 4.23Å; L425-W494 HydrophobicContact CG-CH2 4.03Å; L425-W494 HydrophobicContact CG-CZ2 4.14Å
426	K	90.3	Very high	91.2	Very high	71 Å²	71	27.8 Å²	27.8	31%	0.309	14%	0.136	S	C	.	.	H	α-helix	trans	-58.3	-51.5	177.3	-168.9	-178.9	174.2	-173.6	0	111	R422 D423 L428 V429 E430 W494	R422-K426 WeakPolarHBondContact O-CB 3.45Å; R422-K426 PolarHBondContact O-N 3.07Å; D423-K426 WeakPolarHBondContact O-CB 3.47Å; D423-K426 PolarHBondContact O-N 3.39Å; K426-L428 PolarHBondContact O-N 2.95Å; K426-V429 VanDerWaalsContact O-CG2 3.3Å; K426-V429 WeakPolarHBondContact O-CG2 3.46Å; K426-V429 PolarHBondContact O-N 3.27Å; K426-E430 WeakPolarHBondContact CE-OE1 3.45Å; K426-E430 WeakPolarHBondContact O-CB 3.1Å; K426-E430 WeakPolarHBondContact O-CG 3.35Å; K426-E430 PolarHBondContact O-N 3.01Å; K426-W494 VanDerWaalsContact CA-CZ2 3.48Å; K426-W494 HydrophobicContact CB-CD2 4.4Å; K426-W494 HydrophobicContact CB-CH2 4.38Å; K426-W494 HydrophobicContact CB-CZ2 3.59Å; K426-W494 HydrophobicContact CD-CD2 4.41Å; K426-W494 HydrophobicContact CD-CG 4.22Å; K426-W494 HydrophobicContact CG-CD2 4.16Å; K426-W494 HydrophobicContact CG-CG 4.48Å; K426-W494 HydrophobicContact CG-CZ2 4.18Å
427	A	90.1	Very high	91.3	Very high	12 Å²	12	33 Å²	33	10%	0.099	16%	0.163	C	C	.	.	H	α-helix	trans	-58.8	-37.3	177.1	0	0	0	0	0	112.3	Y317 F318 I321 D423 T424 F431	Y317-A427 HydrophobicContact CE1-CB 4.16Å; F318-A427 HydrophobicContact CD1-CB 4.31Å; F318-A427 HydrophobicContact CE1-CB 3.42Å; F318-A427 VanDerWaalsContact CE1-CB 3.42Å; F318-A427 HydrophobicContact CZ-CB 4.07Å; I321-A427 HydrophobicContact CD1-CB 4.45Å; D423-A427 PolarHBondContact O-N 2.99Å; T424-A427 PolarHBondContact O-N 2.94Å; A427-F431 VanDerWaalsContact O-CB 3.29Å; A427-F431 WeakPolarHBondContact O-CB 3.18Å; A427-F431 PolarHBondContact O-N 3.29Å
428	L	93.1	Very high	91.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-50.7	177.5	-166.5	53.7	0	0	0	112.2	Y317 I378 L385 T424 L425 K426 F431 F432 I457	Y317-L428 WeakPolarHBondContact OH-CA 3.45Å; Y317-L428 WeakPolarHBondContact OH-CB 3.31Å; Y317-L428 WeakPolarHBondContact OH-CD1 3.39Å; Y317-L428 PolarHBondContact OH-N 3.4Å; I378-L428 HydrophobicContact CD1-CD1 3.72Å; I378-L428 HydrophobicContact CD1-CD2 3.7Å; I378-L428 HydrophobicContact CD1-CG 4.38Å; L385-L428 HydrophobicContact CD2-CD2 3.88Å; T424-L428 PolarHBondContact O-N 3.45Å; L425-L428 VanDerWaalsContact O-CB 3.31Å; L425-L428 WeakPolarHBondContact O-CB 3.35Å; L425-L428 PolarHBondContact O-N 3.41Å; K426-L428 PolarHBondContact O-N 2.95Å; L428-F431 WeakPolarHBondContact O-CB 3.45Å; L428-F431 PolarHBondContact O-N 3.2Å; L428-F432 HydrophobicContact CD1-CD1 4.44Å; L428-F432 HydrophobicContact CD1-CE1 3.58Å; L428-F432 HydrophobicContact CD1-CE2 4.12Å; L428-F432 HydrophobicContact CD1-CZ 3.39Å; L428-F432 HydrophobicContact CD2-CE2 4.02Å; L428-F432 HydrophobicContact CD2-CZ 3.85Å; L428-F432 HydrophobicContact CG-CD2 4.33Å; L428-F432 HydrophobicContact CG-CE1 4Å; L428-F432 HydrophobicContact CG-CE2 3.59Å; L428-F432 HydrophobicContact CG-CZ 3.38Å; L428-F432 VanDerWaalsContact O-CG 3.26Å; L428-F432 WeakPolarHBondContact O-CG 3.44Å; L428-F432 PolarHBondContact O-N 3.44Å; L428-I457 HydrophobicContact CD2-CD1 4.08Å; L428-I457 HydrophobicContact CD2-CG1 4.32Å
429	V	95.1	Very high	91.6	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.018	19%	0.188	C	C	.	.	H	α-helix	trans	-73.2	-29.7	-175.9	-60.4	0	0	0	0	112.1	L425 K426 F432 Q433 L486 Q490 W494	L425-V429 HydrophobicContact CD1-CG1 4.2Å; L425-V429 WeakPolarHBondContact O-CG2 3.37Å; L425-V429 PolarHBondContact O-N 3.45Å; K426-V429 VanDerWaalsContact O-CG2 3.3Å; K426-V429 WeakPolarHBondContact O-CG2 3.46Å; K426-V429 PolarHBondContact O-N 3.27Å; V429-F432 PolarHBondContact O-N 3.47Å; V429-Q433 PolarHBondContact O-N 3.24Å; V429-L486 HydrophobicContact CG1-CB 4.27Å; V429-Q490 HydrophobicContact CG2-CB 3.87Å; V429-Q490 PolarHBondContact O-NE2 3.47Å; V429-W494 HydrophobicContact CG2-CH2 3.93Å; V429-W494 HydrophobicContact CG2-CZ3 4.11Å
430	E	93.6	Very high	92	Very high	58 Å²	58	36.3 Å²	36.3	27%	0.271	19%	0.19	S	C	.	.	H	α-helix	trans	-65.4	-44.9	169.5	-76.3	-179.3	-172.3	0	0	111.2	K426 F432 Q433 R434 Q490	K426-E430 WeakPolarHBondContact CE-OE1 3.45Å; K426-E430 WeakPolarHBondContact O-CB 3.1Å; K426-E430 WeakPolarHBondContact O-CG 3.35Å; K426-E430 PolarHBondContact O-N 3.01Å; E430-F432 PolarHBondContact O-N 3.27Å; E430-Q433 WeakPolarHBondContact O-CB 3.31Å; E430-Q433 PolarHBondContact O-N 3.32Å; E430-R434 WeakPolarHBondContact O-CG 3.49Å; E430-R434 PolarHBondContact O-N 3.41Å; E430-R434 IonicContact OE2-NH2 3.54Å; E430-R434 PolarHBondContact OE2-NH2 3.18Å; E430-R434 VanDerWaalsContact OE2-NH2 3.11Å; E430-Q490 VanDerWaalsContact CA-OE1 3.3Å
431	F	94.7	Very high	92.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.8	-46.8	173.8	166.3	-109.3	0	0	0	111.3	I321 V324 E325 L329 L335 L374 A427 L428 Q433 R434 V435	I321-F431 HydrophobicContact CD1-CB 4.3Å; I321-F431 HydrophobicContact CG1-CB 4.45Å; I321-F431 HydrophobicContact CG1-CG 4.29Å; I321-F431 HydrophobicContact CG2-CB 3.98Å; I321-F431 HydrophobicContact CG2-CD2 3.85Å; I321-F431 HydrophobicContact CG2-CG 4.06Å; V324-F431 HydrophobicContact CB-CE2 4.06Å; V324-F431 HydrophobicContact CB-CZ 4.22Å; V324-F431 HydrophobicContact CG1-CE2 3.74Å; V324-F431 HydrophobicContact CG1-CZ 3.72Å; E325-F431 HydrophobicContact CG-CD2 3.88Å; E325-F431 HydrophobicContact CG-CE2 4.16Å; L329-F431 HydrophobicContact CD2-CE2 4.37Å; L335-F431 HydrophobicContact CD1-CE1 4.28Å; L335-F431 HydrophobicContact CD2-CE1 4.23Å; L374-F431 HydrophobicContact CD2-CD1 4.02Å; L374-F431 HydrophobicContact CD2-CE1 3.61Å; L374-F431 HydrophobicContact CD2-CZ 4.26Å; A427-F431 VanDerWaalsContact O-CB 3.29Å; A427-F431 WeakPolarHBondContact O-CB 3.18Å; A427-F431 PolarHBondContact O-N 3.29Å; L428-F431 WeakPolarHBondContact O-CB 3.45Å; L428-F431 PolarHBondContact O-N 3.2Å; F431-Q433 VanDerWaalsContact C-N 3.27Å; F431-Q433 PolarHBondContact O-N 3.45Å; F431-R434 WeakPolarHBondContact O-CB 3.22Å; F431-R434 PolarHBondContact O-N 3.31Å; F431-R434 VanDerWaalsContact O-N 3.08Å; F431-V435 HydrophobicContact CD2-CG2 4.33Å; F431-V435 HydrophobicContact CE1-CG2 4.14Å; F431-V435 HydrophobicContact CE2-CG2 3.8Å; F431-V435 HydrophobicContact CZ-CG2 3.69Å; F431-V435 WeakPolarHBondContact O-CG2 3.43Å; F431-V435 PolarHBondContact O-N 3.03Å
432	F	96.1	Very high	92.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-57.5	-40.8	175.1	-65	-20.8	0	0	0	112.4	L335 L428 V429 E430 R434 V435 I436 V449 M453 I457 I487	L335-F432 HydrophobicContact CD1-CD1 4.08Å; L335-F432 HydrophobicContact CD1-CE1 4.12Å; L428-F432 HydrophobicContact CD1-CD1 4.44Å; L428-F432 HydrophobicContact CD1-CE1 3.58Å; L428-F432 HydrophobicContact CD1-CE2 4.12Å; L428-F432 HydrophobicContact CD1-CZ 3.39Å; L428-F432 HydrophobicContact CD2-CE2 4.02Å; L428-F432 HydrophobicContact CD2-CZ 3.85Å; L428-F432 HydrophobicContact CG-CD2 4.33Å; L428-F432 HydrophobicContact CG-CE1 4Å; L428-F432 HydrophobicContact CG-CE2 3.59Å; L428-F432 HydrophobicContact CG-CZ 3.38Å; L428-F432 VanDerWaalsContact O-CG 3.26Å; L428-F432 WeakPolarHBondContact O-CG 3.44Å; L428-F432 PolarHBondContact O-N 3.44Å; V429-F432 PolarHBondContact O-N 3.47Å; E430-F432 PolarHBondContact O-N 3.27Å; F432-R434 VanDerWaalsContact C-N 3.34Å; F432-R434 PolarHBondContact O-N 2.61Å; F432-V435 WeakPolarHBondContact O-CB 3.4Å; F432-V435 PolarHBondContact O-N 3.49Å; F432-I436 WeakPolarHBondContact O-CD1 3.48Å; F432-I436 VanDerWaalsContact O-CG1 3.25Å; F432-I436 WeakPolarHBondContact O-CG1 3.45Å; F432-I436 PolarHBondContact O-N 3.26Å; F432-V449 HydrophobicContact CB-CG1 3.95Å; F432-V449 HydrophobicContact CD1-CG1 3.92Å; F432-V449 HydrophobicContact CD2-CG1 4.28Å; F432-V449 HydrophobicContact CG-CG1 3.8Å; F432-M453 HydrophobicContact CE1-CE 3.92Å; F432-M453 HydrophobicContact CE1-CG 3.69Å; F432-M453 HydrophobicContact CE1-SD 4.16Å; F432-M453 HydrophobicContact CE2-CB 4.1Å; F432-M453 HydrophobicContact CE2-CG 4.13Å; F432-M453 HydrophobicContact CZ-CB 3.81Å; F432-M453 HydrophobicContact CZ-CE 3.51Å; F432-M453 HydrophobicContact CZ-CG 3.46Å; F432-M453 VanDerWaalsContact CZ-CG 3.46Å; F432-M453 HydrophobicContact CZ-SD 4.1Å; F432-I457 HydrophobicContact CE2-CD1 4.22Å; F432-I487 HydrophobicContact CB-CD1 3.9Å; F432-I487 HydrophobicContact CB-CG1 4.03Å; F432-I487 HydrophobicContact CB-CG2 4.46Å; F432-I487 HydrophobicContact CD2-CD1 3.66Å; F432-I487 HydrophobicContact CD2-CG1 3.79Å; F432-I487 HydrophobicContact CG-CD1 4.15Å; F432-I487 HydrophobicContact CG-CG1 4.42Å
433	Q	95.1	Very high	93.1	Very high	50 Å²	50	44.9 Å²	44.9	23%	0.234	22%	0.223	C	C	.	.	H	α-helix	trans	-64.5	-38.3	176.3	-172.9	60.8	64.7	0	0	112.2	V429 E430 F431 I436 N437 Q490	V429-Q433 PolarHBondContact O-N 3.24Å; E430-Q433 WeakPolarHBondContact O-CB 3.31Å; E430-Q433 PolarHBondContact O-N 3.32Å; F431-Q433 VanDerWaalsContact C-N 3.27Å; F431-Q433 PolarHBondContact O-N 3.45Å; Q433-I436 PolarHBondContact O-N 3.49Å; Q433-N437 PolarHBondContact NE2-OD1 3.32Å; Q433-N437 WeakPolarHBondContact O-CB 3.3Å; Q433-N437 PolarHBondContact O-N 3.34Å; Q433-N437 PolarHBondContact O-ND2 2.9Å; Q433-N437 PolarHBondContact O-OD1 3.35Å; Q433-Q490 VanDerWaalsContact CB-NE2 3.31Å
434	R	95.1	Very high	93.4	Very high	90 Å²	90	41.8 Å²	41.8	34%	0.34	21%	0.207	S	C	.	.	H	α-helix	trans	-63.7	-39.9	173.9	-67.2	167.7	-167.7	133.2	12	111.8	E325 E430 F431 F432 N437 H438	E325-R434 WeakPolarHBondContact OE1-CD 3.48Å; E325-R434 IonicContact OE1-CZ 2.64Å; E325-R434 IonicContact OE1-NE 2.9Å; E325-R434 IonicContact OE1-NH1 3.64Å; E325-R434 PolarHBondContact OE1-NH1 3.11Å; E325-R434 IonicContact OE2-NH1 2.8Å; E430-R434 WeakPolarHBondContact O-CG 3.49Å; E430-R434 PolarHBondContact O-N 3.41Å; E430-R434 IonicContact OE2-NH2 3.54Å; E430-R434 PolarHBondContact OE2-NH2 3.18Å; E430-R434 VanDerWaalsContact OE2-NH2 3.11Å; F431-R434 WeakPolarHBondContact O-CB 3.22Å; F431-R434 PolarHBondContact O-N 3.31Å; F431-R434 VanDerWaalsContact O-N 3.08Å; F432-R434 VanDerWaalsContact C-N 3.34Å; F432-R434 PolarHBondContact O-N 2.61Å; R434-N437 PolarHBondContact O-N 2.95Å; R434-H438 PolarHBondContact O-ND1 3.38Å
435	V	95.4	Very high	93.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.7	-48.3	172.3	175.2	0	0	0	0	110.7	L329 L334 F431 F432 N437 H438 N442 M444 V449	L329-V435 HydrophobicContact CD2-CG2 3.93Å; L334-V435 HydrophobicContact CD2-CG1 4.1Å; L334-V435 HydrophobicContact CD2-CG2 3.77Å; F431-V435 HydrophobicContact CD2-CG2 4.33Å; F431-V435 HydrophobicContact CE1-CG2 4.14Å; F431-V435 HydrophobicContact CE2-CG2 3.8Å; F431-V435 HydrophobicContact CZ-CG2 3.69Å; F431-V435 WeakPolarHBondContact O-CG2 3.43Å; F431-V435 PolarHBondContact O-N 3.03Å; F432-V435 WeakPolarHBondContact O-CB 3.4Å; F432-V435 PolarHBondContact O-N 3.49Å; V435-N437 VanDerWaalsContact C-N 3.3Å; V435-N437 PolarHBondContact O-N 3.07Å; V435-H438 PolarHBondContact O-N 3.24Å; V435-N442 PolarHBondContact O-ND2 3.03Å; V435-M444 HydrophobicContact CG1-CB 4.01Å; V435-M444 HydrophobicContact CG1-CG 4.48Å; V435-V449 HydrophobicContact CG1-CG2 4.3Å
436	I	94.1	Very high	93.7	Very high	10 Å²	10	45.8 Å²	45.8	5%	0.051	23%	0.229	C	C	.	.	H	α-helix	trans	-64.3	-34.6	-179.8	-66.6	158.7	0	0	0	111.7	F432 Q433 H438 Q439 L446 V449 I487	F432-I436 WeakPolarHBondContact O-CD1 3.48Å; F432-I436 VanDerWaalsContact O-CG1 3.25Å; F432-I436 WeakPolarHBondContact O-CG1 3.45Å; F432-I436 PolarHBondContact O-N 3.26Å; Q433-I436 PolarHBondContact O-N 3.49Å; I436-H438 PolarHBondContact O-N 3.45Å; I436-H438 VanDerWaalsContact O-N 3.16Å; I436-Q439 WeakPolarHBondContact O-CB 3.4Å; I436-Q439 WeakPolarHBondContact O-CG 3.29Å; I436-Q439 PolarHBondContact O-N 3.32Å; I436-L446 HydrophobicContact CD1-CB 4.12Å; I436-L446 HydrophobicContact CD1-CD1 3.71Å; I436-L446 HydrophobicContact CG2-CB 4.47Å; I436-V449 HydrophobicContact CD1-CB 4.43Å; I436-V449 HydrophobicContact CD1-CG2 4.46Å; I436-V449 HydrophobicContact CG1-CB 4.46Å; I436-V449 HydrophobicContact CG1-CG2 3.97Å; I436-I487 HydrophobicContact CD1-CD1 4.47Å; I436-I487 HydrophobicContact CD1-CG2 3.63Å
437	N	95	Very high	93.7	Very high	108 Å²	108	44.4 Å²	44.4	58%	0.578	23%	0.225	S	C	*	.	H	α-helix	trans	-61.6	-23.6	175.4	-68.1	-11	0	0	0	112.4	Q433 R434 V435	Q433-N437 PolarHBondContact NE2-OD1 3.32Å; Q433-N437 WeakPolarHBondContact O-CB 3.3Å; Q433-N437 PolarHBondContact O-N 3.34Å; Q433-N437 PolarHBondContact O-ND2 2.9Å; Q433-N437 PolarHBondContact O-OD1 3.35Å; R434-N437 PolarHBondContact O-N 2.95Å; V435-N437 VanDerWaalsContact C-N 3.3Å; V435-N437 PolarHBondContact O-N 3.07Å
438	H	95.3	Very high	93.8	Very high	69 Å²	69	45.5 Å²	45.5	32%	0.319	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	12.7	175.7	-65.7	84.6	0	0	0	113.5	L329 D330 R434 V435 I436 A440 K441 N442	L329-H438 HydrophobicContact CB-CB 4.41Å; L329-H438 WeakPolarHBondContact O-CB 3.42Å; D330-H438 IonicContact OD1-CD2 3.24Å; D330-H438 PolarHBondContact OD1-CD2 3.46Å; D330-H438 VanDerWaalsContact OD1-CD2 3.24Å; D330-H438 IonicContact OD1-CG 3.94Å; R434-H438 PolarHBondContact O-ND1 3.38Å; V435-H438 PolarHBondContact O-N 3.24Å; I436-H438 PolarHBondContact O-N 3.45Å; I436-H438 VanDerWaalsContact O-N 3.16Å; H438-A440 PolarHBondContact O-N 3.33Å; H438-K441 PolarHBondContact O-N 3.22Å; H438-N442 WeakPolarHBondContact CB-ND2 3.45Å; H438-N442 PolarHBondContact O-N 3.44Å; H438-N442 VanDerWaalsContact O-N 3.08Å; H438-N442 PolarHBondContact O-ND2 3.03Å; H438-N442 PolarHBondContact O-OD1 3.11Å
439	Q	92	Very high	93.9	Very high	90 Å²	90	45.5 Å²	45.5	42%	0.421	23%	0.23	S	C	.	.	H	α-helix	trans	-52.8	-27.9	-176.8	67.5	-179.2	-30.4	0	0	114.9	I436 K441 N442 K443 M444	I436-Q439 WeakPolarHBondContact O-CB 3.4Å; I436-Q439 WeakPolarHBondContact O-CG 3.29Å; I436-Q439 PolarHBondContact O-N 3.32Å; Q439-K441 PolarHBondContact O-N 3.44Å; Q439-N442 VanDerWaalsContact CA-OD1 3.24Å; Q439-N442 WeakPolarHBondContact CA-OD1 3.24Å; Q439-K443 VanDerWaalsContact O-CA 3.25Å; Q439-K443 WeakPolarHBondContact O-CA 3.43Å; Q439-K443 PolarHBondContact O-N 2.98Å; Q439-M444 VanDerWaalsContact CB-O 3.28Å; Q439-M444 WeakPolarHBondContact CB-O 3.32Å
440	A	92.6	Very high	93.9	Very high	80 Å²	80	45.3 Å²	45.3	66%	0.661	23%	0.229	S	C	*	.	H	α-helix	trans	-59.4	-34.1	176.9	0	0	0	0	0	112.6	H438 K443	H438-A440 PolarHBondContact O-N 3.33Å; A440-K443 PolarHBondContact O-NZ 3.45Å
441	K	94.1	Very high	93.8	Very high	122 Å²	122	42.6 Å²	42.6	53%	0.53	22%	0.216	S	C	.	.	H	α-helix	trans	-99	-55.2	180	-68.4	172.9	174.4	177.4	0	111.7	D330 H438 Q439 K443	D330-K441 HydrophobicContact CB-CB 4.36Å; D330-K441 HydrophobicContact CB-CD 4.02Å; D330-K441 WeakPolarHBondContact OD1-CD 3.31Å; D330-K441 IonicContact OD1-NZ 3.48Å; D330-K441 PolarHBondContact OD1-NZ 3.36Å; D330-K441 WeakPolarHBondContact OD2-CD 3.3Å; D330-K441 IonicContact OD2-NZ 2.68Å; D330-K441 PolarHBondContact OD2-NZ 3.14Å; H438-K441 PolarHBondContact O-N 3.22Å; Q439-K441 PolarHBondContact O-N 3.44Å; K441-K443 VanDerWaalsContact C-N 3.28Å; K441-K443 PolarHBondContact O-N 3.27Å
442	N	94.6	Very high	93.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-76.3	-11.1	-175.1	67.3	32.2	0	0	0	114.5	L329 T331 E332 G333 V435 H438 Q439 M444	L329-N442 WeakPolarHBondContact O-CB 3.49Å; L329-N442 PolarHBondContact O-ND2 2.87Å; T331-N442 WeakPolarHBondContact O-CB 3.47Å; E332-N442 WeakPolarHBondContact CA-O 3.3Å; G333-N442 PolarHBondContact N-O 2.76Å; V435-N442 PolarHBondContact O-ND2 3.03Å; H438-N442 WeakPolarHBondContact CB-ND2 3.45Å; H438-N442 PolarHBondContact O-N 3.44Å; H438-N442 VanDerWaalsContact O-N 3.08Å; H438-N442 PolarHBondContact O-ND2 3.03Å; H438-N442 PolarHBondContact O-OD1 3.11Å; Q439-N442 VanDerWaalsContact CA-OD1 3.24Å; Q439-N442 WeakPolarHBondContact CA-OD1 3.24Å; N442-M444 PolarHBondContact O-N 3.27Å; N442-M444 VanDerWaalsContact OD1-CB 3.32Å; N442-M444 WeakPolarHBondContact OD1-CB 3.25Å; N442-M444 PolarHBondContact OD1-N 3.2Å
443	K	92.6	Very high	93.7	Very high	108 Å²	108	42.7 Å²	42.7	47%	0.47	22%	0.216	S	C	.	.			trans	63.2	18.9	-180	-46.5	-55.3	-178.4	-173.3	0	115	E332 Q439 A440 K441 N448	E332-K443 HydrophobicContact CG-CG 4.1Å; Q439-K443 VanDerWaalsContact O-CA 3.25Å; Q439-K443 WeakPolarHBondContact O-CA 3.43Å; Q439-K443 PolarHBondContact O-N 2.98Å; A440-K443 PolarHBondContact O-NZ 3.45Å; K441-K443 VanDerWaalsContact C-N 3.28Å; K441-K443 PolarHBondContact O-N 3.27Å; K443-N448 PolarHBondContact O-ND2 3.08Å
444	M	92.6	Very high	93.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.			trans	-99.3	99.8	179.6	-63.1	-61.9	-61	0	0	110.6	L334 R336 V435 Q439 N442 N448 V449	L334-M444 WeakPolarHBondContact O-CE 3.46Å; L334-M444 VanDerWaalsContact O-CG 3.3Å; L334-M444 WeakPolarHBondContact O-CG 3.36Å; R336-M444 HydrophobicContact CB-CE 3.85Å; R336-M444 HydrophobicContact CB-SD 3.73Å; V435-M444 HydrophobicContact CG1-CB 4.01Å; V435-M444 HydrophobicContact CG1-CG 4.48Å; Q439-M444 VanDerWaalsContact CB-O 3.28Å; Q439-M444 WeakPolarHBondContact CB-O 3.32Å; N442-M444 PolarHBondContact O-N 3.27Å; N442-M444 VanDerWaalsContact OD1-CB 3.32Å; N442-M444 WeakPolarHBondContact OD1-CB 3.25Å; N442-M444 PolarHBondContact OD1-N 3.2Å; M444-N448 HydrophobicContact CE-CB 3.98Å; M444-N448 HydrophobicContact SD-CB 4.46Å; M444-V449 HydrophobicContact CB-CG2 3.97Å; M444-V449 HydrophobicContact CE-CG2 3.91Å
445	T	92.9	Very high	93.4	Very high	50 Å²	50	36 Å²	36	31%	0.307	19%	0.189	S	C	.	.			trans	-77	167.9	174.8	69.3	0	0	0	0	111.5	N447 N448 V449	T445-N447 PolarHBondContact O-N 2.89Å; T445-N447 PolarHBondContact OG1-N 3.17Å; T445-N448 PolarHBondContact O-N 3.34Å; T445-N448 PolarHBondContact OG1-N 2.82Å; T445-N448 PolarHBondContact OG1-OD1 3.07Å; T445-N448 VanDerWaalsContact OG1-OD1 3.1Å; T445-V449 WeakPolarHBondContact O-CG2 3.41Å; T445-V449 PolarHBondContact O-N 3.17Å
446	L	92.4	Very high	93.2	Very high	40 Å²	40	36.1 Å²	36.1	21%	0.209	19%	0.19	C	C	.	.	H	α-helix	trans	-52.6	-41.5	172.2	173.3	63.6	0	0	0	111.9	L233 I436 S450 R484 I487 R488	L233-L446 HydrophobicContact CD1-CD2 4.49Å; I436-L446 HydrophobicContact CD1-CB 4.12Å; I436-L446 HydrophobicContact CD1-CD1 3.71Å; I436-L446 HydrophobicContact CG2-CB 4.47Å; L446-S450 WeakPolarHBondContact O-CB 3.25Å; L446-S450 PolarHBondContact O-N 3.39Å; L446-S450 VanDerWaalsContact O-N 3.11Å; L446-S450 PolarHBondContact O-OG 3.08Å; L446-R484 HydrophobicContact CD1-CG 4.37Å; L446-R484 HydrophobicContact CD2-CG 3.99Å; L446-R484 HydrophobicContact CG-CG 3.97Å; L446-I487 HydrophobicContact CD1-CB 3.73Å; L446-I487 HydrophobicContact CD1-CD1 4.12Å; L446-I487 HydrophobicContact CD1-CG2 3.53Å; L446-R488 HydrophobicContact CD2-CB 4.39Å
447	N	91.3	Very high	93.1	Very high	42 Å²	42	35.9 Å²	35.9	23%	0.225	19%	0.189	C	C	.	.	H	α-helix	trans	-65.2	-50.6	177.5	-172.7	39	0	0	0	111.4	L41 T445 V449 S450 V451	L41-N447 VanDerWaalsContact CD2-OD1 3.25Å; L41-N447 WeakPolarHBondContact CD2-OD1 3.31Å; T445-N447 PolarHBondContact O-N 2.89Å; T445-N447 PolarHBondContact OG1-N 3.17Å; N447-V449 VanDerWaalsContact C-N 3.31Å; N447-V449 PolarHBondContact O-N 2.85Å; N447-S450 WeakPolarHBondContact O-CB 3.4Å; N447-S450 PolarHBondContact O-N 2.87Å; N447-V451 WeakPolarHBondContact O-CG2 3.34Å; N447-V451 PolarHBondContact O-N 3.44Å; N447-V451 WeakPolarHBondContact OD1-CG2 3.4Å
448	N	92.4	Very high	92.7	Very high	35 Å²	35	30.9 Å²	30.9	19%	0.187	16%	0.162	C	C	.	.	H	α-helix	trans	-57.5	-44.7	-177.6	-62.3	1.6	0	0	0	111.5	K443 M444 T445 V452	K443-N448 PolarHBondContact O-ND2 3.08Å; M444-N448 HydrophobicContact CE-CB 3.98Å; M444-N448 HydrophobicContact SD-CB 4.46Å; T445-N448 PolarHBondContact O-N 3.34Å; T445-N448 PolarHBondContact OG1-N 2.82Å; T445-N448 PolarHBondContact OG1-OD1 3.07Å; T445-N448 VanDerWaalsContact OG1-OD1 3.1Å; N448-V452 WeakPolarHBondContact O-CB 3.48Å; N448-V452 VanDerWaalsContact O-CG2 3.26Å; N448-V452 WeakPolarHBondContact O-CG2 3.39Å; N448-V452 PolarHBondContact O-N 3.41Å; N448-V452 VanDerWaalsContact O-N 3.13Å
449	V	95.2	Very high	91.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.3	-42.3	177.1	177	0	0	0	0	111	L335 F432 V435 I436 M444 T445 N447 M453 I487	L335-V449 HydrophobicContact CD1-CG1 4.21Å; F432-V449 HydrophobicContact CB-CG1 3.95Å; F432-V449 HydrophobicContact CD1-CG1 3.92Å; F432-V449 HydrophobicContact CD2-CG1 4.28Å; F432-V449 HydrophobicContact CG-CG1 3.8Å; V435-V449 HydrophobicContact CG1-CG2 4.3Å; I436-V449 HydrophobicContact CD1-CB 4.43Å; I436-V449 HydrophobicContact CD1-CG2 4.46Å; I436-V449 HydrophobicContact CG1-CB 4.46Å; I436-V449 HydrophobicContact CG1-CG2 3.97Å; M444-V449 HydrophobicContact CB-CG2 3.97Å; M444-V449 HydrophobicContact CE-CG2 3.91Å; T445-V449 WeakPolarHBondContact O-CG2 3.41Å; T445-V449 PolarHBondContact O-N 3.17Å; N447-V449 VanDerWaalsContact C-N 3.31Å; N447-V449 PolarHBondContact O-N 2.85Å; V449-M453 HydrophobicContact CG1-CG 4.23Å; V449-M453 VanDerWaalsContact O-CB 3.25Å; V449-M453 WeakPolarHBondContact O-CB 3.39Å; V449-M453 WeakPolarHBondContact O-CG 3.32Å; V449-M453 PolarHBondContact O-N 2.94Å; V449-I487 HydrophobicContact CG1-CD1 4.09Å
450	S	94.5	Very high	90.6	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.8	-45.1	-178.4	-56.6	0	0	0	0	112.4	L446 N447 M453 A454 R484	L446-S450 WeakPolarHBondContact O-CB 3.25Å; L446-S450 PolarHBondContact O-N 3.39Å; L446-S450 VanDerWaalsContact O-N 3.11Å; L446-S450 PolarHBondContact O-OG 3.08Å; N447-S450 WeakPolarHBondContact O-CB 3.4Å; N447-S450 PolarHBondContact O-N 2.87Å; S450-M453 PolarHBondContact O-N 3.35Å; S450-A454 VanDerWaalsContact O-CB 3.25Å; S450-A454 WeakPolarHBondContact O-CB 3.47Å; S450-A454 PolarHBondContact O-N 3.29Å; S450-R484 WeakPolarHBondContact OG-CA 3.28Å; S450-R484 WeakPolarHBondContact OG-CB 3.44Å; S450-R484 PolarHBondContact OG-N 3.27Å
451	V	92.4	Very high	88.8	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.006	14%	0.139	C	C	.	.	H	α-helix	trans	-64.5	-43.6	179.6	172.5	0	0	0	0	111.1	M43 D45 Y46 N447 P455 A480	M43-V451 HydrophobicContact SD-CG1 4.34Å; M43-V451 HydrophobicContact SD-CG2 4.28Å; D45-V451 HydrophobicContact CB-CG1 4.17Å; Y46-V451 WeakPolarHBondContact CD2-O 3.47Å; N447-V451 WeakPolarHBondContact O-CG2 3.34Å; N447-V451 PolarHBondContact O-N 3.44Å; N447-V451 WeakPolarHBondContact OD1-CG2 3.4Å; V451-P455 WeakPolarHBondContact O-CD 3.27Å; V451-A480 HydrophobicContact CG2-CB 4.21Å
452	V	93.8	Very high	86.8	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-72.4	-32.6	179	173	0	0	0	0	112.7	D45 L335 R336 N448 P455 N456	D45-V452 HydrophobicContact CB-CG2 3.98Å; L335-V452 HydrophobicContact CB-CG1 4.46Å; L335-V452 WeakPolarHBondContact O-CG1 3.4Å; R336-V452 HydrophobicContact CB-CG2 4.23Å; R336-V452 HydrophobicContact CG-CG2 4.33Å; N448-V452 WeakPolarHBondContact O-CB 3.48Å; N448-V452 VanDerWaalsContact O-CG2 3.26Å; N448-V452 WeakPolarHBondContact O-CG2 3.39Å; N448-V452 PolarHBondContact O-N 3.41Å; N448-V452 VanDerWaalsContact O-N 3.13Å; V452-P455 WeakPolarHBondContact O-CD 3.21Å; V452-P455 WeakPolarHBondContact O-CG 3.44Å; V452-N456 PolarHBondContact O-ND2 3.43Å; V452-N456 VanDerWaalsContact O-ND2 3.17Å
453	M	95	Very high	84.9	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-91.9	-26.6	-175.1	-68.8	-55.1	-58	0	0	114.5	L335 K375 I378 F432 V449 S450 P455 N456 I457	L335-M453 HydrophobicContact CD1-CG 4.41Å; L335-M453 HydrophobicContact CD1-SD 4.45Å; L335-M453 HydrophobicContact CD2-SD 4.18Å; K375-M453 HydrophobicContact CD-SD 3.79Å; K375-M453 HydrophobicContact CG-CE 3.95Å; K375-M453 HydrophobicContact CG-SD 3.74Å; I378-M453 HydrophobicContact CD1-CE 3.96Å; F432-M453 HydrophobicContact CE1-CE 3.92Å; F432-M453 HydrophobicContact CE1-CG 3.69Å; F432-M453 HydrophobicContact CE1-SD 4.16Å; F432-M453 HydrophobicContact CE2-CB 4.1Å; F432-M453 HydrophobicContact CE2-CG 4.13Å; F432-M453 HydrophobicContact CZ-CB 3.81Å; F432-M453 HydrophobicContact CZ-CE 3.51Å; F432-M453 HydrophobicContact CZ-CG 3.46Å; F432-M453 VanDerWaalsContact CZ-CG 3.46Å; F432-M453 HydrophobicContact CZ-SD 4.1Å; V449-M453 HydrophobicContact CG1-CG 4.23Å; V449-M453 VanDerWaalsContact O-CB 3.25Å; V449-M453 WeakPolarHBondContact O-CB 3.39Å; V449-M453 WeakPolarHBondContact O-CG 3.32Å; V449-M453 PolarHBondContact O-N 2.94Å; S450-M453 PolarHBondContact O-N 3.35Å; M453-P455 VanDerWaalsContact C-CD 3.45Å; M453-N456 HydrophobicContact CE-CB 4.15Å; M453-N456 PolarHBondContact O-N 3.49Å; M453-I457 HydrophobicContact CB-CD1 4.38Å; M453-I457 WeakPolarHBondContact O-CG1 3.26Å; M453-I457 PolarHBondContact O-N 3.33Å; M453-I457 VanDerWaalsContact O-N 3.07Å
454	A	93.2	Very high	82.9	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-45.9	-49.7	171.6	0	0	0	0	0	114.8	Y46 S450 N456 I457 F458 A480 V483	Y46-A454 HydrophobicContact CD2-CB 4.48Å; Y46-A454 HydrophobicContact CE2-CB 4.18Å; S450-A454 VanDerWaalsContact O-CB 3.25Å; S450-A454 WeakPolarHBondContact O-CB 3.47Å; S450-A454 PolarHBondContact O-N 3.29Å; A454-N456 VanDerWaalsContact C-N 3.27Å; A454-N456 PolarHBondContact O-N 3.38Å; A454-I457 PolarHBondContact O-N 3.5Å; A454-F458 PolarHBondContact O-N 3.32Å; A454-A480 HydrophobicContact CB-CB 4.22Å; A454-V483 HydrophobicContact CB-CG2 4.02Å
455	P	91	Very high	80.9	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.5	-39.2	178.3	25.3	-37.5	0	0	0	112.3	Y46 E49 I50 I53 V451 V452 M453 I457 M459	Y46-P455 HydrophobicContact CD2-CG 4.29Å; Y46-P455 HydrophobicContact CE2-CB 4.11Å; Y46-P455 HydrophobicContact CE2-CG 4.32Å; E49-P455 HydrophobicContact CB-CG 4.04Å; E49-P455 HydrophobicContact CG-CB 4.37Å; E49-P455 HydrophobicContact CG-CG 3.58Å; I50-P455 HydrophobicContact CD1-CB 3.85Å; I53-P455 HydrophobicContact CD1-CB 3.93Å; V451-P455 WeakPolarHBondContact O-CD 3.27Å; V452-P455 WeakPolarHBondContact O-CD 3.21Å; V452-P455 WeakPolarHBondContact O-CG 3.44Å; M453-P455 VanDerWaalsContact C-CD 3.45Å; P455-I457 PolarHBondContact O-N 2.93Å; P455-M459 HydrophobicContact CB-CE 3.04Å; P455-M459 VanDerWaalsContact O-CB 3.29Å; P455-M459 WeakPolarHBondContact O-CB 3.4Å; P455-M459 WeakPolarHBondContact O-CE 3.47Å; P455-M459 PolarHBondContact O-N 2.94Å; P455-M459 VanDerWaalsContact O-N 3.11Å
456	N	90.6	Very high	79	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.011	20%	0.195	C	C	.	.	H	α-helix	trans	-73.3	-26.2	-178.3	-69.2	-75.4	0	0	0	113.5	E49 I378 R379 V452 M453 A454	E49-N456 PolarHBondContact OE1-ND2 3.36Å; I378-N456 WeakPolarHBondContact CG2-O 3.43Å; R379-N456 PolarHBondContact NH1-OD1 3.26Å; V452-N456 PolarHBondContact O-ND2 3.43Å; V452-N456 VanDerWaalsContact O-ND2 3.17Å; M453-N456 HydrophobicContact CE-CB 4.15Å; M453-N456 PolarHBondContact O-N 3.49Å; A454-N456 VanDerWaalsContact C-N 3.27Å; A454-N456 PolarHBondContact O-N 3.38Å
457	I	91.2	Very high	77.5	Confident	6 Å²	6	37.3 Å²	37.3	3%	0.031	20%	0.195	C	C	.	.	H	α-helix	trans	-88.8	-39.7	-179.9	-65.1	169.3	0	0	0	111.8	I378 L386 L428 F432 M453 A454 P455 V483	I378-I457 HydrophobicContact CG2-CG1 4.48Å; L386-I457 HydrophobicContact CD1-CG2 3.69Å; L386-I457 HydrophobicContact CG-CG2 3.89Å; L428-I457 HydrophobicContact CD2-CD1 4.08Å; L428-I457 HydrophobicContact CD2-CG1 4.32Å; F432-I457 HydrophobicContact CE2-CD1 4.22Å; M453-I457 HydrophobicContact CB-CD1 4.38Å; M453-I457 WeakPolarHBondContact O-CG1 3.26Å; M453-I457 PolarHBondContact O-N 3.33Å; M453-I457 VanDerWaalsContact O-N 3.07Å; A454-I457 PolarHBondContact O-N 3.5Å; P455-I457 PolarHBondContact O-N 2.93Å; I457-V483 HydrophobicContact CD1-CG1 4.38Å; I457-V483 HydrophobicContact CD1-CG2 3.98Å
458	F	86.3	Confident	76.3	Confident	3 Å²	3	39 Å²	39	1%	0.013	21%	0.207	C	C	.	.	H	α-helix	trans	-97.6	-24.1	-170.6	-76.7	-91.9	0	0	0	114.4	L386 L391 F394 I395 A454 T479 I482 V483	L386-F458 HydrophobicContact CD1-CD1 4.38Å; L386-F458 HydrophobicContact CD1-CE1 3.74Å; L386-F458 HydrophobicContact CD1-CE2 4.04Å; L386-F458 HydrophobicContact CD1-CZ 3.54Å; L391-F458 HydrophobicContact CD1-CD1 3.57Å; L391-F458 HydrophobicContact CD1-CE1 3.97Å; L391-F458 HydrophobicContact CD1-CG 4.46Å; L391-F458 HydrophobicContact CG-CD1 4.48Å; F394-F458 HydrophobicContact CB-CE1 4.06Å; F394-F458 HydrophobicContact CB-CZ 4.46Å; I395-F458 HydrophobicContact CG1-CD1 4.23Å; I395-F458 HydrophobicContact CG1-CE1 4.19Å; A454-F458 PolarHBondContact O-N 3.32Å; F458-T479 HydrophobicContact CB-CG2 3.86Å; F458-T479 HydrophobicContact CD1-CG2 3.62Å; F458-T479 HydrophobicContact CD2-CG2 3.99Å; F458-T479 HydrophobicContact CE1-CG2 4.15Å; F458-T479 HydrophobicContact CE2-CG2 4.48Å; F458-T479 HydrophobicContact CG-CG2 3.54Å; F458-I482 HydrophobicContact CE2-CB 4.45Å; F458-I482 HydrophobicContact CE2-CG2 4.41Å; F458-I482 HydrophobicContact CZ-CB 3.97Å; F458-I482 HydrophobicContact CZ-CG2 3.74Å; F458-V483 HydrophobicContact CD2-CG2 4.34Å; F458-V483 HydrophobicContact CE2-CG2 3.81Å
459	M	75.9	Confident	75	Confident	14 Å²	14	45.4 Å²	45.4	7%	0.069	24%	0.235	C	C	.	.			trans	-98.9	104.6	-177.4	-57	-170.7	-70.3	0	0	111.6	I50 I53 P455 R464	I50-M459 HydrophobicContact CD1-CE 2.94Å; I50-M459 HydrophobicContact CD1-SD 3.67Å; I50-M459 HydrophobicContact CG1-CE 4.45Å; I53-M459 HydrophobicContact CD1-CE 4.01Å; P455-M459 HydrophobicContact CB-CE 3.04Å; P455-M459 VanDerWaalsContact O-CB 3.29Å; P455-M459 WeakPolarHBondContact O-CB 3.4Å; P455-M459 WeakPolarHBondContact O-CE 3.47Å; P455-M459 PolarHBondContact O-N 2.94Å; P455-M459 VanDerWaalsContact O-N 3.11Å; M459-R464 VanDerWaalsContact CE-NH2 3.29Å; M459-R464 PolarHBondContact SD-NE 3.02Å; M459-R464 PolarHBondContact SD-NH2 3.35Å
460	F	68.3	Low	73.5	Confident	41 Å²	41	54.1 Å²	54.1	18%	0.18	28%	0.276	C	S	.	.			trans	-112.5	161.3	173.4	71.2	-79.3	0	0	0	111	P384 V388 L391 G462 F463	P384-F460 HydrophobicContact CB-CB 4.19Å; P384-F460 HydrophobicContact CB-CD1 4.05Å; P384-F460 HydrophobicContact CB-CG 4.12Å; P384-F460 HydrophobicContact CG-CD1 3.97Å; P384-F460 HydrophobicContact CG-CD2 4.41Å; P384-F460 HydrophobicContact CG-CE1 4.27Å; P384-F460 HydrophobicContact CG-CG 4.06Å; V388-F460 HydrophobicContact CG2-CE2 4.39Å; L391-F460 HydrophobicContact CD2-CD1 3.93Å; L391-F460 HydrophobicContact CD2-CE1 3.34Å; L391-F460 HydrophobicContact CD2-CZ 4.39Å; F460-G462 PolarHBondContact O-N 3.5Å; F460-F463 HydrophobicContact CD1-CB 3.86Å; F460-F463 HydrophobicContact CD1-CG 4.47Å; F460-F463 HydrophobicContact CE1-CB 3.53Å; F460-F463 AromaticContact CE1-CD2 3.99Å; F460-F463 HydrophobicContact CE1-CD2 3.99Å; F460-F463 AromaticContact CE1-CG 3.97Å; F460-F463 HydrophobicContact CE1-CG 3.97Å; F460-F463 HydrophobicContact CZ-CB 4Å; F460-F463 HydrophobicContact CZ-CD2 4.5Å; F460-F463 PolarHBondContact O-N 2.94Å; F460-F463 VanDerWaalsContact O-N 3.11Å
461	K	54.4	Low	72.5	Confident	157 Å²	157	59.5 Å²	59.5	68%	0.683	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	108.8	179.6	-65.1	175.5	-177.2	168.8	0	109.1	E380	E380-K461 WeakPolarHBondContact OE1-CE 3.44Å; E380-K461 IonicContact OE1-NZ 3.76Å; E380-K461 PolarHBondContact OE1-NZ 3.48Å; E380-K461 IonicContact OE2-NZ 3.83Å; E380-K461 PolarHBondContact OE2-NZ 3.35Å
462	G	52.1	Low	71.9	Confident	53 Å²	53	62.2 Å²	62.2	55%	0.546	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	121.4	-20.1	-178	0	0	0	0	0	115.7	F460	F460-G462 PolarHBondContact O-N 3.5Å
463	F	54.1	Low	71.3	Confident	32 Å²	32	66 Å²	66	14%	0.14	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-29.3	179.7	-169.3	-109.1	0	0	0	113.6	L391 I395 F460 S465 M475	L391-F463 HydrophobicContact CD2-CD2 3.99Å; L391-F463 HydrophobicContact CD2-CE2 4.02Å; L391-F463 HydrophobicContact CD2-CG 4.46Å; L391-F463 HydrophobicContact CD2-CZ 4.49Å; I395-F463 HydrophobicContact CD1-CE1 4.43Å; I395-F463 HydrophobicContact CD1-CE2 4.31Å; I395-F463 HydrophobicContact CD1-CZ 3.62Å; F460-F463 HydrophobicContact CD1-CB 3.86Å; F460-F463 HydrophobicContact CD1-CG 4.47Å; F460-F463 HydrophobicContact CE1-CB 3.53Å; F460-F463 AromaticContact CE1-CD2 3.99Å; F460-F463 HydrophobicContact CE1-CD2 3.99Å; F460-F463 AromaticContact CE1-CG 3.97Å; F460-F463 HydrophobicContact CE1-CG 3.97Å; F460-F463 HydrophobicContact CZ-CB 4Å; F460-F463 HydrophobicContact CZ-CD2 4.5Å; F460-F463 PolarHBondContact O-N 2.94Å; F460-F463 VanDerWaalsContact O-N 3.11Å; F463-S465 PolarHBondContact O-N 3.24Å; F463-M475 HydrophobicContact CE1-CE 4.35Å; F463-M475 HydrophobicContact CE1-SD 3.52Å; F463-M475 VanDerWaalsContact CE1-SD 3.52Å; F463-M475 HydrophobicContact CZ-SD 4.09Å
464	R	52.2	Low	70.7	Confident	81 Å²	81	69 Å²	69	31%	0.306	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-65.2	-30.5	-176.9	-75.4	-85.9	-168.2	129.4	11.9	114.3	E54 M459 K466	E54-R464 IonicContact OE1-CZ 3.68Å; E54-R464 IonicContact OE1-NH1 2.93Å; E54-R464 PolarHBondContact OE1-NH1 2.91Å; M459-R464 VanDerWaalsContact CE-NH2 3.29Å; M459-R464 PolarHBondContact SD-NE 3.02Å; M459-R464 PolarHBondContact SD-NH2 3.35Å; R464-K466 PolarHBondContact O-N 2.93Å
465	S	50.1	Low	70.2	Confident	98 Å²	98	70.2 Å²	70.2	69%	0.685	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-72.9	-1.2	-168.8	-49.2	0	0	0	0	115.1	F463	F463-S465 PolarHBondContact O-N 3.24Å
466	K	53.3	Low	70.1	Confident	184 Å²	184	70.2 Å²	70.2	80%	0.8	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-119.5	-0.3	-170.8	-64.8	-176.5	-178.7	176.3	0	115.3	R464	R464-K466 PolarHBondContact O-N 2.93Å
467	V	61.2	Low	70	Confident	33 Å²	33	72.1 Å²	72.1	20%	0.2	37%	0.369	C	S	.	.			trans	-105.3	133.2	-173.2	-171.2	0	0	0	0	110	Q471 E472 M475	V467-Q471 HydrophobicContact CG1-CB 3.7Å; V467-E472 HydrophobicContact CB-CG 4.37Å; V467-E472 HydrophobicContact CG1-CB 4.48Å; V467-E472 HydrophobicContact CG1-CG 3.71Å; V467-M475 HydrophobicContact CG1-CE 4.22Å; V467-M475 HydrophobicContact CG1-SD 4.26Å; V467-M475 HydrophobicContact CG2-CE 4.17Å; V467-M475 HydrophobicContact CG2-SD 3.88Å
468	T	65.8	Low	69.9	Low	78 Å²	78	74.1 Å²	74.1	48%	0.479	38%	0.38	S	S	.	.			trans	-86.2	152.7	174.4	59.6	0	0	0	0	110.9	Q470 Q471 E472	T468-Q470 PolarHBondContact O-N 3.03Å; T468-Q471 WeakPolarHBondContact O-CA 3.45Å; T468-Q471 WeakPolarHBondContact O-CB 3.39Å; T468-Q471 PolarHBondContact O-N 3.18Å; T468-Q471 WeakPolarHBondContact OG1-CG 3.31Å; T468-E472 WeakPolarHBondContact O-CG 3.2Å; T468-E472 PolarHBondContact O-N 3.16Å; T468-E472 VanDerWaalsContact O-N 3.11Å
469	E	64.8	Low	70.1	Confident	169 Å²	169	74.1 Å²	74.1	79%	0.79	38%	0.38	S	S	*	.	H	α-helix	trans	-48.5	-40	-178.1	-69.1	-179.9	173.7	0	0	113.8	Q471 E472	E469-Q471 VanDerWaalsContact C-N 3.32Å; E469-Q471 PolarHBondContact O-N 3.26Å; E469-E472 PolarHBondContact O-N 3.24Å
470	Q	63.6	Low	70.9	Confident	183 Å²	183	73.5 Å²	73.5	86%	0.855	38%	0.377	S	S	*	.	H	α-helix	trans	-68.8	-28.3	177.9	-71.7	175.7	-16.5	0	0	113.6	T468	T468-Q470 PolarHBondContact O-N 3.03Å
471	Q	74.3	Confident	72.1	Confident	113 Å²	113	72.1 Å²	72.1	53%	0.528	37%	0.372	S	S	.	.	H	α-helix	trans	-83.9	-21.5	177	-68.5	176.5	-3.8	0	0	112.2	V467 T468 E469 F473 S474 M475	V467-Q471 HydrophobicContact CG1-CB 3.7Å; T468-Q471 WeakPolarHBondContact O-CA 3.45Å; T468-Q471 WeakPolarHBondContact O-CB 3.39Å; T468-Q471 PolarHBondContact O-N 3.18Å; T468-Q471 WeakPolarHBondContact OG1-CG 3.31Å; E469-Q471 VanDerWaalsContact C-N 3.32Å; E469-Q471 PolarHBondContact O-N 3.26Å; Q471-F473 PolarHBondContact O-N 2.59Å; Q471-S474 PolarHBondContact O-N 2.86Å; Q471-M475 VanDerWaalsContact O-CB 3.25Å; Q471-M475 WeakPolarHBondContact O-CB 3.45Å; Q471-M475 PolarHBondContact O-N 2.7Å
472	E	78.4	Confident	74	Confident	58 Å²	58	64.7 Å²	64.7	27%	0.271	34%	0.339	S	S	.	.	H	α-helix	trans	-63.5	-43.2	-178.1	-65.7	-175.8	154.1	0	0	112.2	W47 V467 T468 E469 M475 A476	W47-E472 HydrophobicContact CH2-CB 3.91Å; V467-E472 HydrophobicContact CB-CG 4.37Å; V467-E472 HydrophobicContact CG1-CB 4.48Å; V467-E472 HydrophobicContact CG1-CG 3.71Å; T468-E472 WeakPolarHBondContact O-CG 3.2Å; T468-E472 PolarHBondContact O-N 3.16Å; T468-E472 VanDerWaalsContact O-N 3.11Å; E469-E472 PolarHBondContact O-N 3.24Å; E472-M475 PolarHBondContact O-N 3.44Å; E472-A476 WeakPolarHBondContact O-CB 3.29Å; E472-A476 PolarHBondContact O-N 3.37Å
473	F	81.2	Confident	76	Confident	81 Å²	81	62.2 Å²	62.2	36%	0.355	31%	0.314	S	S	.	.	H	α-helix	trans	-63.6	-48.4	178.7	-174.1	-95.5	0	0	0	112.1	E40 M43 W47 Q471 M475 A476 T477	E40-F473 WeakPolarHBondContact OE2-CZ 3.39Å; M43-F473 HydrophobicContact CB-CE2 4.26Å; M43-F473 HydrophobicContact CG-CE2 4.01Å; M43-F473 HydrophobicContact CG-CZ 4.34Å; W47-F473 HydrophobicContact CZ2-CD2 4.2Å; Q471-F473 PolarHBondContact O-N 2.59Å; F473-M475 VanDerWaalsContact C-N 3.27Å; F473-M475 PolarHBondContact O-N 3.14Å; F473-A476 WeakPolarHBondContact O-CB 3.29Å; F473-A476 PolarHBondContact O-N 3.49Å; F473-A476 VanDerWaalsContact O-N 3.17Å; F473-T477 PolarHBondContact O-N 3Å; F473-T477 PolarHBondContact O-OG1 3.22Å
474	S	82.2	Confident	77.9	Confident	63 Å²	63	61.4 Å²	61.4	44%	0.441	31%	0.31	S	S	.	.	H	α-helix	trans	-60	-40.9	176.7	-178.2	0	0	0	0	111.3	Q471 T477 N478	Q471-S474 PolarHBondContact O-N 2.86Å; S474-T477 PolarHBondContact O-N 2.64Å; S474-N478 WeakPolarHBondContact O-CB 3.3Å; S474-N478 PolarHBondContact O-N 3.32Å; S474-N478 PolarHBondContact O-ND2 3.4Å; S474-N478 PolarHBondContact OG-ND2 3.16Å
475	M	84.1	Confident	79.9	Confident	26 Å²	26	57.6 Å²	57.6	13%	0.128	30%	0.296	C	S	.	.	H	α-helix	trans	-64.1	-41.1	176.4	-174	178.9	72.9	0	0	112.3	F463 V467 Q471 E472 F473 N478 T479	F463-M475 HydrophobicContact CE1-CE 4.35Å; F463-M475 HydrophobicContact CE1-SD 3.52Å; F463-M475 VanDerWaalsContact CE1-SD 3.52Å; F463-M475 HydrophobicContact CZ-SD 4.09Å; V467-M475 HydrophobicContact CG1-CE 4.22Å; V467-M475 HydrophobicContact CG1-SD 4.26Å; V467-M475 HydrophobicContact CG2-CE 4.17Å; V467-M475 HydrophobicContact CG2-SD 3.88Å; Q471-M475 VanDerWaalsContact O-CB 3.25Å; Q471-M475 WeakPolarHBondContact O-CB 3.45Å; Q471-M475 PolarHBondContact O-N 2.7Å; E472-M475 PolarHBondContact O-N 3.44Å; F473-M475 VanDerWaalsContact C-N 3.27Å; F473-M475 PolarHBondContact O-N 3.14Å; M475-N478 PolarHBondContact O-N 3.39Å; M475-T479 HydrophobicContact CG-CG2 4.31Å; M475-T479 WeakPolarHBondContact O-CB 3.41Å; M475-T479 VanDerWaalsContact O-CG2 3.31Å; M475-T479 WeakPolarHBondContact O-CG2 3.24Å; M475-T479 PolarHBondContact O-N 3.23Å; M475-T479 PolarHBondContact O-OG1 2.91Å
476	A	87.6	Confident	82.1	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.3	-50.8	177	0	0	0	0	0	111	M43 Y46 W47 E472 F473 N478 T479 A480	M43-A476 VanDerWaalsContact CE-C 3.5Å; M43-A476 HydrophobicContact CE-CB 3.48Å; M43-A476 VanDerWaalsContact CE-CB 3.48Å; Y46-A476 HydrophobicContact CD1-CB 3.76Å; Y46-A476 HydrophobicContact CD2-CB 4.15Å; Y46-A476 HydrophobicContact CE1-CB 3.39Å; Y46-A476 HydrophobicContact CE2-CB 3.81Å; Y46-A476 HydrophobicContact CG-CB 4.14Å; Y46-A476 VanDerWaalsContact CZ-CB 3.43Å; W47-A476 HydrophobicContact CZ2-CB 4.41Å; E472-A476 WeakPolarHBondContact O-CB 3.29Å; E472-A476 PolarHBondContact O-N 3.37Å; F473-A476 WeakPolarHBondContact O-CB 3.29Å; F473-A476 PolarHBondContact O-N 3.49Å; F473-A476 VanDerWaalsContact O-N 3.17Å; A476-N478 PolarHBondContact O-N 3.26Å; A476-T479 PolarHBondContact O-N 3.29Å; A476-T479 PolarHBondContact O-OG1 3.47Å; A476-T479 VanDerWaalsContact O-OG1 3.07Å; A476-A480 VanDerWaalsContact O-CB 3.3Å; A476-A480 WeakPolarHBondContact O-CB 3.4Å; A476-A480 PolarHBondContact O-N 3.19Å
477	T	88.6	Confident	84.1	Confident	41 Å²	41	44.3 Å²	44.3	25%	0.252	23%	0.225	S	C	.	.	H	α-helix	trans	-61.5	-43.9	176.8	-55.9	0	0	0	0	111.7	L41 F473 S474 N481	L41-T477 HydrophobicContact CD1-CG2 4.31Å; F473-T477 PolarHBondContact O-N 3Å; F473-T477 PolarHBondContact O-OG1 3.22Å; S474-T477 PolarHBondContact O-N 2.64Å; T477-N481 WeakPolarHBondContact O-CB 3.11Å; T477-N481 PolarHBondContact O-N 3.06Å
478	N	89.2	Confident	85.6	Confident	49 Å²	49	47.7 Å²	47.7	26%	0.262	24%	0.235	S	C	.	.	H	α-helix	trans	-61.9	-47.6	179.1	-76.3	-26.8	0	0	0	111.9	N398 S474 M475 A476 N481 I482	N398-N478 WeakPolarHBondContact ND2-CB 3.47Å; N398-N478 PolarHBondContact ND2-O 3.16Å; S474-N478 WeakPolarHBondContact O-CB 3.3Å; S474-N478 PolarHBondContact O-N 3.32Å; S474-N478 PolarHBondContact O-ND2 3.4Å; S474-N478 PolarHBondContact OG-ND2 3.16Å; M475-N478 PolarHBondContact O-N 3.39Å; A476-N478 PolarHBondContact O-N 3.26Å; N478-N481 PolarHBondContact O-N 3.04Å; N478-I482 WeakPolarHBondContact O-CG1 3.38Å; N478-I482 PolarHBondContact O-N 2.92Å; N478-I482 VanDerWaalsContact O-N 3.08Å
479	T	92.1	Very high	87	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-69	-40.1	-179.2	52.5	0	0	0	0	111.8	I395 F458 M475 A476 N481 I482 V483	I395-T479 HydrophobicContact CG1-CG2 4.47Å; F458-T479 HydrophobicContact CB-CG2 3.86Å; F458-T479 HydrophobicContact CD1-CG2 3.62Å; F458-T479 HydrophobicContact CD2-CG2 3.99Å; F458-T479 HydrophobicContact CE1-CG2 4.15Å; F458-T479 HydrophobicContact CE2-CG2 4.48Å; F458-T479 HydrophobicContact CG-CG2 3.54Å; M475-T479 HydrophobicContact CG-CG2 4.31Å; M475-T479 WeakPolarHBondContact O-CB 3.41Å; M475-T479 VanDerWaalsContact O-CG2 3.31Å; M475-T479 WeakPolarHBondContact O-CG2 3.24Å; M475-T479 PolarHBondContact O-N 3.23Å; M475-T479 PolarHBondContact O-OG1 2.91Å; A476-T479 PolarHBondContact O-N 3.29Å; A476-T479 PolarHBondContact O-OG1 3.47Å; A476-T479 VanDerWaalsContact O-OG1 3.07Å; T479-N481 VanDerWaalsContact C-N 3.33Å; T479-N481 PolarHBondContact O-N 3.19Å; T479-I482 PolarHBondContact O-N 3.37Å; T479-V483 PolarHBondContact O-N 3.28Å; T479-V483 VanDerWaalsContact O-N 3.08Å
480	A	92.4	Very high	88.3	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-59	-43.2	171.8	0	0	0	0	0	112	L41 M43 V451 A454 A476 I482 V483 R484	L41-A480 HydrophobicContact CD1-CB 4.49Å; M43-A480 HydrophobicContact CE-CB 4.42Å; V451-A480 HydrophobicContact CG2-CB 4.21Å; A454-A480 HydrophobicContact CB-CB 4.22Å; A476-A480 VanDerWaalsContact O-CB 3.3Å; A476-A480 WeakPolarHBondContact O-CB 3.4Å; A476-A480 PolarHBondContact O-N 3.19Å; A480-I482 PolarHBondContact O-N 3.28Å; A480-V483 PolarHBondContact O-N 3.05Å; A480-R484 WeakPolarHBondContact O-CB 3.39Å; A480-R484 PolarHBondContact O-N 3.46Å
481	N	92.1	Very high	89.5	Confident	13 Å²	13	33.8 Å²	33.8	7%	0.07	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-40	175.8	-175.5	58.5	0	0	0	112.3	N398 T477 N478 T479 R484 L485	N398-N481 PolarHBondContact OD1-ND2 3.22Å; T477-N481 WeakPolarHBondContact O-CB 3.11Å; T477-N481 PolarHBondContact O-N 3.06Å; N478-N481 PolarHBondContact O-N 3.04Å; T479-N481 VanDerWaalsContact C-N 3.33Å; T479-N481 PolarHBondContact O-N 3.19Å; N481-R484 WeakPolarHBondContact O-CB 3.39Å; N481-R484 PolarHBondContact O-N 2.88Å; N481-R484 PolarHBondContact OD1-NE 3.47Å; N481-R484 PolarHBondContact OD1-NH2 3.33Å; N481-L485 VanDerWaalsContact O-CG 3.31Å; N481-L485 WeakPolarHBondContact O-CG 3.3Å; N481-L485 PolarHBondContact O-N 3.48Å
482	I	94.3	Very high	90.4	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.1	-47.2	175.9	-62.6	-58.3	0	0	0	111.3	F394 V397 N398 L410 F458 N478 T479 A480 R484 L485 L486	F394-I482 HydrophobicContact CD1-CG2 4.24Å; F394-I482 WeakPolarHBondContact O-CD1 3.32Å; V397-I482 HydrophobicContact CB-CD1 3.71Å; V397-I482 HydrophobicContact CG1-CD1 3.74Å; N398-I482 WeakPolarHBondContact ND2-CD1 3.49Å; N398-I482 WeakPolarHBondContact ND2-CG1 3.46Å; L410-I482 HydrophobicContact CD2-CD1 4.42Å; L410-I482 HydrophobicContact CD2-CG2 3.93Å; F458-I482 HydrophobicContact CE2-CB 4.45Å; F458-I482 HydrophobicContact CE2-CG2 4.41Å; F458-I482 HydrophobicContact CZ-CB 3.97Å; F458-I482 HydrophobicContact CZ-CG2 3.74Å; N478-I482 WeakPolarHBondContact O-CG1 3.38Å; N478-I482 PolarHBondContact O-N 2.92Å; N478-I482 VanDerWaalsContact O-N 3.08Å; T479-I482 PolarHBondContact O-N 3.37Å; A480-I482 PolarHBondContact O-N 3.28Å; I482-R484 VanDerWaalsContact C-N 3.26Å; I482-R484 PolarHBondContact O-N 2.87Å; I482-L485 PolarHBondContact O-N 2.88Å; I482-L486 HydrophobicContact CG2-CD1 4.04Å; I482-L486 HydrophobicContact CG2-CG 4.22Å; I482-L486 WeakPolarHBondContact O-CG 3.44Å; I482-L486 PolarHBondContact O-N 3.36Å
483	V	95.4	Very high	91.2	Very high	1 Å²	1	27 Å²	27	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-58.7	-41.5	176.2	179.3	0	0	0	0	110.9	A454 I457 F458 T479 A480 L485 L486 I487	A454-V483 HydrophobicContact CB-CG2 4.02Å; I457-V483 HydrophobicContact CD1-CG1 4.38Å; I457-V483 HydrophobicContact CD1-CG2 3.98Å; F458-V483 HydrophobicContact CD2-CG2 4.34Å; F458-V483 HydrophobicContact CE2-CG2 3.81Å; T479-V483 PolarHBondContact O-N 3.28Å; T479-V483 VanDerWaalsContact O-N 3.08Å; A480-V483 PolarHBondContact O-N 3.05Å; V483-L485 PolarHBondContact O-N 3.46Å; V483-L486 PolarHBondContact O-N 3.16Å; V483-I487 HydrophobicContact CG1-CD1 3.82Å; V483-I487 HydrophobicContact CG1-CG1 4.37Å; V483-I487 WeakPolarHBondContact O-CG1 3.26Å; V483-I487 PolarHBondContact O-N 3.29Å
484	R	94	Very high	91.8	Very high	15 Å²	15	23.7 Å²	23.7	6%	0.057	12%	0.122	C	C	.	.	H	α-helix	trans	-57.8	-46	176.2	-170.5	174.7	65.2	150.8	-3.7	112.1	D230 L233 L446 S450 A480 N481 I482 R488	D230-R484 PolarHBondContact O-NH1 3.29Å; D230-R484 IonicContact OD2-CZ 3.6Å; D230-R484 IonicContact OD2-NH1 3.86Å; D230-R484 IonicContact OD2-NH2 3.5Å; D230-R484 PolarHBondContact OD2-NH2 2.98Å; L233-R484 HydrophobicContact CD1-CG 3.99Å; L446-R484 HydrophobicContact CD1-CG 4.37Å; L446-R484 HydrophobicContact CD2-CG 3.99Å; L446-R484 HydrophobicContact CG-CG 3.97Å; S450-R484 WeakPolarHBondContact OG-CA 3.28Å; S450-R484 WeakPolarHBondContact OG-CB 3.44Å; S450-R484 PolarHBondContact OG-N 3.27Å; A480-R484 WeakPolarHBondContact O-CB 3.39Å; A480-R484 PolarHBondContact O-N 3.46Å; N481-R484 WeakPolarHBondContact O-CB 3.39Å; N481-R484 PolarHBondContact O-N 2.88Å; N481-R484 PolarHBondContact OD1-NE 3.47Å; N481-R484 PolarHBondContact OD1-NH2 3.33Å; I482-R484 VanDerWaalsContact C-N 3.26Å; I482-R484 PolarHBondContact O-N 2.87Å; R484-R488 VanDerWaalsContact O-CB 3.3Å; R484-R488 WeakPolarHBondContact O-CB 3.38Å; R484-R488 PolarHBondContact O-N 3.26Å
485	L	94.1	Very high	92.4	Very high	2 Å²	2	21 Å²	21	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-66.8	-41.1	177	-64.2	174.9	0	0	0	112	L233 Q406 L410 N481 I482 V483 I487 R488 Y489	L233-L485 HydrophobicContact CD1-CD2 4.38Å; L233-L485 HydrophobicContact CD2-CD2 3.94Å; Q406-L485 HydrophobicContact CB-CD1 4.34Å; L410-L485 HydrophobicContact CD1-CB 3.61Å; L410-L485 HydrophobicContact CD1-CD1 3.9Å; L410-L485 HydrophobicContact CD1-CG 4.42Å; N481-L485 VanDerWaalsContact O-CG 3.31Å; N481-L485 WeakPolarHBondContact O-CG 3.3Å; N481-L485 PolarHBondContact O-N 3.48Å; I482-L485 PolarHBondContact O-N 2.88Å; V483-L485 PolarHBondContact O-N 3.46Å; L485-I487 PolarHBondContact O-N 3.27Å; L485-R488 PolarHBondContact O-N 2.74Å; L485-Y489 HydrophobicContact CB-CD2 4.38Å; L485-Y489 HydrophobicContact CD2-CD2 4.19Å; L485-Y489 HydrophobicContact CD2-CE2 3.64Å; L485-Y489 WeakPolarHBondContact O-CD2 3.43Å; L485-Y489 PolarHBondContact O-N 3.35Å
486	L	96.3	Very high	92.9	Very high	2 Å²	2	20 Å²	20	1%	0.01	10%	0.098	C	C	.	.	H	α-helix	trans	-59.3	-45.4	177.4	-72.1	175	0	0	0	111.7	L410 V414 V429 I482 V483 Q490 L493	L410-L486 HydrophobicContact CD2-CD2 4.15Å; V414-L486 HydrophobicContact CG2-CD2 4.29Å; V429-L486 HydrophobicContact CG1-CB 4.27Å; I482-L486 HydrophobicContact CG2-CD1 4.04Å; I482-L486 HydrophobicContact CG2-CG 4.22Å; I482-L486 WeakPolarHBondContact O-CG 3.44Å; I482-L486 PolarHBondContact O-N 3.36Å; V483-L486 PolarHBondContact O-N 3.16Å; L486-Q490 WeakPolarHBondContact O-CB 3.36Å; L486-Q490 PolarHBondContact O-N 3.29Å; L486-L493 HydrophobicContact CB-CD1 4.49Å; L486-L493 HydrophobicContact CD2-CD1 3.66Å
487	I	95	Very high	93.3	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-67	-49.6	177.7	-63.1	165.9	0	0	0	110.4	F432 I436 L446 V449 V483 L485 Y489 Q490	F432-I487 HydrophobicContact CB-CD1 3.9Å; F432-I487 HydrophobicContact CB-CG1 4.03Å; F432-I487 HydrophobicContact CB-CG2 4.46Å; F432-I487 HydrophobicContact CD2-CD1 3.66Å; F432-I487 HydrophobicContact CD2-CG1 3.79Å; F432-I487 HydrophobicContact CG-CD1 4.15Å; F432-I487 HydrophobicContact CG-CG1 4.42Å; I436-I487 HydrophobicContact CD1-CD1 4.47Å; I436-I487 HydrophobicContact CD1-CG2 3.63Å; L446-I487 HydrophobicContact CD1-CB 3.73Å; L446-I487 HydrophobicContact CD1-CD1 4.12Å; L446-I487 HydrophobicContact CD1-CG2 3.53Å; V449-I487 HydrophobicContact CG1-CD1 4.09Å; V483-I487 HydrophobicContact CG1-CD1 3.82Å; V483-I487 HydrophobicContact CG1-CG1 4.37Å; V483-I487 WeakPolarHBondContact O-CG1 3.26Å; V483-I487 PolarHBondContact O-N 3.29Å; L485-I487 PolarHBondContact O-N 3.27Å; I487-Y489 VanDerWaalsContact C-N 3.34Å; I487-Y489 PolarHBondContact O-N 3.44Å; I487-Q490 PolarHBondContact O-NE2 3.14Å
488	R	93	Very high	93.6	Very high	105 Å²	105	20.5 Å²	20.5	40%	0.396	10%	0.097	S	C	.	.	H	α-helix	trans	-61.9	-39.7	-173.7	179.9	59.8	-178.8	152.1	-6.7	112.9	L233 N235 L446 R484 L485	L233-R488 HydrophobicContact CB-CG 4.44Å; L233-R488 HydrophobicContact CD1-CB 4.11Å; L233-R488 HydrophobicContact CD1-CG 3.97Å; N235-R488 PolarHBondContact OD1-NH2 3Å; L446-R488 HydrophobicContact CD2-CB 4.39Å; R484-R488 VanDerWaalsContact O-CB 3.3Å; R484-R488 WeakPolarHBondContact O-CB 3.38Å; R484-R488 PolarHBondContact O-N 3.26Å; L485-R488 PolarHBondContact O-N 2.74Å
489	Y	93.9	Very high	93.9	Very high	9 Å²	9	18.7 Å²	18.7	4%	0.035	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	18.4	-171.7	-55.3	-66.2	0	0	0	114.1	P234 F236 L407 L485 I487 N491 L492 L493	P234-Y489 VanDerWaalsContact O-CE1 3.31Å; P234-Y489 WeakPolarHBondContact O-CE1 3.3Å; P234-Y489 PolarHBondContact O-OH 2.82Å; F236-Y489 HydrophobicContact CB-CE1 4.38Å; F236-Y489 HydrophobicContact CD2-CD1 4.26Å; F236-Y489 AromaticContact CD2-CE1 3.58Å; F236-Y489 HydrophobicContact CD2-CE1 3.58Å; F236-Y489 HydrophobicContact CD2-CE2 4.48Å; F236-Y489 AromaticContact CD2-CZ 3.69Å; F236-Y489 HydrophobicContact CE2-CE1 4.41Å; F236-Y489 HydrophobicContact CG-CE1 4.45Å; L407-Y489 VanDerWaalsContact CD1-CB 3.45Å; L407-Y489 HydrophobicContact CD1-CD2 3.88Å; L407-Y489 HydrophobicContact CD1-CG 3.77Å; L407-Y489 HydrophobicContact CD2-CD1 4.06Å; L407-Y489 HydrophobicContact CD2-CD2 4.26Å; L407-Y489 HydrophobicContact CD2-CE1 4.46Å; L407-Y489 HydrophobicContact CD2-CG 3.94Å; L485-Y489 HydrophobicContact CB-CD2 4.38Å; L485-Y489 HydrophobicContact CD2-CD2 4.19Å; L485-Y489 HydrophobicContact CD2-CE2 3.64Å; L485-Y489 WeakPolarHBondContact O-CD2 3.43Å; L485-Y489 PolarHBondContact O-N 3.35Å; I487-Y489 VanDerWaalsContact C-N 3.34Å; I487-Y489 PolarHBondContact O-N 3.44Å; Y489-N491 PolarHBondContact O-N 2.92Å; Y489-L492 HydrophobicContact CD1-CD1 4.22Å; Y489-L492 PolarHBondContact O-N 3.43Å; Y489-L493 WeakPolarHBondContact O-CG 3.36Å; Y489-L493 PolarHBondContact O-N 2.98Å
490	Q	92.6	Very high	94.1	Very high	18 Å²	18	18.6 Å²	18.6	8%	0.084	9%	0.086	C	C	.	.	H	α-helix	trans	-48.4	-37.1	-177.8	66	-173	-83.6	0	0	114.4	V429 E430 Q433 L486 I487 L492 L493 W494	V429-Q490 HydrophobicContact CG2-CB 3.87Å; V429-Q490 PolarHBondContact O-NE2 3.47Å; E430-Q490 VanDerWaalsContact CA-OE1 3.3Å; Q433-Q490 VanDerWaalsContact CB-NE2 3.31Å; L486-Q490 WeakPolarHBondContact O-CB 3.36Å; L486-Q490 PolarHBondContact O-N 3.29Å; I487-Q490 PolarHBondContact O-NE2 3.14Å; Q490-L492 PolarHBondContact O-N 2.93Å; Q490-L493 PolarHBondContact O-N 3.11Å; Q490-W494 HydrophobicContact CB-CZ3 4.37Å; Q490-W494 VanDerWaalsContact O-CE3 3.32Å
491	N	89.1	Confident	94.3	Very high	111 Å²	111	18.8 Å²	18.8	59%	0.594	9%	0.087	S	C	*	.	H	α-helix	trans	-66.8	-21.6	179.9	-67.8	-31.3	0	0	0	114	Y489 T495	Y489-N491 PolarHBondContact O-N 2.92Å; N491-T495 PolarHBondContact O-OG1 2.98Å
492	L	92.5	Very high	94.4	Very high	29 Å²	29	20.8 Å²	20.8	15%	0.152	10%	0.1	C	C	.	.	H	α-helix	trans	-96.4	-28.9	179.6	-58	173.2	0	0	0	111.6	L199 F236 L238 L407 N411 Y489 Q490 W494 T495	L199-L492 HydrophobicContact CD1-CD1 3.85Å; F236-L492 HydrophobicContact CB-CD1 3.88Å; L238-L492 HydrophobicContact CB-CD2 4.32Å; L238-L492 HydrophobicContact CD1-CD2 4.45Å; L407-L492 HydrophobicContact CD2-CD1 4.04Å; N411-L492 PolarHBondContact ND2-O 3.41Å; N411-L492 VanDerWaalsContact ND2-O 3.11Å; Y489-L492 HydrophobicContact CD1-CD1 4.22Å; Y489-L492 PolarHBondContact O-N 3.43Å; Q490-L492 PolarHBondContact O-N 2.93Å; L492-W494 PolarHBondContact O-N 3.11Å; L492-T495 PolarHBondContact O-N 3.46Å
493	L	94.9	Very high	94.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-70.7	-28.5	-172.1	-69.8	174.2	0	0	0	113.8	L407 L410 N411 V414 L486 Y489 Q490 T495	L407-L493 HydrophobicContact CD1-CD2 3.62Å; L407-L493 HydrophobicContact CD1-CG 4.22Å; L410-L493 HydrophobicContact CB-CD2 3.52Å; N411-L493 HydrophobicContact CB-CD2 4.13Å; N411-L493 VanDerWaalsContact N-CD2 3.34Å; N411-L493 PolarHBondContact ND2-O 3.25Å; V414-L493 HydrophobicContact CG2-CB 4.35Å; L486-L493 HydrophobicContact CB-CD1 4.49Å; L486-L493 HydrophobicContact CD2-CD1 3.66Å; Y489-L493 WeakPolarHBondContact O-CG 3.36Å; Y489-L493 PolarHBondContact O-N 2.98Å; Q490-L493 PolarHBondContact O-N 3.11Å; L493-T495 VanDerWaalsContact C-N 3.35Å
494	W	94.4	Very high	94.6	Very high	10 Å²	10	21.2 Å²	21.2	4%	0.038	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	13.9	177.2	-82.2	-104.1	0	0	0	113.7	R247 V248 V414 R422 L425 K426 V429 Q490 L492	R247-W494 WeakPolarHBondContact CA-O 3.33Å; V248-W494 PolarHBondContact N-O 3.26Å; V414-W494 HydrophobicContact CG1-CD2 3.64Å; V414-W494 VanDerWaalsContact CG1-CE2 3.47Å; V414-W494 HydrophobicContact CG1-CE3 4.01Å; V414-W494 HydrophobicContact CG1-CG 4.13Å; V414-W494 HydrophobicContact CG1-CH2 4.08Å; V414-W494 HydrophobicContact CG1-CZ2 3.71Å; V414-W494 HydrophobicContact CG1-CZ3 4.22Å; V414-W494 HydrophobicContact CG2-CH2 4.32Å; V414-W494 HydrophobicContact CG2-CZ3 4.48Å; R422-W494 HydrophobicContact CG-CZ2 4.49Å; R422-W494 VanDerWaalsContact CG-NE1 3.28Å; R422-W494 WeakPolarHBondContact O-CZ2 3.38Å; R422-W494 PolarHBondContact O-NE1 3Å; L425-W494 HydrophobicContact CB-CZ2 4.31Å; L425-W494 HydrophobicContact CD2-CH2 4.12Å; L425-W494 HydrophobicContact CD2-CZ2 4.23Å; L425-W494 HydrophobicContact CG-CH2 4.03Å; L425-W494 HydrophobicContact CG-CZ2 4.14Å; K426-W494 VanDerWaalsContact CA-CZ2 3.48Å; K426-W494 HydrophobicContact CB-CD2 4.4Å; K426-W494 HydrophobicContact CB-CH2 4.38Å; K426-W494 HydrophobicContact CB-CZ2 3.59Å; K426-W494 HydrophobicContact CD-CD2 4.41Å; K426-W494 HydrophobicContact CD-CG 4.22Å; K426-W494 HydrophobicContact CG-CD2 4.16Å; K426-W494 HydrophobicContact CG-CG 4.48Å; K426-W494 HydrophobicContact CG-CZ2 4.18Å; V429-W494 HydrophobicContact CG2-CH2 3.93Å; V429-W494 HydrophobicContact CG2-CZ3 4.11Å; Q490-W494 HydrophobicContact CB-CZ3 4.37Å; Q490-W494 VanDerWaalsContact O-CE3 3.32Å; L492-W494 PolarHBondContact O-N 3.11Å
495	T	94.3	Very high	94.7	Very high	6 Å²	6	20.9 Å²	20.9	4%	0.037	10%	0.1	C	C	.	.	B	Isolated β-bridge	trans	-96	134.3	177.3	-57.1	0	0	0	0	109.9	L238 T246 N411 N491 L492 L493 P497	L238-T495 HydrophobicContact CD2-CG2 4.29Å; T246-T495 WeakPolarHBondContact O-CG2 3.4Å; N411-T495 PolarHBondContact ND2-O 3.34Å; N491-T495 PolarHBondContact O-OG1 2.98Å; L492-T495 PolarHBondContact O-N 3.46Å; L493-T495 VanDerWaalsContact C-N 3.35Å; T495-P497 WeakPolarHBondContact O-CD 3.33Å
496	I	95.8	Very high	94.7	Very high	5 Å²	5	24.6 Å²	24.6	3%	0.026	12%	0.118	C	C	.	.	P	Polyproline II helix	trans	-79.7	120.3	175	-57.6	177.8	0	0	0	107.9	T246 L251 M256 V259 L415 I500	T246-I496 HydrophobicContact CG2-CD1 4.1Å; T246-I496 PolarHBondContact O-N 3.03Å; L251-I496 HydrophobicContact CD1-CD1 3.45Å; L251-I496 VanDerWaalsContact CD1-CD1 3.45Å; L251-I496 HydrophobicContact CG-CD1 4.05Å; M256-I496 HydrophobicContact SD-CD1 3.71Å; V259-I496 HydrophobicContact CG1-CD1 4.48Å; V259-I496 HydrophobicContact CG1-CG2 4.21Å; V259-I496 HydrophobicContact CG2-CD1 4.42Å; V259-I496 HydrophobicContact CG2-CG2 4.36Å; L415-I496 HydrophobicContact CD2-CG1 4.25Å; I496-I500 HydrophobicContact CG2-CB 4.3Å; I496-I500 HydrophobicContact CG2-CG2 4.2Å
497	P	95.5	Very high	94.5	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.019	12%	0.117	C	C	.	.	P	Polyproline II helix	trans	-58.1	140.6	177.7	-25.5	34.9	0	0	0	112.2	V201 F205 N411 T495 F499 I500 L501	V201-P497 HydrophobicContact CB-CB 4.32Å; F205-P497 HydrophobicContact CE2-CB 4.5Å; F205-P497 HydrophobicContact CE2-CG 3.82Å; F205-P497 HydrophobicContact CZ-CB 4Å; F205-P497 HydrophobicContact CZ-CG 3.69Å; N411-P497 VanDerWaalsContact OD1-CG 3.29Å; N411-P497 WeakPolarHBondContact OD1-CG 3.19Å; T495-P497 WeakPolarHBondContact O-CD 3.33Å; P497-F499 VanDerWaalsContact C-N 3.28Å; P497-F499 HydrophobicContact CB-CD1 3.56Å; P497-F499 HydrophobicContact CB-CE1 3.32Å; P497-F499 HydrophobicContact CB-CZ 4.17Å; P497-F499 HydrophobicContact CG-CE1 4.02Å; P497-F499 PolarHBondContact O-N 2.89Å; P497-I500 HydrophobicContact CB-CG1 4.14Å; P497-I500 HydrophobicContact CG-CG1 4.33Å; P497-I500 WeakPolarHBondContact O-CB 3.19Å; P497-I500 PolarHBondContact O-N 3.12Å; P497-L501 PolarHBondContact O-N 3.04Å; P497-L501 VanDerWaalsContact O-N 3.12Å
498	K	93.8	Very high	94.4	Very high	49 Å²	49	24.6 Å²	24.6	21%	0.213	12%	0.118	C	C	.	.	H	α-helix	trans	-60.6	-35.3	-176.4	-179	175.6	168.5	-169.9	0	112.6	V201 E202 D241 I500 L501 T502	V201-K498 HydrophobicContact CG2-CB 4.29Å; V201-K498 WeakPolarHBondContact O-CA 3.48Å; V201-K498 WeakPolarHBondContact O-CB 3.33Å; V201-K498 PolarHBondContact O-N 2.92Å; E202-K498 HydrophobicContact CG-CD 4.15Å; E202-K498 IonicContact OE1-NZ 3.95Å; E202-K498 PolarHBondContact OE1-NZ 2.58Å; D241-K498 HydrophobicContact CB-CD 4.14Å; D241-K498 IonicContact OD1-NZ 2.83Å; D241-K498 PolarHBondContact OD1-NZ 3.02Å; D241-K498 VanDerWaalsContact OD2-CD 3.31Å; D241-K498 WeakPolarHBondContact OD2-CD 3.35Å; D241-K498 WeakPolarHBondContact OD2-CE 3.19Å; D241-K498 IonicContact OD2-NZ 3.64Å; D241-K498 PolarHBondContact OD2-NZ 2.76Å; K498-I500 VanDerWaalsContact C-N 3.32Å; K498-I500 PolarHBondContact O-N 2.78Å; K498-L501 PolarHBondContact O-N 3.08Å; K498-T502 WeakPolarHBondContact O-CB 3.25Å; K498-T502 PolarHBondContact O-N 2.98Å; K498-T502 PolarHBondContact O-OG1 3.37Å
499	F	95.8	Very high	94.4	Very high	11 Å²	11	22.5 Å²	22.5	5%	0.048	11%	0.113	C	C	.	.	H	α-helix	trans	-62	-39.9	175.5	76.5	-92.3	0	0	0	112.1	V201 E202 A204 F205 E266 P497 T502 Q503	V201-F499 WeakPolarHBondContact O-CD1 3.33Å; V201-F499 PolarHBondContact O-N 3.42Å; E202-F499 VanDerWaalsContact O-CB 3.31Å; E202-F499 WeakPolarHBondContact O-CB 3.37Å; A204-F499 HydrophobicContact CB-CD2 3.91Å; A204-F499 HydrophobicContact CB-CE2 3.85Å; A204-F499 HydrophobicContact CB-CG 4.44Å; A204-F499 HydrophobicContact CB-CZ 4.36Å; F205-F499 AromaticContact CD1-CE1 3.83Å; F205-F499 HydrophobicContact CD1-CE1 3.83Å; F205-F499 HydrophobicContact CD1-CZ 4.48Å; F205-F499 HydrophobicContact CD2-CE1 4.3Å; F205-F499 HydrophobicContact CD2-CZ 4.4Å; F205-F499 AromaticContact CE1-CE1 3.82Å; F205-F499 HydrophobicContact CE1-CE1 3.82Å; F205-F499 HydrophobicContact CE2-CE1 4.28Å; F205-F499 HydrophobicContact CG-CE1 4.1Å; F205-F499 HydrophobicContact CG-CZ 4.32Å; F205-F499 HydrophobicContact CZ-CE1 4.05Å; E266-F499 HydrophobicContact CG-CE2 4Å; E266-F499 HydrophobicContact CG-CZ 3.81Å; P497-F499 VanDerWaalsContact C-N 3.28Å; P497-F499 HydrophobicContact CB-CD1 3.56Å; P497-F499 HydrophobicContact CB-CE1 3.32Å; P497-F499 HydrophobicContact CB-CZ 4.17Å; P497-F499 HydrophobicContact CG-CE1 4.02Å; P497-F499 PolarHBondContact O-N 2.89Å; F499-T502 WeakPolarHBondContact O-CB 3.13Å; F499-T502 PolarHBondContact O-N 3.03Å; F499-Q503 WeakPolarHBondContact O-CG 3.49Å; F499-Q503 PolarHBondContact O-N 3.24Å
500	I	97	Very high	94.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.3	-47.2	175.6	-60.7	-69.9	0	0	0	110	V259 L262 V263 E266 I496 P497 K498 T502 Q503 V504	V259-I500 HydrophobicContact CB-CG2 4.34Å; V259-I500 HydrophobicContact CG1-CG2 4.01Å; V259-I500 HydrophobicContact CG2-CG2 4.22Å; L262-I500 HydrophobicContact CB-CD1 3.91Å; L262-I500 HydrophobicContact CB-CG2 4.15Å; L262-I500 HydrophobicContact CD1-CG2 4.14Å; V263-I500 HydrophobicContact CG2-CD1 4.3Å; V263-I500 HydrophobicContact CG2-CG1 4.41Å; V263-I500 HydrophobicContact CG2-CG2 4.34Å; E266-I500 HydrophobicContact CB-CD1 4.41Å; I496-I500 HydrophobicContact CG2-CB 4.3Å; I496-I500 HydrophobicContact CG2-CG2 4.2Å; P497-I500 HydrophobicContact CB-CG1 4.14Å; P497-I500 HydrophobicContact CG-CG1 4.33Å; P497-I500 WeakPolarHBondContact O-CB 3.19Å; P497-I500 PolarHBondContact O-N 3.12Å; K498-I500 VanDerWaalsContact C-N 3.32Å; K498-I500 PolarHBondContact O-N 2.78Å; I500-T502 PolarHBondContact O-N 3.49Å; I500-Q503 PolarHBondContact O-N 3.28Å; I500-V504 WeakPolarHBondContact O-CG2 3.39Å; I500-V504 PolarHBondContact O-N 3.31Å
501	L	95.8	Very high	93.7	Very high	6 Å²	6	26 Å²	26	3%	0.031	13%	0.133	C	C	.	.	H	α-helix	trans	-58.9	-38.8	176.4	-176.8	65.3	0	0	0	111.8	T246 L251 P497 K498 V504 R505 I601	T246-L501 WeakPolarHBondContact OG1-CD2 3.5Å; L251-L501 HydrophobicContact CD1-CD1 4.11Å; L251-L501 HydrophobicContact CD2-CD1 4.09Å; P497-L501 PolarHBondContact O-N 3.04Å; P497-L501 VanDerWaalsContact O-N 3.12Å; K498-L501 PolarHBondContact O-N 3.08Å; L501-V504 PolarHBondContact O-N 3.3Å; L501-R505 WeakPolarHBondContact O-CG 3.29Å; L501-R505 PolarHBondContact O-N 3.43Å; L501-I601 HydrophobicContact CD1-CD1 4.12Å
502	T	95.9	Very high	93.4	Very high	55 Å²	55	24.6 Å²	24.6	34%	0.337	12%	0.123	S	C	.	.	H	α-helix	trans	-64.5	-42.8	177.6	-58.4	0	0	0	0	111.4	K498 F499 I500 R505 Q506	K498-T502 WeakPolarHBondContact O-CB 3.25Å; K498-T502 PolarHBondContact O-N 2.98Å; K498-T502 PolarHBondContact O-OG1 3.37Å; F499-T502 WeakPolarHBondContact O-CB 3.13Å; F499-T502 PolarHBondContact O-N 3.03Å; I500-T502 PolarHBondContact O-N 3.49Å; T502-R505 PolarHBondContact O-N 2.81Å; T502-Q506 WeakPolarHBondContact O-CG 3.47Å; T502-Q506 PolarHBondContact O-N 2.92Å
503	Q	96.8	Very high	93	Very high	9 Å²	9	30.1 Å²	30.1	4%	0.042	14%	0.142	C	C	.	.	H	α-helix	trans	-63.1	-41.7	174	-70.5	176.7	-56.6	0	0	111.8	T116 L262 F499 I500 R505 Q506 Q507	T116-Q503 PolarHBondContact O-NE2 3.48Å; L262-Q503 HydrophobicContact CD1-CB 3.61Å; L262-Q503 HydrophobicContact CD2-CB 4.1Å; F499-Q503 WeakPolarHBondContact O-CG 3.49Å; F499-Q503 PolarHBondContact O-N 3.24Å; I500-Q503 PolarHBondContact O-N 3.28Å; Q503-R505 VanDerWaalsContact C-N 3.33Å; Q503-R505 PolarHBondContact O-N 3.07Å; Q503-Q506 WeakPolarHBondContact O-CB 3.41Å; Q503-Q506 PolarHBondContact O-N 2.93Å; Q503-Q507 WeakPolarHBondContact O-CG 3.38Å; Q503-Q507 PolarHBondContact O-N 2.89Å
504	V	96.2	Very high	92.3	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58.8	-44.6	173.5	173.6	0	0	0	0	111.2	D255 K258 V259 L262 I500 L501 Q506 Q507 N508 I601	D255-V504 HydrophobicContact CB-CG1 4.04Å; K258-V504 HydrophobicContact CB-CG1 4.43Å; K258-V504 HydrophobicContact CB-CG2 4Å; K258-V504 HydrophobicContact CD-CG1 4.29Å; V259-V504 HydrophobicContact CG2-CG2 3.8Å; L262-V504 HydrophobicContact CD1-CG2 3.73Å; I500-V504 WeakPolarHBondContact O-CG2 3.39Å; I500-V504 PolarHBondContact O-N 3.31Å; L501-V504 PolarHBondContact O-N 3.3Å; V504-Q506 VanDerWaalsContact C-N 3.34Å; V504-Q506 PolarHBondContact O-N 2.7Å; V504-Q507 PolarHBondContact O-N 3.11Å; V504-N508 PolarHBondContact O-N 3.4Å; V504-I601 HydrophobicContact CG1-CD1 4.14Å
505	R	95.5	Very high	91.5	Very high	8 Å²	8	37.2 Å²	37.2	3%	0.03	18%	0.177	C	C	.	.	H	α-helix	trans	-60.6	-42.8	176.5	-72	178.8	-177.2	-89.4	2.9	112.3	L501 T502 Q503 N508 M509 E596 N600 I601	L501-R505 WeakPolarHBondContact O-CG 3.29Å; L501-R505 PolarHBondContact O-N 3.43Å; T502-R505 PolarHBondContact O-N 2.81Å; Q503-R505 VanDerWaalsContact C-N 3.33Å; Q503-R505 PolarHBondContact O-N 3.07Å; R505-N508 PolarHBondContact O-N 3.49Å; R505-M509 WeakPolarHBondContact O-CB 3.46Å; R505-M509 PolarHBondContact O-N 3.46Å; R505-E596 IonicContact CZ-OE1 3.29Å; R505-E596 IonicContact CZ-OE2 3.65Å; R505-E596 IonicContact NH1-OE1 2.75Å; R505-E596 PolarHBondContact NH1-OE1 3.24Å; R505-E596 IonicContact NH1-OE2 3.39Å; R505-E596 IonicContact NH2-OE1 2.92Å; R505-E596 PolarHBondContact NH2-OE1 3.09Å; R505-E596 IonicContact NH2-OE2 2.8Å; R505-E596 PolarHBondContact NH2-OE2 3.17Å; R505-N600 VanDerWaalsContact CA-O 3.26Å; R505-N600 WeakPolarHBondContact CA-O 3.25Å; R505-N600 HydrophobicContact CB-CB 4.27Å; R505-N600 PolarHBondContact NH1-OD1 3.03Å; R505-I601 HydrophobicContact CG-CD1 4.41Å
506	Q	94.6	Very high	90.9	Very high	80 Å²	80	45.4 Å²	45.4	37%	0.374	21%	0.209	S	C	.	.	H	α-helix	trans	-61.3	-46.6	175.3	-71	171.3	0.8	0	0	111.5	T116 T502 Q503 V504 N508 M509 E510	T116-Q506 HydrophobicContact CG2-CB 3.74Å; T502-Q506 WeakPolarHBondContact O-CG 3.47Å; T502-Q506 PolarHBondContact O-N 2.92Å; Q503-Q506 WeakPolarHBondContact O-CB 3.41Å; Q503-Q506 PolarHBondContact O-N 2.93Å; V504-Q506 VanDerWaalsContact C-N 3.34Å; V504-Q506 PolarHBondContact O-N 2.7Å; Q506-N508 VanDerWaalsContact C-N 3.34Å; Q506-N508 PolarHBondContact O-N 2.84Å; Q506-M509 PolarHBondContact O-N 3.22Å; Q506-E510 PolarHBondContact O-N 2.95Å
507	Q	93.3	Very high	90.4	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.1	-42.5	177.8	-70.1	179.7	11.9	0	0	112.1	V112 F113 T116 K258 Q503 V504 E510 S511	V112-Q507 HydrophobicContact CG1-CB 3.98Å; V112-Q507 HydrophobicContact CG1-CG 4.11Å; F113-Q507 VanDerWaalsContact CD2-NE2 3.28Å; T116-Q507 HydrophobicContact CG2-CG 3.68Å; T116-Q507 PolarHBondContact OG1-NE2 2.98Å; K258-Q507 HydrophobicContact CD-CB 4.45Å; Q503-Q507 WeakPolarHBondContact O-CG 3.38Å; Q503-Q507 PolarHBondContact O-N 2.89Å; V504-Q507 PolarHBondContact O-N 3.11Å; Q507-E510 PolarHBondContact O-N 3.27Å; Q507-S511 WeakPolarHBondContact O-CB 3.15Å; Q507-S511 PolarHBondContact O-N 2.87Å; Q507-S511 PolarHBondContact O-OG 3Å
508	N	92.8	Very high	89.7	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.011	25%	0.25	C	S	.	.	H	α-helix	trans	-62.9	-44.5	176.8	-81.1	-25.5	0	0	0	112	D255 K258 V504 R505 Q506 S511 Q512 N600	D255-N508 PolarHBondContact OD1-ND2 3.17Å; K258-N508 PolarHBondContact NZ-OD1 2.96Å; V504-N508 PolarHBondContact O-N 3.4Å; R505-N508 PolarHBondContact O-N 3.49Å; Q506-N508 VanDerWaalsContact C-N 3.34Å; Q506-N508 PolarHBondContact O-N 2.84Å; N508-S511 PolarHBondContact O-N 3.03Å; N508-Q512 WeakPolarHBondContact O-CG 3.25Å; N508-Q512 PolarHBondContact O-N 3.39Å; N508-N600 WeakPolarHBondContact CB-O 3.41Å; N508-N600 PolarHBondContact ND2-O 2.8Å; N508-N600 VanDerWaalsContact ND2-O 3.17Å
509	M	91.1	Very high	89.2	Confident	62 Å²	62	60.2 Å²	60.2	31%	0.305	27%	0.271	S	S	.	.	H	α-helix	trans	-64.8	-41.7	177.6	178.8	171.6	45.9	0	0	112	R505 Q506 Q512 R513 N600	R505-M509 WeakPolarHBondContact O-CB 3.46Å; R505-M509 PolarHBondContact O-N 3.46Å; Q506-M509 PolarHBondContact O-N 3.22Å; M509-Q512 PolarHBondContact O-N 3.11Å; M509-R513 VanDerWaalsContact O-CG 3.3Å; M509-R513 WeakPolarHBondContact O-CG 3.45Å; M509-R513 PolarHBondContact O-N 3.48Å; M509-R513 PolarHBondContact SD-NH2 2.94Å; M509-R513 VanDerWaalsContact SD-NH2 3.36Å; M509-N600 HydrophobicContact CB-CB 4.36Å
510	E	87.9	Confident	88.7	Confident	68 Å²	68	61.9 Å²	61.9	32%	0.318	29%	0.286	S	S	.	.	H	α-helix	trans	-67.6	-41.6	178.5	-132.2	169.5	-157.3	0	0	111.8	V112 S115 Q506 Q507 Q512 R513 K514	V112-E510 HydrophobicContact CG1-CB 3.84Å; V112-E510 HydrophobicContact CG2-CB 4.25Å; S115-E510 PolarHBondContact OG-OE2 3.23Å; Q506-E510 PolarHBondContact O-N 2.95Å; Q507-E510 PolarHBondContact O-N 3.27Å; E510-Q512 VanDerWaalsContact C-N 3.32Å; E510-Q512 PolarHBondContact O-N 2.94Å; E510-R513 PolarHBondContact O-N 3.36Å; E510-K514 WeakPolarHBondContact O-CG 3.49Å; E510-K514 PolarHBondContact O-N 3.32Å
511	S	85.3	Confident	88.1	Confident	32 Å²	32	65.6 Å²	65.6	22%	0.224	31%	0.309	C	S	.	.	H	α-helix	trans	-58.8	-42.9	173.7	-57.2	0	0	0	0	111.7	Q507 N508 K514 L515	Q507-S511 WeakPolarHBondContact O-CB 3.15Å; Q507-S511 PolarHBondContact O-N 2.87Å; Q507-S511 PolarHBondContact O-OG 3Å; N508-S511 PolarHBondContact O-N 3.03Å; S511-K514 PolarHBondContact O-N 2.98Å; S511-L515 WeakPolarHBondContact O-CG 3.3Å; S511-L515 PolarHBondContact O-N 3.43Å; S511-L515 VanDerWaalsContact O-N 3.08Å
512	Q	82.9	Confident	87.5	Confident	82 Å²	82	73.6 Å²	73.6	38%	0.383	34%	0.339	S	S	.	.	H	α-helix	trans	-67.1	-42.5	176.5	-77	178	-9.6	0	0	112.9	N508 M509 E510 K514 L515 Y516 G599	N508-Q512 WeakPolarHBondContact O-CG 3.25Å; N508-Q512 PolarHBondContact O-N 3.39Å; M509-Q512 PolarHBondContact O-N 3.11Å; E510-Q512 VanDerWaalsContact C-N 3.32Å; E510-Q512 PolarHBondContact O-N 2.94Å; Q512-K514 VanDerWaalsContact C-N 3.28Å; Q512-K514 PolarHBondContact O-N 3.48Å; Q512-L515 PolarHBondContact O-N 2.96Å; Q512-Y516 PolarHBondContact O-N 3.02Å; Q512-G599 VanDerWaalsContact CD-O 3.3Å; Q512-G599 PolarHBondContact NE2-O 3.35Å; Q512-G599 PolarHBondContact OE1-O 3.05Å
513	R	84.2	Confident	87	Confident	145 Å²	145	78.5 Å²	78.5	55%	0.547	36%	0.356	S	S	.	.	H	α-helix	trans	-59.9	-39.8	176.5	-75.7	173	-179	-178.1	0.7	111.4	M509 E510 Y516 K517	M509-R513 VanDerWaalsContact O-CG 3.3Å; M509-R513 WeakPolarHBondContact O-CG 3.45Å; M509-R513 PolarHBondContact O-N 3.48Å; M509-R513 PolarHBondContact SD-NH2 2.94Å; M509-R513 VanDerWaalsContact SD-NH2 3.36Å; E510-R513 PolarHBondContact O-N 3.36Å; R513-Y516 PolarHBondContact O-N 3.25Å; R513-K517 WeakPolarHBondContact O-CG 3.25Å; R513-K517 PolarHBondContact O-N 3.02Å
514	K	78.8	Confident	86.2	Confident	61 Å²	61	83 Å²	83	27%	0.265	38%	0.379	S	S	.	.	H	α-helix	trans	-63.7	-52.4	174.6	-73.1	-174.4	177	-166.8	0	111.7	E108 V112 E510 S511 Q512 Y516 K517 D518	E108-K514 PolarHBondContact O-NZ 3.24Å; V112-K514 HydrophobicContact CG2-CD 3.94Å; V112-K514 VanDerWaalsContact CG2-CE 3.44Å; E510-K514 WeakPolarHBondContact O-CG 3.49Å; E510-K514 PolarHBondContact O-N 3.32Å; S511-K514 PolarHBondContact O-N 2.98Å; Q512-K514 VanDerWaalsContact C-N 3.28Å; Q512-K514 PolarHBondContact O-N 3.48Å; K514-Y516 PolarHBondContact O-N 3.39Å; K514-Y516 VanDerWaalsContact O-N 3.12Å; K514-K517 CarbonylContact O-C 3.58Å; K514-K517 WeakPolarHBondContact O-CA 3.21Å; K514-K517 WeakPolarHBondContact O-CB 3.34Å; K514-K517 PolarHBondContact O-N 3.4Å; K514-D518 PolarHBondContact O-N 3.21Å
515	L	78.9	Confident	85.6	Confident	98 Å²	98	87.7 Å²	87.7	51%	0.513	40%	0.404	S	S	.	.	H	α-helix	trans	-54.4	-37.2	176.4	-73.3	169.7	0	0	0	112.9	S511 Q512 R519	S511-L515 WeakPolarHBondContact O-CG 3.3Å; S511-L515 PolarHBondContact O-N 3.43Å; S511-L515 VanDerWaalsContact O-N 3.08Å; Q512-L515 PolarHBondContact O-N 2.96Å; L515-R519 WeakPolarHBondContact O-CB 3.3Å; L515-R519 VanDerWaalsContact O-CG 3.23Å; L515-R519 WeakPolarHBondContact O-CG 3.37Å; L515-R519 PolarHBondContact O-N 3.11Å; L515-R519 VanDerWaalsContact O-N 3.08Å
516	Y	82	Confident	84.9	Confident	177 Å²	177	94.3 Å²	94.3	69%	0.694	43%	0.433	S	S	*	.	H	α-helix	trans	-66.3	-46.9	174.4	-177.2	-94.1	0	0	0	112.2	Q512 R513 K514 D518 R519 A520	Q512-Y516 PolarHBondContact O-N 3.02Å; R513-Y516 PolarHBondContact O-N 3.25Å; K514-Y516 PolarHBondContact O-N 3.39Å; K514-Y516 VanDerWaalsContact O-N 3.12Å; Y516-D518 PolarHBondContact O-N 2.93Å; Y516-R519 PolarHBondContact O-N 3.45Å; Y516-A520 PolarHBondContact O-N 3.45Å
517	K	83.8	Confident	84.2	Confident	140 Å²	140	98 Å²	98	61%	0.609	45%	0.448	S	S	*	.	H	α-helix	trans	-59.4	-44.8	175.9	-72.5	176	-179	-176.7	0	111.3	R513 K514 R519 A520 V521	R513-K517 WeakPolarHBondContact O-CG 3.25Å; R513-K517 PolarHBondContact O-N 3.02Å; K514-K517 CarbonylContact O-C 3.58Å; K514-K517 WeakPolarHBondContact O-CA 3.21Å; K514-K517 WeakPolarHBondContact O-CB 3.34Å; K514-K517 PolarHBondContact O-N 3.4Å; K517-R519 PolarHBondContact O-N 3.13Å; K517-A520 CarbonylContact O-C 3.49Å; K517-A520 WeakPolarHBondContact O-CB 3.4Å; K517-A520 PolarHBondContact O-N 2.95Å; K517-A520 VanDerWaalsContact O-N 3.1Å; K517-V521 WeakPolarHBondContact O-CG2 3.31Å; K517-V521 PolarHBondContact O-N 3.39Å
518	D	80.8	Confident	83.3	Confident	57 Å²	57	104 Å²	104	31%	0.305	48%	0.478	S	S	.	.	H	α-helix	trans	-66.5	-38.6	-179.9	-61.8	-25	0	0	0	112.2	K514 Y516 A520 V521 R522	K514-D518 PolarHBondContact O-N 3.21Å; Y516-D518 PolarHBondContact O-N 2.93Å; D518-A520 VanDerWaalsContact C-N 3.31Å; D518-A520 PolarHBondContact O-N 2.93Å; D518-V521 PolarHBondContact O-N 2.82Å; D518-R522 WeakPolarHBondContact O-CB 3.36Å; D518-R522 VanDerWaalsContact O-CG 3.26Å; D518-R522 WeakPolarHBondContact O-CG 3.31Å; D518-R522 PolarHBondContact O-N 3.1Å
519	R	84.7	Confident	82.3	Confident	171 Å²	171	109.2 Å²	109.2	65%	0.645	51%	0.511	S	S	*	.	H	α-helix	trans	-62.2	-40.5	172.2	-75.3	174.2	-176.5	-174.7	2.2	111.3	L515 Y516 K517 K523	L515-R519 WeakPolarHBondContact O-CB 3.3Å; L515-R519 VanDerWaalsContact O-CG 3.23Å; L515-R519 WeakPolarHBondContact O-CG 3.37Å; L515-R519 PolarHBondContact O-N 3.11Å; L515-R519 VanDerWaalsContact O-N 3.08Å; Y516-R519 PolarHBondContact O-N 3.45Å; K517-R519 PolarHBondContact O-N 3.13Å; R519-K523 WeakPolarHBondContact O-CB 3.45Å; R519-K523 VanDerWaalsContact O-CG 3.26Å; R519-K523 WeakPolarHBondContact O-CG 3.24Å; R519-K523 PolarHBondContact O-N 3.28Å
520	A	83.9	Confident	80.7	Confident	46 Å²	46	110.8 Å²	110.8	38%	0.38	52%	0.524	S	S	.	.	H	α-helix	trans	-66.1	-43.9	176.5	0	0	0	0	0	111.7	Y516 K517 D518 K523 L524	Y516-A520 PolarHBondContact O-N 3.45Å; K517-A520 CarbonylContact O-C 3.49Å; K517-A520 WeakPolarHBondContact O-CB 3.4Å; K517-A520 PolarHBondContact O-N 2.95Å; K517-A520 VanDerWaalsContact O-N 3.1Å; D518-A520 VanDerWaalsContact C-N 3.31Å; D518-A520 PolarHBondContact O-N 2.93Å; A520-K523 WeakPolarHBondContact O-CB 3.32Å; A520-K523 PolarHBondContact O-N 3.04Å; A520-L524 WeakPolarHBondContact O-CB 3.34Å; A520-L524 PolarHBondContact O-N 3.39Å
521	V	85.1	Confident	78.9	Confident	78 Å²	78	115.9 Å²	115.9	47%	0.473	55%	0.553	S	S	.	*	H	α-helix	trans	-62.4	-46.7	175.3	173	0	0	0	0	110.7	K517 D518 K523 L524 L525	K517-V521 WeakPolarHBondContact O-CG2 3.31Å; K517-V521 PolarHBondContact O-N 3.39Å; D518-V521 PolarHBondContact O-N 2.82Å; V521-K523 VanDerWaalsContact C-N 3.32Å; V521-K523 PolarHBondContact O-N 2.81Å; V521-L524 CarbonylContact O-C 3.57Å; V521-L524 WeakPolarHBondContact O-CB 3.4Å; V521-L524 PolarHBondContact O-N 2.79Å; V521-L524 VanDerWaalsContact O-N 3.12Å; V521-L525 HydrophobicContact CG1-CD1 3.83Å; V521-L525 HydrophobicContact CG1-CG 4.22Å; V521-L525 WeakPolarHBondContact O-CB 3.36Å; V521-L525 VanDerWaalsContact O-CG 3.31Å; V521-L525 WeakPolarHBondContact O-CG 3.44Å; V521-L525 PolarHBondContact O-N 2.86Å
522	R	83.8	Confident	77.3	Confident	174 Å²	174	125.1 Å²	125.1	66%	0.657	58%	0.583	S	S	*	*	H	α-helix	trans	-61.5	-38.4	175.4	-72	178.1	-168.3	-165.4	4.8	112.2	D518 K526	D518-R522 WeakPolarHBondContact O-CB 3.36Å; D518-R522 VanDerWaalsContact O-CG 3.26Å; D518-R522 WeakPolarHBondContact O-CG 3.31Å; D518-R522 PolarHBondContact O-N 3.1Å; R522-K526 WeakPolarHBondContact O-CB 3.44Å; R522-K526 VanDerWaalsContact O-CG 3.27Å; R522-K526 WeakPolarHBondContact O-CG 3.25Å; R522-K526 PolarHBondContact O-N 2.86Å
523	K	84.8	Confident	75.6	Confident	159 Å²	159	127 Å²	127	69%	0.691	60%	0.603	S	S	*	*	H	α-helix	trans	-64.4	-41	173.4	-77.9	176.9	-179.3	-176.1	0	111.5	R519 A520 V521 K526 K527	R519-K523 WeakPolarHBondContact O-CB 3.45Å; R519-K523 VanDerWaalsContact O-CG 3.26Å; R519-K523 WeakPolarHBondContact O-CG 3.24Å; R519-K523 PolarHBondContact O-N 3.28Å; A520-K523 WeakPolarHBondContact O-CB 3.32Å; A520-K523 PolarHBondContact O-N 3.04Å; V521-K523 VanDerWaalsContact C-N 3.32Å; V521-K523 PolarHBondContact O-N 2.81Å; K523-K526 PolarHBondContact O-N 3.07Å; K523-K527 WeakPolarHBondContact O-CB 3.48Å; K523-K527 PolarHBondContact O-N 3.14Å
524	L	80.4	Confident	73.8	Confident	103 Å²	103	127.5 Å²	127.5	54%	0.539	62%	0.615	S	S	.	*	H	α-helix	trans	-65.2	-46.2	175.6	-176.5	65.5	0	0	0	111.6	A520 V521 K526 K527 I528	A520-L524 WeakPolarHBondContact O-CB 3.34Å; A520-L524 PolarHBondContact O-N 3.39Å; V521-L524 CarbonylContact O-C 3.57Å; V521-L524 WeakPolarHBondContact O-CB 3.4Å; V521-L524 PolarHBondContact O-N 2.79Å; V521-L524 VanDerWaalsContact O-N 3.12Å; L524-K526 VanDerWaalsContact C-N 3.33Å; L524-K526 PolarHBondContact O-N 3.28Å; L524-K527 CarbonylContact O-C 3.54Å; L524-K527 WeakPolarHBondContact O-CA 3.47Å; L524-K527 WeakPolarHBondContact O-CB 3.5Å; L524-K527 PolarHBondContact O-N 3.15Å; L524-I528 HydrophobicContact CG-CD1 4.09Å; L524-I528 WeakPolarHBondContact O-CG1 3.26Å; L524-I528 PolarHBondContact O-N 3.04Å
525	L	82.9	Confident	72.3	Confident	98 Å²	98	131.8 Å²	131.8	51%	0.513	64%	0.641	S	S	.	*	H	α-helix	trans	-61.7	-39.4	176.9	-69.9	171	0	0	0	112	V521 K527 I528 T529	V521-L525 HydrophobicContact CG1-CD1 3.83Å; V521-L525 HydrophobicContact CG1-CG 4.22Å; V521-L525 WeakPolarHBondContact O-CB 3.36Å; V521-L525 VanDerWaalsContact O-CG 3.31Å; V521-L525 WeakPolarHBondContact O-CG 3.44Å; V521-L525 PolarHBondContact O-N 2.86Å; L525-K527 VanDerWaalsContact C-N 3.33Å; L525-I528 PolarHBondContact O-N 3.06Å; L525-T529 PolarHBondContact O-N 3.13Å; L525-T529 PolarHBondContact O-OG1 3.42Å
526	K	81.8	Confident	70.5	Confident	147 Å²	147	136.3 Å²	136.3	64%	0.639	66%	0.656	S	S	*	*	H	α-helix	trans	-64.1	-36.6	171.6	-75.6	179.3	-179.2	-171.7	0	112.4	R522 K523 L524 I528 T529 T530	R522-K526 WeakPolarHBondContact O-CB 3.44Å; R522-K526 VanDerWaalsContact O-CG 3.27Å; R522-K526 WeakPolarHBondContact O-CG 3.25Å; R522-K526 PolarHBondContact O-N 2.86Å; K523-K526 PolarHBondContact O-N 3.07Å; L524-K526 VanDerWaalsContact C-N 3.33Å; L524-K526 PolarHBondContact O-N 3.28Å; K526-I528 VanDerWaalsContact C-N 3.33Å; K526-T529 WeakPolarHBondContact CA-OG1 3.32Å; K526-T529 PolarHBondContact O-N 2.92Å; K526-T529 PolarHBondContact O-OG1 2.96Å; K526-T530 PolarHBondContact O-N 3.03Å; K526-T530 PolarHBondContact O-OG1 2.92Å
527	K	78.6	Confident	68.5	Low	159 Å²	159	132.3 Å²	132.3	69%	0.691	66%	0.66	S	S	*	*	H	α-helix	trans	-67.6	-32.5	174.8	-167.6	179	-179.2	-178.5	0	112.3	K523 L524 L525	K523-K527 WeakPolarHBondContact O-CB 3.48Å; K523-K527 PolarHBondContact O-N 3.14Å; L524-K527 CarbonylContact O-C 3.54Å; L524-K527 WeakPolarHBondContact O-CA 3.47Å; L524-K527 WeakPolarHBondContact O-CB 3.5Å; L524-K527 PolarHBondContact O-N 3.15Å; L525-K527 VanDerWaalsContact C-N 3.33Å
528	I	74.9	Confident	66.3	Low	124 Å²	124	132.6 Å²	132.6	64%	0.636	67%	0.667	S	S	*	*	H	α-helix	trans	-76.3	-31.4	177.1	-65.3	164	0	0	0	111.7	L524 L525 K526	L524-I528 HydrophobicContact CG-CD1 4.09Å; L524-I528 WeakPolarHBondContact O-CG1 3.26Å; L524-I528 PolarHBondContact O-N 3.04Å; L525-I528 PolarHBondContact O-N 3.06Å; K526-I528 VanDerWaalsContact C-N 3.33Å
529	T	71.9	Confident	64.3	Low	113 Å²	113	135.6 Å²	135.6	69%	0.693	69%	0.689	S	S	*	*	H	α-helix	trans	-90.1	-10.1	-177.6	39.6	0	0	0	0	114.7	L525 K526	L525-T529 PolarHBondContact O-N 3.13Å; L525-T529 PolarHBondContact O-OG1 3.42Å; K526-T529 WeakPolarHBondContact CA-OG1 3.32Å; K526-T529 PolarHBondContact O-N 2.92Å; K526-T529 PolarHBondContact O-OG1 2.96Å
530	T	56.5	Low	62	Low	95 Å²	95	136.1 Å²	136.1	58%	0.583	70%	0.699	S	S	*	*	S	Bend	trans	-133.7	111.1	175.8	13	0	0	0	0	110.7	K526 R532	K526-T530 PolarHBondContact O-N 3.03Å; K526-T530 PolarHBondContact O-OG1 2.92Å; T530-R532 VanDerWaalsContact C-N 3.31Å; T530-R532 PolarHBondContact O-N 2.75Å
531	D	50.1	Low	59.7	Low	174 Å²	174	136.8 Å²	136.8	93%	0.93	71%	0.71	S	S	*	*			trans	-68.6	84.6	170.1	-103.9	-18.1	0	0	0	109.9
532	R	52.1	Low	57.4	Low	226 Å²	226	140 Å²	140	85%	0.853	73%	0.725	S	S	*	*			trans	-148.1	123.7	166.2	-120.1	-179.5	-177.8	-174.2	0.5	112	T530	T530-R532 VanDerWaalsContact C-N 3.31Å; T530-R532 PolarHBondContact O-N 2.75Å
533	P	47.8	Very low	55.4	Low	123 Å²	123	140.9 Å²	140.9	80%	0.799	74%	0.737	S	S	*	*			trans	-85	135.7	169.6	33.6	-27.9	0	0	0	109
534	L	45.6	Very low	53.4	Low	155 Å²	155	139.6 Å²	139.6	81%	0.812	74%	0.737	S	S	*	*			trans	-143	120.6	153.6	-158.1	79.4	0	0	0	109.2
535	D	48.7	Very low	52	Low	151 Å²	151	139.6 Å²	139.6	81%	0.807	74%	0.742	S	S	*	*			trans	-53.1	135.4	163.3	-69.1	-49.7	0	0	0	110.6
536	K	39.7	Very low	50.8	Low	192 Å²	192	143.8 Å²	143.8	84%	0.835	76%	0.759	S	S	*	*			trans	-166.4	133.7	142.6	-105.7	159.6	-167.9	-172	0	111
537	A	41.3	Very low	50.6	Low	94 Å²	94	138 Å²	138	78%	0.777	74%	0.74	S	S	*	*			trans	-53.7	141.7	-179.5	0	0	0	0	0	112.8
538	I	36.3	Very low	51.1	Low	145 Å²	145	135.7 Å²	135.7	74%	0.744	73%	0.731	S	S	*	*			trans	-65.6	127.2	164	-61.3	160.7	0	0	0	106.4	E540	I538-E540 PolarHBondContact O-N 2.88Å; I538-E540 VanDerWaalsContact O-N 3.15Å
539	P	39.6	Very low	51.8	Low	120 Å²	120	130.1 Å²	130.1	78%	0.779	70%	0.702	S	S	*	*			trans	-70.5	107.8	159.6	6.1	9.7	0	0	0	105.9	G541	P539-G541 PolarHBondContact O-N 3.01Å
540	E	36.3	Very low	52.8	Low	182 Å²	182	132.3 Å²	132.3	85%	0.85	70%	0.698	S	S	*	*			trans	-54.4	126.4	165.9	-68.1	-169	159.5	0	0	108	I538 D542	I538-E540 PolarHBondContact O-N 2.88Å; I538-E540 VanDerWaalsContact O-N 3.15Å; E540-D542 PolarHBondContact O-N 3.46Å
541	G	34.9	Very low	54.5	Low	60 Å²	60	127.8 Å²	127.8	62%	0.619	67%	0.67	S	S	*	*			trans	-61.6	134.9	174.8	0	0	0	0	0	109.2	P539 E543	P539-G541 PolarHBondContact O-N 3.01Å; G541-E543 PolarHBondContact O-N 3.44Å
542	D	36.8	Very low	56.5	Low	147 Å²	147	123.2 Å²	123.2	79%	0.786	64%	0.643	S	S	*	*			trans	-60.7	91.8	178.4	-152.6	2.1	0	0	0	109.7	E540 N544	E540-D542 PolarHBondContact O-N 3.46Å; D542-N544 PolarHBondContact O-N 3.18Å
543	E	42.1	Very low	58.2	Low	191 Å²	191	112.5 Å²	112.5	89%	0.893	60%	0.603	S	S	*	*			trans	-74.2	19.4	-175.9	-86.1	-156.9	156.8	0	0	114.3	G541	G541-E543 PolarHBondContact O-N 3.44Å
544	N	43	Very low	59.9	Low	132 Å²	132	110.6 Å²	110.6	71%	0.706	59%	0.59	S	S	*	*			trans	-135.9	49.7	-170	-132.1	9.3	0	0	0	116.3	D542	D542-N544 PolarHBondContact O-N 3.18Å
545	T	50.4	Low	61.5	Low	104 Å²	104	106.5 Å²	106.5	64%	0.638	57%	0.567	S	S	*	*			trans	-106.3	34.3	162.8	42.8	0	0	0	0	112.5	G547	T545-G547 VanDerWaalsContact C-N 3.27Å; T545-G547 PolarHBondContact O-N 3.12Å
546	Q	57.8	Low	63	Low	186 Å²	186	99.7 Å²	99.7	87%	0.869	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	82.7	175.7	-121.6	167.2	6.2	0	0	110.2
547	G	78.4	Confident	64.7	Low	24 Å²	24	94.9 Å²	94.9	25%	0.247	52%	0.521	C	S	.	.	T	Hydrogen-bonded Turn	trans	135.4	-2.4	171.9	0	0	0	0	0	116.5	T545 Q564 L565	T545-G547 VanDerWaalsContact C-N 3.27Å; T545-G547 PolarHBondContact O-N 3.12Å; G547-Q564 CarbonylContact O-C 3.56Å; G547-Q564 WeakPolarHBondContact O-CA 3.08Å; G547-L565 PolarHBondContact O-N 3.39Å
548	F	88	Confident	66.4	Low	111 Å²	111	94.3 Å²	94.3	49%	0.487	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	138.8	176.4	-66.5	-93.6	0	0	0	111.5	I563 Q564	F548-I563 CarbonylContact C-O 3.43Å; F548-I563 VanDerWaalsContact CA-O 3.28Å; F548-I563 WeakPolarHBondContact CA-O 3.5Å; F548-Q564 VanDerWaalsContact CD1-CA 3.49Å; F548-Q564 HydrophobicContact CD1-CB 3.84Å; F548-Q564 HydrophobicContact CD1-CG 4.32Å; F548-Q564 HydrophobicContact CE1-CB 3.5Å; F548-Q564 VanDerWaalsContact CE1-CB 3.5Å; F548-Q564 HydrophobicContact CE1-CG 3.85Å; F548-Q564 HydrophobicContact CZ-CB 4.13Å; F548-Q564 HydrophobicContact CZ-CG 3.95Å
549	I	90.9	Very high	68.5	Low	8 Å²	8	92.6 Å²	92.6	4%	0.041	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	150.5	167.2	57.6	169.6	0	0	0	110.1	V551 A562 I563 L565 M612 W624	I549-V551 HydrophobicContact CD1-CG2 3.91Å; I549-V551 HydrophobicContact CG1-CG2 4.24Å; I549-A562 CarbonylContact O-C 3.56Å; I549-A562 WeakPolarHBondContact O-CA 3.35Å; I549-I563 HydrophobicContact CG1-CB 4.08Å; I549-I563 PolarHBondContact N-O 3.38Å; I549-I563 PolarHBondContact O-N 3.49Å; I549-L565 HydrophobicContact CB-CD2 4.42Å; I549-L565 HydrophobicContact CD1-CD2 3.92Å; I549-L565 HydrophobicContact CG1-CD2 3.91Å; I549-L565 HydrophobicContact CG1-CG 4.44Å; I549-L565 HydrophobicContact CG2-CD1 3.78Å; I549-L565 HydrophobicContact CG2-CD2 3.72Å; I549-L565 HydrophobicContact CG2-CG 3.85Å; I549-M612 HydrophobicContact CD1-CB 4.47Å; I549-M612 HydrophobicContact CD1-CE 3.82Å; I549-W624 HydrophobicContact CD1-CD2 4.49Å; I549-W624 HydrophobicContact CD1-CG 4.29Å
550	R	92.2	Very high	70.8	Confident	158 Å²	158	88.9 Å²	88.9	60%	0.596	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	116.7	171.2	-174.9	171.5	-68.8	-89	1.5	109.1	S560	R550-S560 VanDerWaalsContact CG-OG 3.31Å; R550-S560 WeakPolarHBondContact CG-OG 3.39Å; R550-S560 PolarHBondContact NH1-OG 3.1Å
551	V	92.8	Very high	73.4	Confident	0 Å²	0	81 Å²	81	0%	0	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	131	176.9	-176.2	0	0	0	0	109.2	I549 S560 M561 I563 V574 F578 L594 W624 I626	I549-V551 HydrophobicContact CD1-CG2 3.91Å; I549-V551 HydrophobicContact CG1-CG2 4.24Å; V551-S560 CarbonylContact O-C 3.56Å; V551-S560 VanDerWaalsContact O-CA 3.3Å; V551-S560 WeakPolarHBondContact O-CA 3.49Å; V551-S560 PolarHBondContact O-OG 3.02Å; V551-M561 PolarHBondContact N-O 3.42Å; V551-M561 PolarHBondContact O-N 2.83Å; V551-I563 HydrophobicContact CB-CD1 4.22Å; V551-I563 HydrophobicContact CG2-CD1 3.66Å; V551-I563 HydrophobicContact CG2-CG1 4.28Å; V551-V574 HydrophobicContact CG1-CG1 4.15Å; V551-V574 HydrophobicContact CG2-CG1 4.03Å; V551-F578 HydrophobicContact CB-CE2 3.85Å; V551-F578 HydrophobicContact CB-CZ 4.06Å; V551-F578 HydrophobicContact CG1-CE2 3.61Å; V551-F578 HydrophobicContact CG1-CZ 3.95Å; V551-L594 HydrophobicContact CG1-CD1 3.85Å; V551-W624 CarbonylContact C-O 3.59Å; V551-W624 WeakPolarHBondContact CA-O 3.13Å; V551-W624 HydrophobicContact CB-CB 4.42Å; V551-W624 HydrophobicContact CG1-CB 4.47Å; V551-W624 HydrophobicContact CG2-CB 3.95Å; V551-I626 HydrophobicContact CG1-CD1 4.1Å; V551-I626 HydrophobicContact CG1-CG1 3.89Å
552	Q	92.3	Very high	76	Confident	79 Å²	79	80.9 Å²	80.9	37%	0.369	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	138.2	175.5	-58.2	-177	0.7	0	0	109.9	I559 W624 V625 I626	Q552-I559 CarbonylContact C-O 3.6Å; Q552-I559 WeakPolarHBondContact CA-O 3.24Å; Q552-W624 PolarHBondContact N-O 3.27Å; Q552-V625 HydrophobicContact CB-CG1 4.42Å; Q552-V625 HydrophobicContact CB-CG2 4.3Å; Q552-V625 CarbonylContact O-C 3.55Å; Q552-V625 VanDerWaalsContact O-CA 3.32Å; Q552-V625 WeakPolarHBondContact O-CA 3.44Å; Q552-I626 PolarHBondContact O-N 2.98Å
553	A	88.1	Confident	78.6	Confident	0 Å²	0	74 Å²	74	0%	0	39%	0.389	C	S	.	.			trans	-143.3	75.6	178.8	0	0	0	0	0	109.6	Q555 F556 I559 F578 I626	A553-Q555 PolarHBondContact O-N 3.15Å; A553-F556 HydrophobicContact CB-CB 4.31Å; A553-F556 HydrophobicContact CB-CD2 3.6Å; A553-F556 HydrophobicContact CB-CE2 4.33Å; A553-F556 HydrophobicContact CB-CG 4.26Å; A553-F556 PolarHBondContact O-N 2.92Å; A553-I559 PolarHBondContact N-O 3.05Å; A553-F578 HydrophobicContact CB-CD1 3.7Å; A553-F578 HydrophobicContact CB-CE1 3.42Å; A553-F578 VanDerWaalsContact CB-CE1 3.42Å; A553-F578 HydrophobicContact CB-CG 4.47Å; A553-F578 HydrophobicContact CB-CZ 3.98Å; A553-I626 HydrophobicContact CB-CB 4.11Å; A553-I626 HydrophobicContact CB-CD1 4.18Å; A553-I626 HydrophobicContact CB-CG1 4.4Å
554	P	82.9	Confident	81	Confident	83 Å²	83	70.2 Å²	70.2	54%	0.539	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.3	-172.6	-24.2	34.3	0	0	0	115.5	F556	P554-F556 VanDerWaalsContact C-N 3.35Å
555	Q	79.3	Confident	83.3	Confident	70 Å²	70	65.2 Å²	65.2	33%	0.327	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-6.8	179.7	71.7	-81	31.5	0	0	114.1	A553 L592 I626	A553-Q555 PolarHBondContact O-N 3.15Å; Q555-L592 HydrophobicContact CG-CD2 4.45Å; Q555-I626 VanDerWaalsContact NE2-C 3.32Å; Q555-I626 PolarHBondContact NE2-O 3.37Å; Q555-I626 PolarHBondContact OE1-O 2.87Å
556	F	79.2	Confident	85.3	Confident	7 Å²	7	62.5 Å²	62.5	3%	0.031	33%	0.327	C	S	.	.	S	Bend	trans	-103.5	155.6	177.2	-70.7	-98.4	0	0	0	110.7	A553 P554 K558 F578 L579 D582 V585 L592 I626	A553-F556 HydrophobicContact CB-CB 4.31Å; A553-F556 HydrophobicContact CB-CD2 3.6Å; A553-F556 HydrophobicContact CB-CE2 4.33Å; A553-F556 HydrophobicContact CB-CG 4.26Å; A553-F556 PolarHBondContact O-N 2.92Å; P554-F556 VanDerWaalsContact C-N 3.35Å; F556-K558 PolarHBondContact O-N 3.15Å; F556-F578 HydrophobicContact CE1-CB 4.24Å; F556-F578 HydrophobicContact CG-CD1 4.4Å; F556-F578 HydrophobicContact CZ-CB 4.3Å; F556-L579 HydrophobicContact CE1-CD2 4.02Å; F556-L579 HydrophobicContact CZ-CD2 3.95Å; F556-L579 HydrophobicContact CZ-CG 4.48Å; F556-D582 HydrophobicContact CD1-CB 3.76Å; F556-D582 HydrophobicContact CE1-CB 4.38Å; F556-V585 HydrophobicContact CD1-CG2 3.73Å; F556-V585 HydrophobicContact CE1-CB 4.35Å; F556-V585 HydrophobicContact CE1-CG1 4.43Å; F556-V585 HydrophobicContact CE1-CG2 4Å; F556-V585 HydrophobicContact CG-CG2 4.39Å; F556-L592 HydrophobicContact CE2-CD1 3.92Å; F556-L592 HydrophobicContact CZ-CD1 3.61Å; F556-I626 HydrophobicContact CE2-CG2 4.32Å
557	S	75.7	Confident	86.8	Confident	92 Å²	92	58.8 Å²	58.8	64%	0.643	31%	0.31	S	S	*	.	S	Bend	trans	-58.7	-35.8	172.6	60.7	0	0	0	0	111.8	I559 D582	S557-I559 PolarHBondContact O-N 3.11Å; S557-D582 WeakPolarHBondContact CB-OD2 3.33Å; S557-D582 PolarHBondContact N-OD2 3.25Å; S557-D582 VanDerWaalsContact OG-CG 3.26Å; S557-D582 PolarHBondContact OG-OD2 3.43Å
558	K	77.2	Confident	87.5	Confident	82 Å²	82	63 Å²	63	36%	0.357	33%	0.327	S	S	.	.	S	Bend	trans	-90.4	92.5	169.4	-167.7	-178	-170.9	-177.6	0	110.3	F556 S560 M561	F556-K558 PolarHBondContact O-N 3.15Å; K558-S560 VanDerWaalsContact C-N 3.27Å; K558-S560 PolarHBondContact O-N 2.85Å; K558-M561 PolarHBondContact NZ-SD 2.88Å
559	I	81.3	Confident	87.8	Confident	108 Å²	108	57.8 Å²	57.8	55%	0.554	30%	0.304	S	S	*	.			trans	-68.9	-21.8	-173.1	-59.1	165	0	0	0	113.2	Q552 A553 S557	Q552-I559 CarbonylContact C-O 3.6Å; Q552-I559 WeakPolarHBondContact CA-O 3.24Å; A553-I559 PolarHBondContact N-O 3.05Å; S557-I559 PolarHBondContact O-N 3.11Å
560	S	88.5	Confident	88	Confident	42 Å²	42	59.6 Å²	59.6	29%	0.294	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	143	178	-175.7	0	0	0	0	112.5	R550 V551 K558	R550-S560 VanDerWaalsContact CG-OG 3.31Å; R550-S560 WeakPolarHBondContact CG-OG 3.39Å; R550-S560 PolarHBondContact NH1-OG 3.1Å; V551-S560 CarbonylContact O-C 3.56Å; V551-S560 VanDerWaalsContact O-CA 3.3Å; V551-S560 WeakPolarHBondContact O-CA 3.49Å; V551-S560 PolarHBondContact O-OG 3.02Å; K558-S560 VanDerWaalsContact C-N 3.27Å; K558-S560 PolarHBondContact O-N 2.85Å
561	M	89.3	Confident	88	Confident	16 Å²	16	52.2 Å²	52.2	8%	0.079	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	134.9	176	-174	162.9	66.1	0	0	111.1	V551 K558 I563 R577 F578	V551-M561 PolarHBondContact N-O 3.42Å; V551-M561 PolarHBondContact O-N 2.83Å; K558-M561 PolarHBondContact NZ-SD 2.88Å; M561-I563 HydrophobicContact CE-CD1 3.67Å; M561-I563 HydrophobicContact CE-CG1 3.88Å; M561-I563 HydrophobicContact CG-CG1 4.09Å; M561-R577 HydrophobicContact CE-CB 3.98Å; M561-F578 HydrophobicContact CB-CE1 4.11Å; M561-F578 HydrophobicContact CB-CE2 4.09Å; M561-F578 HydrophobicContact CB-CZ 3.52Å; M561-F578 HydrophobicContact CE-CD2 3.61Å; M561-F578 HydrophobicContact CE-CE2 3.47Å; M561-F578 VanDerWaalsContact CE-CE2 3.47Å; M561-F578 HydrophobicContact CE-CG 4.26Å; M561-F578 HydrophobicContact CE-CZ 3.99Å
562	A	90.9	Very high	88	Confident	58 Å²	58	53.1 Å²	53.1	48%	0.479	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.3	166.9	0	0	0	0	0	109.2	I549	I549-A562 CarbonylContact O-C 3.56Å; I549-A562 WeakPolarHBondContact O-CA 3.35Å
563	I	90.6	Very high	88.1	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.015	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	127.3	-176.4	-57.8	-176.2	0	0	0	108.6	F548 I549 V551 M561 L569 V574 F578	F548-I563 CarbonylContact C-O 3.43Å; F548-I563 VanDerWaalsContact CA-O 3.28Å; F548-I563 WeakPolarHBondContact CA-O 3.5Å; I549-I563 HydrophobicContact CG1-CB 4.08Å; I549-I563 PolarHBondContact N-O 3.38Å; I549-I563 PolarHBondContact O-N 3.49Å; V551-I563 HydrophobicContact CB-CD1 4.22Å; V551-I563 HydrophobicContact CG2-CD1 3.66Å; V551-I563 HydrophobicContact CG2-CG1 4.28Å; M561-I563 HydrophobicContact CE-CD1 3.67Å; M561-I563 HydrophobicContact CE-CG1 3.88Å; M561-I563 HydrophobicContact CG-CG1 4.09Å; I563-L569 HydrophobicContact CG2-CD1 4.48Å; I563-L569 HydrophobicContact CG2-CD2 3.67Å; I563-V574 HydrophobicContact CD1-CB 4.25Å; I563-V574 HydrophobicContact CD1-CG1 3.61Å; I563-V574 HydrophobicContact CD1-CG2 4Å; I563-F578 HydrophobicContact CD1-CE2 4.27Å
564	Q	92.1	Very high	88.2	Confident	112 Å²	112	52.3 Å²	52.3	52%	0.523	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	129	173.9	-166.5	173.8	11.6	0	0	110.2	G547 F548 T566	G547-Q564 CarbonylContact O-C 3.56Å; G547-Q564 WeakPolarHBondContact O-CA 3.08Å; F548-Q564 VanDerWaalsContact CD1-CA 3.49Å; F548-Q564 HydrophobicContact CD1-CB 3.84Å; F548-Q564 HydrophobicContact CD1-CG 4.32Å; F548-Q564 HydrophobicContact CE1-CB 3.5Å; F548-Q564 VanDerWaalsContact CE1-CB 3.5Å; F548-Q564 HydrophobicContact CE1-CG 3.85Å; F548-Q564 HydrophobicContact CZ-CB 4.13Å; F548-Q564 HydrophobicContact CZ-CG 3.95Å; Q564-T566 PolarHBondContact O-N 3.45Å
565	L	92.1	Very high	88.6	Confident	27 Å²	27	48.8 Å²	48.8	14%	0.141	27%	0.266	C	S	.	.			trans	-77.4	114.7	174.3	-68.7	178.1	0	0	0	109.9	G547 I549 L569 M612 K613	G547-L565 PolarHBondContact O-N 3.39Å; I549-L565 HydrophobicContact CB-CD2 4.42Å; I549-L565 HydrophobicContact CD1-CD2 3.92Å; I549-L565 HydrophobicContact CG1-CD2 3.91Å; I549-L565 HydrophobicContact CG1-CG 4.44Å; I549-L565 HydrophobicContact CG2-CD1 3.78Å; I549-L565 HydrophobicContact CG2-CD2 3.72Å; I549-L565 HydrophobicContact CG2-CG 3.85Å; L565-L569 HydrophobicContact CD2-CD2 4.24Å; L565-M612 HydrophobicContact CD2-CB 3.82Å; L565-K613 HydrophobicContact CB-CB 4.48Å
566	T	91.9	Very high	89.1	Confident	46 Å²	46	48.4 Å²	48.4	28%	0.282	27%	0.269	S	S	.	.			trans	-108.8	163.7	169.6	61.1	0	0	0	0	110.1	Q564 D568 L569	Q564-T566 PolarHBondContact O-N 3.45Å; T566-D568 WeakPolarHBondContact CB-OD1 3.44Å; T566-D568 PolarHBondContact O-N 3.44Å; T566-D568 PolarHBondContact OG1-OD1 2.9Å; T566-L569 PolarHBondContact O-N 2.74Å; T566-L569 WeakPolarHBondContact OG1-CB 3.29Å; T566-L569 PolarHBondContact OG1-N 2.67Å
567	E	89.8	Confident	89.5	Confident	109 Å²	109	52.9 Å²	52.9	51%	0.509	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-26.2	179.3	-70.3	-69.7	160.3	0	0	113	Y611 K613	E567-Y611 VanDerWaalsContact O-CD1 3.3Å; E567-Y611 WeakPolarHBondContact O-CD1 3.28Å; E567-K613 WeakPolarHBondContact OE1-CE 3.32Å; E567-K613 IonicContact OE1-NZ 3.73Å; E567-K613 PolarHBondContact OE1-NZ 3.23Å
568	D	92.8	Very high	90.1	Very high	112 Å²	112	48.6 Å²	48.6	60%	0.599	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-6.3	-176	61	-27.2	0	0	0	113.6	T566 Q570	T566-D568 WeakPolarHBondContact CB-OD1 3.44Å; T566-D568 PolarHBondContact O-N 3.44Å; T566-D568 PolarHBondContact OG1-OD1 2.9Å; D568-Q570 PolarHBondContact O-N 3.08Å; D568-Q570 VanDerWaalsContact O-N 3.12Å
569	L	94.1	Very high	90.4	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	25%	0.249	C	C	.	.			trans	-67.1	112.5	-176.4	-177.7	72	0	0	0	111.2	I563 L565 T566 D573 V574 M612	I563-L569 HydrophobicContact CG2-CD1 4.48Å; I563-L569 HydrophobicContact CG2-CD2 3.67Å; L565-L569 HydrophobicContact CD2-CD2 4.24Å; T566-L569 PolarHBondContact O-N 2.74Å; T566-L569 WeakPolarHBondContact OG1-CB 3.29Å; T566-L569 PolarHBondContact OG1-N 2.67Å; L569-D573 HydrophobicContact CD1-CB 3.92Å; L569-V574 HydrophobicContact CD1-CG2 4.21Å; L569-V574 HydrophobicContact CD2-CG2 4.19Å; L569-V574 HydrophobicContact CG-CG2 4.24Å; L569-M612 HydrophobicContact CD2-CB 4Å; L569-M612 HydrophobicContact CD2-CG 4.17Å; L569-M612 HydrophobicContact CG-CB 4.28Å; L569-M612 HydrophobicContact CG-CG 4.15Å; L569-M612 PolarHBondContact O-N 2.83Å
570	Q	95.3	Very high	90.6	Very high	45 Å²	45	46 Å²	46	21%	0.21	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-96.8	161.2	175.4	-65.5	-175.9	-24.8	0	0	112.7	D568 S572 D573 V574 T610 Y611	D568-Q570 PolarHBondContact O-N 3.08Å; D568-Q570 VanDerWaalsContact O-N 3.12Å; Q570-S572 PolarHBondContact O-N 3.31Å; Q570-D573 PolarHBondContact N-OD2 2.93Å; Q570-D573 WeakPolarHBondContact O-CB 3.47Å; Q570-D573 PolarHBondContact O-N 3.49Å; Q570-D573 VanDerWaalsContact O-N 3.14Å; Q570-V574 PolarHBondContact O-N 3.18Å; Q570-T610 CarbonylContact C-O 3.46Å; Q570-T610 VanDerWaalsContact CA-O 3.24Å; Q570-T610 WeakPolarHBondContact CA-O 3.45Å; Q570-Y611 HydrophobicContact CG-CD1 4.19Å; Q570-Y611 HydrophobicContact CG-CE1 4.06Å; Q570-Y611 PolarHBondContact NE2-OH 3Å
571	A	93.1	Very high	90	Very high	4 Å²	4	49.1 Å²	49.1	3%	0.033	26%	0.264	C	S	.	.	H	α-helix	trans	-58.3	-37.4	174.9	0	0	0	0	0	112.1	D573 V574 L575 L594 L606 T610 M612	A571-D573 VanDerWaalsContact C-N 3.32Å; A571-D573 PolarHBondContact O-N 2.98Å; A571-V574 WeakPolarHBondContact O-CB 3.44Å; A571-V574 PolarHBondContact O-N 2.84Å; A571-L575 PolarHBondContact O-N 2.92Å; A571-L575 VanDerWaalsContact O-N 3.16Å; A571-L594 HydrophobicContact CB-CD2 4.13Å; A571-L606 HydrophobicContact CB-CB 4.28Å; A571-T610 PolarHBondContact N-O 3.48Å; A571-M612 HydrophobicContact CB-SD 3.97Å
572	S	92.5	Very high	89.1	Confident	19 Å²	19	48.9 Å²	48.9	13%	0.133	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-33.7	176	63.5	0	0	0	0	113.4	Q570 L575 T576 E608	Q570-S572 PolarHBondContact O-N 3.31Å; S572-L575 PolarHBondContact O-N 3.14Å; S572-T576 WeakPolarHBondContact O-CB 3.48Å; S572-T576 PolarHBondContact O-N 3.48Å; S572-T576 PolarHBondContact O-OG1 3.18Å; S572-E608 WeakPolarHBondContact CB-O 3.48Å; S572-E608 PolarHBondContact N-O 2.7Å; S572-E608 VanDerWaalsContact N-O 3.11Å; S572-E608 PolarHBondContact OG-O 2.67Å
573	D	93.1	Very high	87.6	Confident	62 Å²	62	52.4 Å²	52.4	33%	0.332	28%	0.284	S	S	.	.	H	α-helix	trans	-67.9	-41.4	175.5	-63.2	-44	0	0	0	111.2	L569 Q570 A571 L575 T576 R577	L569-D573 HydrophobicContact CD1-CB 3.92Å; Q570-D573 PolarHBondContact N-OD2 2.93Å; Q570-D573 WeakPolarHBondContact O-CB 3.47Å; Q570-D573 PolarHBondContact O-N 3.49Å; Q570-D573 VanDerWaalsContact O-N 3.14Å; A571-D573 VanDerWaalsContact C-N 3.32Å; A571-D573 PolarHBondContact O-N 2.98Å; D573-L575 VanDerWaalsContact C-N 3.34Å; D573-L575 PolarHBondContact O-N 2.99Å; D573-T576 PolarHBondContact O-N 2.99Å; D573-R577 VanDerWaalsContact O-CG 3.31Å; D573-R577 WeakPolarHBondContact O-CG 3.41Å; D573-R577 PolarHBondContact O-N 3.13Å
574	V	91.3	Very high	86.2	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-57.7	-49.2	175.3	171.4	0	0	0	0	110	V551 I563 L569 Q570 A571 T576 R577 F578 L594 M612	V551-V574 HydrophobicContact CG1-CG1 4.15Å; V551-V574 HydrophobicContact CG2-CG1 4.03Å; I563-V574 HydrophobicContact CD1-CB 4.25Å; I563-V574 HydrophobicContact CD1-CG1 3.61Å; I563-V574 HydrophobicContact CD1-CG2 4Å; L569-V574 HydrophobicContact CD1-CG2 4.21Å; L569-V574 HydrophobicContact CD2-CG2 4.19Å; L569-V574 HydrophobicContact CG-CG2 4.24Å; Q570-V574 PolarHBondContact O-N 3.18Å; A571-V574 WeakPolarHBondContact O-CB 3.44Å; A571-V574 PolarHBondContact O-N 2.84Å; V574-T576 PolarHBondContact O-N 2.85Å; V574-R577 PolarHBondContact O-N 2.92Å; V574-F578 HydrophobicContact CG1-CD2 4.44Å; V574-F578 HydrophobicContact CG1-CE2 4.41Å; V574-F578 WeakPolarHBondContact O-CD2 3.46Å; V574-F578 PolarHBondContact O-N 3.11Å; V574-L594 HydrophobicContact CB-CD2 4.17Å; V574-L594 HydrophobicContact CG1-CD1 4.38Å; V574-L594 HydrophobicContact CG1-CD2 4Å; V574-L594 HydrophobicContact CG2-CD2 4.48Å; V574-M612 HydrophobicContact CG2-CG 4.07Å
575	L	89.9	Confident	84.6	Confident	8 Å²	8	52.9 Å²	52.9	4%	0.042	30%	0.299	C	S	.	.	H	α-helix	trans	-61.7	-43.7	178.3	-176	62.5	0	0	0	111.9	A571 S572 D573 R577 F578 L579 K589 L592 I626	A571-L575 PolarHBondContact O-N 2.92Å; A571-L575 VanDerWaalsContact O-N 3.16Å; S572-L575 PolarHBondContact O-N 3.14Å; D573-L575 VanDerWaalsContact C-N 3.34Å; D573-L575 PolarHBondContact O-N 2.99Å; L575-R577 VanDerWaalsContact C-N 3.29Å; L575-R577 PolarHBondContact O-N 2.66Å; L575-F578 PolarHBondContact O-N 3.3Å; L575-F578 VanDerWaalsContact O-N 3.16Å; L575-L579 HydrophobicContact CD1-CD1 4.49Å; L575-L579 HydrophobicContact CG-CD1 4.07Å; L575-L579 PolarHBondContact O-N 3.46Å; L575-K589 HydrophobicContact CD2-CG 3.86Å; L575-L592 HydrophobicContact CD1-CB 3.75Å; L575-L592 HydrophobicContact CD1-CD1 4.09Å; L575-L592 HydrophobicContact CD2-CB 4.24Å; L575-I626 HydrophobicContact CD1-CD1 4.24Å; L575-I626 HydrophobicContact CD1-CG2 3.79Å
576	T	89.9	Confident	83.2	Confident	62 Å²	62	57.5 Å²	57.5	38%	0.38	33%	0.333	S	S	.	.	H	α-helix	trans	-64.1	-33.5	179.3	-55.1	0	0	0	0	112.1	S572 D573 V574 S580 K589	S572-T576 WeakPolarHBondContact O-CB 3.48Å; S572-T576 PolarHBondContact O-N 3.48Å; S572-T576 PolarHBondContact O-OG1 3.18Å; D573-T576 PolarHBondContact O-N 2.99Å; V574-T576 PolarHBondContact O-N 2.85Å; T576-S580 WeakPolarHBondContact O-CB 3.37Å; T576-S580 PolarHBondContact O-N 2.87Å; T576-S580 PolarHBondContact O-OG 3.27Å; T576-K589 PolarHBondContact OG1-NZ 2.64Å
577	R	89	Confident	82.1	Confident	101 Å²	101	57.9 Å²	57.9	38%	0.381	34%	0.335	S	S	.	.	H	α-helix	trans	-66.8	-34.6	173.8	-73.9	177.7	-171.8	-176.8	5.7	113.1	M561 D573 V574 L575 S580 Q581	M561-R577 HydrophobicContact CE-CB 3.98Å; D573-R577 VanDerWaalsContact O-CG 3.31Å; D573-R577 WeakPolarHBondContact O-CG 3.41Å; D573-R577 PolarHBondContact O-N 3.13Å; V574-R577 PolarHBondContact O-N 2.92Å; L575-R577 VanDerWaalsContact C-N 3.29Å; L575-R577 PolarHBondContact O-N 2.66Å; R577-S580 PolarHBondContact O-OG 3.03Å; R577-Q581 WeakPolarHBondContact O-CG 3.25Å
578	F	86.9	Confident	81.2	Confident	3 Å²	3	59 Å²	59	1%	0.013	34%	0.339	C	S	.	.	H	α-helix	trans	-73.1	-45.2	174.8	-87.5	-90.4	0	0	0	111.8	V551 A553 F556 M561 I563 V574 L575 S580 Q581 D582 I626	V551-F578 HydrophobicContact CB-CE2 3.85Å; V551-F578 HydrophobicContact CB-CZ 4.06Å; V551-F578 HydrophobicContact CG1-CE2 3.61Å; V551-F578 HydrophobicContact CG1-CZ 3.95Å; A553-F578 HydrophobicContact CB-CD1 3.7Å; A553-F578 HydrophobicContact CB-CE1 3.42Å; A553-F578 VanDerWaalsContact CB-CE1 3.42Å; A553-F578 HydrophobicContact CB-CG 4.47Å; A553-F578 HydrophobicContact CB-CZ 3.98Å; F556-F578 HydrophobicContact CE1-CB 4.24Å; F556-F578 HydrophobicContact CG-CD1 4.4Å; F556-F578 HydrophobicContact CZ-CB 4.3Å; M561-F578 HydrophobicContact CB-CE1 4.11Å; M561-F578 HydrophobicContact CB-CE2 4.09Å; M561-F578 HydrophobicContact CB-CZ 3.52Å; M561-F578 HydrophobicContact CE-CD2 3.61Å; M561-F578 HydrophobicContact CE-CE2 3.47Å; M561-F578 VanDerWaalsContact CE-CE2 3.47Å; M561-F578 HydrophobicContact CE-CG 4.26Å; M561-F578 HydrophobicContact CE-CZ 3.99Å; I563-F578 HydrophobicContact CD1-CE2 4.27Å; V574-F578 HydrophobicContact CG1-CD2 4.44Å; V574-F578 HydrophobicContact CG1-CE2 4.41Å; V574-F578 WeakPolarHBondContact O-CD2 3.46Å; V574-F578 PolarHBondContact O-N 3.11Å; L575-F578 PolarHBondContact O-N 3.3Å; L575-F578 VanDerWaalsContact O-N 3.16Å; F578-S580 VanDerWaalsContact C-N 3.31Å; F578-S580 PolarHBondContact O-N 3.01Å; F578-Q581 PolarHBondContact O-N 3.27Å; F578-D582 PolarHBondContact O-N 3.19Å; F578-I626 HydrophobicContact CB-CD1 4.06Å; F578-I626 HydrophobicContact CD1-CD1 4.34Å; F578-I626 HydrophobicContact CD2-CD1 3.33Å; F578-I626 HydrophobicContact CE2-CD1 3.71Å; F578-I626 HydrophobicContact CG-CD1 3.67Å; F578-I626 HydrophobicContact CZ-CD1 4.37Å
579	L	85	Confident	80.4	Confident	42 Å²	42	57.6 Å²	57.6	22%	0.22	33%	0.327	C	S	.	.	H	α-helix	trans	-63	-34.5	179.4	-70.9	169.6	0	0	0	113.1	F556 L575 Q581 K589 L592	F556-L579 HydrophobicContact CE1-CD2 4.02Å; F556-L579 HydrophobicContact CZ-CD2 3.95Å; F556-L579 HydrophobicContact CZ-CG 4.48Å; L575-L579 HydrophobicContact CD1-CD1 4.49Å; L575-L579 HydrophobicContact CG-CD1 4.07Å; L575-L579 PolarHBondContact O-N 3.46Å; L579-Q581 VanDerWaalsContact C-N 3.33Å; L579-K589 HydrophobicContact CD1-CB 3.7Å; L579-K589 HydrophobicContact CD1-CD 4.17Å; L579-K589 HydrophobicContact CD1-CG 3.73Å; L579-L592 HydrophobicContact CD2-CD1 4.13Å
580	S	83.8	Confident	79.6	Confident	94 Å²	94	64 Å²	64	66%	0.657	36%	0.357	S	S	*	.	H	α-helix	trans	-73.9	-22.4	178.8	57.5	0	0	0	0	114.1	T576 R577 F578	T576-S580 WeakPolarHBondContact O-CB 3.37Å; T576-S580 PolarHBondContact O-N 2.87Å; T576-S580 PolarHBondContact O-OG 3.27Å; R577-S580 PolarHBondContact O-OG 3.03Å; F578-S580 VanDerWaalsContact C-N 3.31Å; F578-S580 PolarHBondContact O-N 3.01Å
581	Q	77.3	Confident	79.1	Confident	106 Å²	106	64.6 Å²	64.6	50%	0.495	36%	0.361	S	S	.	.	H	α-helix	trans	-89	-16.1	179.8	-71.1	-178.3	15	0	0	113.2	R577 F578 L579	R577-Q581 WeakPolarHBondContact O-CG 3.25Å; F578-Q581 PolarHBondContact O-N 3.27Å; L579-Q581 VanDerWaalsContact C-N 3.33Å
582	D	69	Low	78.8	Confident	12 Å²	12	64.9 Å²	64.9	6%	0.064	36%	0.362	C	S	.	.			trans	-127.4	85.3	-175.6	-156.1	-20.9	0	0	0	110.9	F556 S557 F578 S584 V585	F556-D582 HydrophobicContact CD1-CB 3.76Å; F556-D582 HydrophobicContact CE1-CB 4.38Å; S557-D582 WeakPolarHBondContact CB-OD2 3.33Å; S557-D582 PolarHBondContact N-OD2 3.25Å; S557-D582 VanDerWaalsContact OG-CG 3.26Å; S557-D582 PolarHBondContact OG-OD2 3.43Å; F578-D582 PolarHBondContact O-N 3.19Å; D582-S584 PolarHBondContact O-N 2.8Å; D582-S584 VanDerWaalsContact O-N 3.15Å; D582-S584 WeakPolarHBondContact OD1-CB 3.28Å; D582-S584 PolarHBondContact OD1-N 2.94Å; D582-S584 PolarHBondContact OD1-OG 3.09Å; D582-V585 HydrophobicContact CB-CG2 4.09Å
583	S	61.1	Low	78.7	Confident	131 Å²	131	64.5 Å²	64.5	92%	0.916	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-2.5	176.9	56.8	0	0	0	0	113.7
584	S	59.3	Low	78.8	Confident	93 Å²	93	61.8 Å²	61.8	65%	0.65	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-12.7	-175.6	78.3	0	0	0	0	114.4	D582 S586	D582-S584 PolarHBondContact O-N 2.8Å; D582-S584 VanDerWaalsContact O-N 3.15Å; D582-S584 WeakPolarHBondContact OD1-CB 3.28Å; D582-S584 PolarHBondContact OD1-N 2.94Å; D582-S584 PolarHBondContact OD1-OG 3.09Å; S584-S586 PolarHBondContact O-N 3.47Å
585	V	59.5	Low	78.9	Confident	33 Å²	33	62.7 Å²	62.7	20%	0.2	35%	0.349	C	S	.	.			trans	-84.3	113.5	-176.3	-176.2	0	0	0	0	110.1	F556 D582 V587	F556-V585 HydrophobicContact CD1-CG2 3.73Å; F556-V585 HydrophobicContact CE1-CB 4.35Å; F556-V585 HydrophobicContact CE1-CG1 4.43Å; F556-V585 HydrophobicContact CE1-CG2 4Å; F556-V585 HydrophobicContact CG-CG2 4.39Å; D582-V585 HydrophobicContact CB-CG2 4.09Å; V585-V587 HydrophobicContact CG1-CB 3.74Å; V585-V587 HydrophobicContact CG1-CG2 3.65Å; V585-V587 PolarHBondContact O-N 3.14Å; V585-V587 VanDerWaalsContact O-N 3.14Å
586	S	63	Low	79.2	Confident	124 Å²	124	62.3 Å²	62.3	87%	0.867	35%	0.347	S	S	*	.			trans	-76.5	12.3	178.3	64.6	0	0	0	0	114.3	S584	S584-S586 PolarHBondContact O-N 3.47Å
587	V	67.4	Low	79.4	Confident	54 Å²	54	61 Å²	61	33%	0.327	34%	0.337	S	S	.	.			trans	-91.1	131	-175.7	-174.8	0	0	0	0	109.1	V585 D591 L592	V585-V587 HydrophobicContact CG1-CB 3.74Å; V585-V587 HydrophobicContact CG1-CG2 3.65Å; V585-V587 PolarHBondContact O-N 3.14Å; V585-V587 VanDerWaalsContact O-N 3.14Å; V587-D591 HydrophobicContact CG1-CB 3.92Å; V587-L592 HydrophobicContact CG1-CD1 4.22Å; V587-L592 HydrophobicContact CG1-CD2 4.01Å; V587-L592 HydrophobicContact CG1-CG 3.87Å
588	K	72.7	Confident	79.4	Confident	133 Å²	133	57.3 Å²	57.3	58%	0.578	33%	0.33	S	S	*	.			trans	-71.1	147.7	179	-61.5	179.1	178.5	-179.3	0	109.9	E590 D591	K588-E590 PolarHBondContact O-N 2.9Å; K588-E590 VanDerWaalsContact O-N 3.16Å; K588-D591 PolarHBondContact O-N 3.32Å
589	K	75.4	Confident	79.5	Confident	82 Å²	82	57.7 Å²	57.7	36%	0.357	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-52.3	-37.6	174.8	-178.5	175.7	171.9	175.4	0	112	L575 T576 L579 D591 L592	L575-K589 HydrophobicContact CD2-CG 3.86Å; T576-K589 PolarHBondContact OG1-NZ 2.64Å; L579-K589 HydrophobicContact CD1-CB 3.7Å; L579-K589 HydrophobicContact CD1-CD 4.17Å; L579-K589 HydrophobicContact CD1-CG 3.73Å; K589-D591 PolarHBondContact O-N 2.92Å; K589-L592 PolarHBondContact O-N 3.01Å
590	E	77.9	Confident	79.9	Confident	135 Å²	135	56.6 Å²	56.6	63%	0.631	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-65.1	-14.2	-179.8	-62.8	147.4	-144.8	0	0	114.5	K588 R631	K588-E590 PolarHBondContact O-N 2.9Å; K588-E590 VanDerWaalsContact O-N 3.16Å; E590-R631 PolarHBondContact O-NH2 3.44Å
591	D	83.3	Confident	80.4	Confident	58 Å²	58	52.1 Å²	52.1	31%	0.31	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-101.5	-0.2	-178.3	-59.5	-34.4	0	0	0	112	V587 K588 K589 A628 V629 R631	V587-D591 HydrophobicContact CG1-CB 3.92Å; K588-D591 PolarHBondContact O-N 3.32Å; K589-D591 PolarHBondContact O-N 2.92Å; D591-A628 CarbonylContact O-C 3.5Å; D591-A628 WeakPolarHBondContact O-CA 3.37Å; D591-V629 PolarHBondContact O-N 3.32Å; D591-R631 IonicContact OD1-NH2 2.67Å
592	L	87.7	Confident	81.1	Confident	11 Å²	11	51.4 Å²	51.4	6%	0.058	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137	-177.5	-65	175.9	0	0	0	111.5	Q555 F556 L575 L579 V587 K589 I626 K627	Q555-L592 HydrophobicContact CG-CD2 4.45Å; F556-L592 HydrophobicContact CE2-CD1 3.92Å; F556-L592 HydrophobicContact CZ-CD1 3.61Å; L575-L592 HydrophobicContact CD1-CB 3.75Å; L575-L592 HydrophobicContact CD1-CD1 4.09Å; L575-L592 HydrophobicContact CD2-CB 4.24Å; L579-L592 HydrophobicContact CD2-CD1 4.13Å; V587-L592 HydrophobicContact CG1-CD1 4.22Å; V587-L592 HydrophobicContact CG1-CD2 4.01Å; V587-L592 HydrophobicContact CG1-CG 3.87Å; K589-L592 PolarHBondContact O-N 3.01Å; L592-I626 HydrophobicContact CB-CG2 4.29Å; L592-I626 HydrophobicContact CD2-CG2 4.47Å; L592-K627 WeakPolarHBondContact CA-O 3.24Å
593	C	90.7	Very high	82.3	Confident	11 Å²	11	53.1 Å²	53.1	7%	0.074	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	150.3	172.9	178.4	0	0	0	0	110.3	Y595 C605 L606 I626 K627 V629	C593-Y595 HydrophobicContact CB-CD2 4.36Å; C593-Y595 HydrophobicContact CB-CE2 3.73Å; C593-Y595 WeakPolarHBondContact O-CD2 3.38Å; C593-C605 HydrophobicContact CB-CB 4.4Å; C593-C605 WeakPolarHBondContact CB-SG 3.47Å; C593-C605 WeakPolarHBondContact SG-CB 3.26Å; C593-C605 CovalentContact SG-SG 2.06Å; C593-C605 PolarHBondContact SG-SG 2.91Å; C593-L606 PolarHBondContact SG-N 2.82Å; C593-L606 VanDerWaalsContact SG-N 3.4Å; C593-L606 PolarHBondContact SG-O 3.49Å; C593-I626 WeakPolarHBondContact O-CA 3.25Å; C593-K627 PolarHBondContact N-O 3.19Å; C593-K627 PolarHBondContact O-N 2.97Å; C593-V629 HydrophobicContact CB-CG2 3.84Å
594	L	94	Very high	84	Confident	5 Å²	5	46.9 Å²	46.9	3%	0.026	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	130.9	168.2	-177	63.5	0	0	0	109.1	V551 A571 V574 L606 M612 W624 I626	V551-L594 HydrophobicContact CG1-CD1 3.85Å; A571-L594 HydrophobicContact CB-CD2 4.13Å; V574-L594 HydrophobicContact CB-CD2 4.17Å; V574-L594 HydrophobicContact CG1-CD1 4.38Å; V574-L594 HydrophobicContact CG1-CD2 4Å; V574-L594 HydrophobicContact CG2-CD2 4.48Å; L594-L606 HydrophobicContact CB-CD1 4.46Å; L594-L606 HydrophobicContact CD2-CD1 4.02Å; L594-L606 HydrophobicContact CG-CD1 4.01Å; L594-L606 VanDerWaalsContact O-CB 3.32Å; L594-L606 WeakPolarHBondContact O-CB 3.46Å; L594-L606 WeakPolarHBondContact O-CG 3.5Å; L594-L606 PolarHBondContact O-N 3.26Å; L594-M612 HydrophobicContact CD2-CE 3.59Å; L594-M612 HydrophobicContact CD2-SD 3.68Å; L594-W624 HydrophobicContact CD1-CB 4.43Å; L594-I626 HydrophobicContact CD1-CG1 3.76Å
595	Y	94.8	Very high	85.6	Confident	19 Å²	19	43.2 Å²	43.2	8%	0.075	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	138.7	-179.4	-70.3	-103.8	0	0	0	111.1	C593 E603 R604 C605 W624 V625 K627	C593-Y595 HydrophobicContact CB-CD2 4.36Å; C593-Y595 HydrophobicContact CB-CE2 3.73Å; C593-Y595 WeakPolarHBondContact O-CD2 3.38Å; Y595-E603 HydrophobicContact CD1-CG 3.75Å; Y595-E603 HydrophobicContact CE1-CG 4.38Å; Y595-R604 CarbonylContact C-O 3.05Å; Y595-R604 VanDerWaalsContact CA-O 3.27Å; Y595-R604 WeakPolarHBondContact CA-O 3.37Å; Y595-C605 HydrophobicContact CD1-CB 3.99Å; Y595-C605 HydrophobicContact CE1-CB 3.57Å; Y595-C605 HydrophobicContact CE2-CB 4.44Å; Y595-W624 WeakPolarHBondContact O-CA 3.35Å; Y595-V625 WeakPolarHBondContact CA-O 3.36Å; Y595-V625 WeakPolarHBondContact CB-O 3.45Å; Y595-V625 PolarHBondContact N-O 2.84Å; Y595-V625 PolarHBondContact O-N 3.26Å; Y595-K627 HydrophobicContact CD2-CB 3.8Å; Y595-K627 HydrophobicContact CD2-CD 4.16Å; Y595-K627 HydrophobicContact CD2-CG 3.99Å; Y595-K627 HydrophobicContact CE2-CB 3.64Å; Y595-K627 HydrophobicContact CE2-CD 4.43Å; Y595-K627 HydrophobicContact CE2-CG 4.3Å; Y595-K627 HydrophobicContact CG-CD 4.37Å
596	E	95.3	Very high	87.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	119.8	164.6	179.8	-166.8	-178.7	0	0	108.4	R505 I601 E603 R604 L606 L615 N619 A622 W624	R505-E596 IonicContact CZ-OE1 3.29Å; R505-E596 IonicContact CZ-OE2 3.65Å; R505-E596 IonicContact NH1-OE1 2.75Å; R505-E596 PolarHBondContact NH1-OE1 3.24Å; R505-E596 IonicContact NH1-OE2 3.39Å; R505-E596 IonicContact NH2-OE1 2.92Å; R505-E596 PolarHBondContact NH2-OE1 3.09Å; R505-E596 IonicContact NH2-OE2 2.8Å; R505-E596 PolarHBondContact NH2-OE2 3.17Å; E596-I601 HydrophobicContact CB-CG2 4.47Å; E596-I601 HydrophobicContact CG-CG2 3.76Å; E596-E603 CarbonylContact O-C 3.52Å; E596-E603 WeakPolarHBondContact O-CA 3.14Å; E596-R604 HydrophobicContact CB-CB 4.46Å; E596-R604 PolarHBondContact N-O 2.88Å; E596-R604 PolarHBondContact O-N 3.41Å; E596-R604 IonicContact OE2-NH1 2.86Å; E596-L606 HydrophobicContact CB-CD1 4.48Å; E596-L606 HydrophobicContact CB-CD2 3.93Å; E596-L606 HydrophobicContact CB-CG 4.41Å; E596-L615 HydrophobicContact CB-CD2 4.5Å; E596-N619 WeakPolarHBondContact OE1-CB 3.38Å; E596-N619 PolarHBondContact OE1-ND2 2.92Å; E596-A622 HydrophobicContact CG-CB 3.85Å; E596-W624 HydrophobicContact CB-CE3 4.31Å; E596-W624 HydrophobicContact CB-CZ3 3.88Å; E596-W624 HydrophobicContact CG-CH2 4.29Å; E596-W624 HydrophobicContact CG-CZ3 3.92Å
597	I	93.6	Very high	88.7	Confident	33 Å²	33	38.1 Å²	38.1	17%	0.169	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	132.7	-173.7	-55.9	-177.1	0	0	0	110.1	K602 E603 E623 V625	I597-K602 WeakPolarHBondContact CA-O 3.31Å; I597-K602 WeakPolarHBondContact CG2-O 3.09Å; I597-E603 HydrophobicContact CD1-CG 4.47Å; I597-E603 HydrophobicContact CG1-CB 4.45Å; I597-E603 HydrophobicContact CG1-CG 4.14Å; I597-E623 PolarHBondContact N-O 3.34Å; I597-E623 PolarHBondContact O-N 3.47Å; I597-V625 HydrophobicContact CD1-CB 4Å; I597-V625 HydrophobicContact CD1-CG2 3.84Å
598	G	89.6	Confident	89.8	Confident	24 Å²	24	41 Å²	41	25%	0.247	20%	0.204	C	C	.	.	S	Bend	trans	78	-172.5	176.3	0	0	0	0	0	114.7	N600 I601 K602 N619	G598-N600 PolarHBondContact O-N 2.94Å; G598-I601 CarbonylContact C-O 3.56Å; G598-I601 WeakPolarHBondContact CA-O 3.42Å; G598-I601 PolarHBondContact N-O 2.81Å; G598-I601 VanDerWaalsContact N-O 3.13Å; G598-I601 PolarHBondContact O-N 3.21Å; G598-K602 PolarHBondContact N-O 2.86Å; G598-N619 PolarHBondContact O-ND2 3.41Å
599	G	89.3	Confident	90.8	Very high	12 Å²	12	38.7 Å²	38.7	12%	0.124	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	-124.2	-168.2	0	0	0	0	0	111.3	Q512 N619	Q512-G599 VanDerWaalsContact CD-O 3.3Å; Q512-G599 PolarHBondContact NE2-O 3.35Å; Q512-G599 PolarHBondContact OE1-O 3.05Å; G599-N619 WeakPolarHBondContact CA-OD1 3.45Å
600	N	92.8	Very high	91.6	Very high	18 Å²	18	34.8 Å²	34.8	10%	0.096	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	3.5	-178.6	67.1	22	0	0	0	114.5	R505 N508 M509 G598 L618 N619	R505-N600 VanDerWaalsContact CA-O 3.26Å; R505-N600 WeakPolarHBondContact CA-O 3.25Å; R505-N600 HydrophobicContact CB-CB 4.27Å; R505-N600 PolarHBondContact NH1-OD1 3.03Å; N508-N600 WeakPolarHBondContact CB-O 3.41Å; N508-N600 PolarHBondContact ND2-O 2.8Å; N508-N600 VanDerWaalsContact ND2-O 3.17Å; M509-N600 HydrophobicContact CB-CB 4.36Å; G598-N600 PolarHBondContact O-N 2.94Å; N600-L618 PolarHBondContact ND2-O 2.84Å; N600-N619 PolarHBondContact N-OD1 3.11Å; N600-N619 WeakPolarHBondContact OD1-CB 3.25Å; N600-N619 PolarHBondContact OD1-ND2 3.45Å; N600-N619 PolarHBondContact OD1-OD1 3.37Å
601	I	95	Very high	92.5	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.162	C	C	.	.			trans	-129.1	154.5	169.2	-159.9	66	0	0	0	108.8	L251 D255 L501 V504 R505 E596 G598 R604	L251-I601 HydrophobicContact CD2-CD1 4.22Å; L251-I601 HydrophobicContact CD2-CG1 4.41Å; D255-I601 HydrophobicContact CB-CD1 4.45Å; D255-I601 WeakPolarHBondContact OD2-CD1 3.44Å; L501-I601 HydrophobicContact CD1-CD1 4.12Å; V504-I601 HydrophobicContact CG1-CD1 4.14Å; R505-I601 HydrophobicContact CG-CD1 4.41Å; E596-I601 HydrophobicContact CB-CG2 4.47Å; E596-I601 HydrophobicContact CG-CG2 3.76Å; G598-I601 CarbonylContact C-O 3.56Å; G598-I601 WeakPolarHBondContact CA-O 3.42Å; G598-I601 PolarHBondContact N-O 2.81Å; G598-I601 VanDerWaalsContact N-O 3.13Å; G598-I601 PolarHBondContact O-N 3.21Å; I601-R604 HydrophobicContact CG1-CB 4.17Å
602	K	93	Very high	93	Very high	90 Å²	90	29.1 Å²	29.1	39%	0.391	15%	0.147	S	C	.	.	S	Bend	trans	-79.5	-58.1	175	-60.2	-63.1	-176.7	178.9	0	110.1	S252 L254 D255 I597 G598	S252-K602 WeakPolarHBondContact OG-CB 3.21Å; L254-K602 HydrophobicContact CB-CG 4.47Å; D255-K602 WeakPolarHBondContact OD2-CA 3.34Å; D255-K602 WeakPolarHBondContact OD2-CB 3.49Å; D255-K602 PolarHBondContact OD2-N 3.26Å; I597-K602 WeakPolarHBondContact CA-O 3.31Å; I597-K602 WeakPolarHBondContact CG2-O 3.09Å; G598-K602 PolarHBondContact N-O 2.86Å
603	E	94.1	Very high	93.3	Very high	48 Å²	48	31.3 Å²	31.3	22%	0.224	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	135	176	176.9	172.5	-110	0	0	109	S252 Y595 E596 I597 K627	S252-E603 PolarHBondContact N-O 3.43Å; Y595-E603 HydrophobicContact CD1-CG 3.75Å; Y595-E603 HydrophobicContact CE1-CG 4.38Å; E596-E603 CarbonylContact O-C 3.52Å; E596-E603 WeakPolarHBondContact O-CA 3.14Å; I597-E603 HydrophobicContact CD1-CG 4.47Å; I597-E603 HydrophobicContact CG1-CB 4.45Å; I597-E603 HydrophobicContact CG1-CG 4.14Å; E603-K627 IonicContact OE1-NZ 4Å; E603-K627 PolarHBondContact OE1-NZ 2.68Å
604	R	95.2	Very high	93.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	123.2	177.2	176.7	-179.5	175.6	-138.5	-1.5	110.6	T243 G244 Q245 T246 D250 L251 Y595 E596 I601 L606	T243-R604 PolarHBondContact O-NH1 3.15Å; T243-R604 VanDerWaalsContact O-NH1 3.13Å; T243-R604 PolarHBondContact O-NH2 3.42Å; G244-R604 PolarHBondContact O-NH2 2.98Å; Q245-R604 PolarHBondContact O-NH2 2.91Å; T246-R604 PolarHBondContact OG1-NE 3.3Å; T246-R604 PolarHBondContact OG1-NH2 3.1Å; D250-R604 CarbonylContact O-C 3.48Å; D250-R604 WeakPolarHBondContact O-CA 3.3Å; L251-R604 HydrophobicContact CD2-CB 3.76Å; L251-R604 HydrophobicContact CD2-CG 3.78Å; Y595-R604 CarbonylContact C-O 3.05Å; Y595-R604 VanDerWaalsContact CA-O 3.27Å; Y595-R604 WeakPolarHBondContact CA-O 3.37Å; E596-R604 HydrophobicContact CB-CB 4.46Å; E596-R604 PolarHBondContact N-O 2.88Å; E596-R604 PolarHBondContact O-N 3.41Å; E596-R604 IonicContact OE2-NH1 2.86Å; I601-R604 HydrophobicContact CG1-CB 4.17Å; R604-L606 HydrophobicContact CG-CD2 4.21Å
605	C	94.4	Very high	93.3	Very high	17 Å²	17	32.3 Å²	32.3	12%	0.115	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	133.4	163.5	170	0	0	0	0	109.1	D250 C593 Y595	D250-C605 HydrophobicContact CB-CB 4.25Å; D250-C605 PolarHBondContact O-N 3.2Å; C593-C605 HydrophobicContact CB-CB 4.4Å; C593-C605 WeakPolarHBondContact CB-SG 3.47Å; C593-C605 WeakPolarHBondContact SG-CB 3.26Å; C593-C605 CovalentContact SG-SG 2.06Å; C593-C605 PolarHBondContact SG-SG 2.91Å; Y595-C605 HydrophobicContact CD1-CB 3.99Å; Y595-C605 HydrophobicContact CE1-CB 3.57Å; Y595-C605 HydrophobicContact CE2-CB 4.44Å
606	L	94.5	Very high	93.2	Very high	9 Å²	9	32.4 Å²	32.4	5%	0.047	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-92.5	138.5	-174.9	-58.5	-177.8	0	0	0	111.4	A571 C593 L594 E596 R604 M612 L615 W624	A571-L606 HydrophobicContact CB-CB 4.28Å; C593-L606 PolarHBondContact SG-N 2.82Å; C593-L606 VanDerWaalsContact SG-N 3.4Å; C593-L606 PolarHBondContact SG-O 3.49Å; L594-L606 HydrophobicContact CB-CD1 4.46Å; L594-L606 HydrophobicContact CD2-CD1 4.02Å; L594-L606 HydrophobicContact CG-CD1 4.01Å; L594-L606 VanDerWaalsContact O-CB 3.32Å; L594-L606 WeakPolarHBondContact O-CB 3.46Å; L594-L606 WeakPolarHBondContact O-CG 3.5Å; L594-L606 PolarHBondContact O-N 3.26Å; E596-L606 HydrophobicContact CB-CD1 4.48Å; E596-L606 HydrophobicContact CB-CD2 3.93Å; E596-L606 HydrophobicContact CB-CG 4.41Å; R604-L606 HydrophobicContact CG-CD2 4.21Å; L606-M612 HydrophobicContact CD1-CE 4.22Å; L606-M612 HydrophobicContact CD1-SD 4.16Å; L606-L615 HydrophobicContact CD1-CD2 3.67Å; L606-L615 HydrophobicContact CD2-CD2 3.44Å; L606-L615 VanDerWaalsContact CD2-CD2 3.44Å; L606-L615 HydrophobicContact CG-CD2 4.2Å; L606-W624 HydrophobicContact CD1-CE3 4.24Å; L606-W624 HydrophobicContact CD1-CZ3 3.96Å
607	D	92.6	Very high	93	Very high	41 Å²	41	38.7 Å²	38.7	22%	0.219	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-63.3	144	168.2	-177.4	38.6	0	0	0	110.4	Q245 E609 T610	Q245-D607 PolarHBondContact N-OD2 3.19Å; D607-E609 PolarHBondContact O-N 3.45Å; D607-T610 PolarHBondContact N-OG1 3.18Å; D607-T610 WeakPolarHBondContact O-CB 3.48Å; D607-T610 PolarHBondContact O-N 3.27Å; D607-T610 PolarHBondContact O-OG1 2.64Å
608	E	91.2	Very high	93	Very high	115 Å²	115	40.5 Å²	40.5	54%	0.537	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-32.1	-173	-73	-167.6	171.5	0	0	113	S572 T610	S572-E608 WeakPolarHBondContact CB-O 3.48Å; S572-E608 PolarHBondContact N-O 2.7Å; S572-E608 VanDerWaalsContact N-O 3.11Å; S572-E608 PolarHBondContact OG-O 2.67Å; E608-T610 VanDerWaalsContact C-N 3.28Å; E608-T610 PolarHBondContact O-N 3.12Å
609	E	91.9	Very high	93.1	Very high	84 Å²	84	39.5 Å²	39.5	39%	0.393	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	3.8	-179.9	-59.4	-175.4	174.5	0	0	113.1	R240 D607 Y611	R240-E609 IonicContact CZ-OE1 3.51Å; R240-E609 IonicContact CZ-OE2 2.93Å; R240-E609 IonicContact NH1-OE1 3.58Å; R240-E609 PolarHBondContact NH1-OE1 2.97Å; R240-E609 IonicContact NH1-OE2 3.67Å; R240-E609 PolarHBondContact NH1-OE2 3.07Å; D607-E609 PolarHBondContact O-N 3.45Å; E609-Y611 PolarHBondContact O-N 3.39Å
610	T	93.7	Very high	93.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.221	C	C	.	.			trans	-66.8	124.5	-178.2	-57	0	0	0	0	111.5	G244 Q570 A571 D607 E608 M612 L615	G244-T610 WeakPolarHBondContact CA-OG1 3.49Å; Q570-T610 CarbonylContact C-O 3.46Å; Q570-T610 VanDerWaalsContact CA-O 3.24Å; Q570-T610 WeakPolarHBondContact CA-O 3.45Å; A571-T610 PolarHBondContact N-O 3.48Å; D607-T610 PolarHBondContact N-OG1 3.18Å; D607-T610 WeakPolarHBondContact O-CB 3.48Å; D607-T610 PolarHBondContact O-N 3.27Å; D607-T610 PolarHBondContact O-OG1 2.64Å; E608-T610 VanDerWaalsContact C-N 3.28Å; E608-T610 PolarHBondContact O-N 3.12Å; T610-M612 PolarHBondContact O-N 2.96Å; T610-L615 HydrophobicContact CG2-CB 4.21Å; T610-L615 HydrophobicContact CG2-CD2 3.79Å
611	Y	95.2	Very high	93	Very high	74 Å²	74	46.6 Å²	46.6	29%	0.29	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-78.9	118.3	174.5	-67.7	-89	0	0	0	110.6	K242 E567 Q570 E609 K613 D614 L615	K242-Y611 HydrophobicContact CB-CD2 3.9Å; K242-Y611 HydrophobicContact CB-CG 4.46Å; K242-Y611 HydrophobicContact CG-CD2 4.12Å; K242-Y611 HydrophobicContact CG-CE2 4.49Å; K242-Y611 WeakPolarHBondContact O-CD2 3.38Å; K242-Y611 PolarHBondContact O-N 3.28Å; E567-Y611 VanDerWaalsContact O-CD1 3.3Å; E567-Y611 WeakPolarHBondContact O-CD1 3.28Å; Q570-Y611 HydrophobicContact CG-CD1 4.19Å; Q570-Y611 HydrophobicContact CG-CE1 4.06Å; Q570-Y611 PolarHBondContact NE2-OH 3Å; E609-Y611 PolarHBondContact O-N 3.39Å; Y611-K613 VanDerWaalsContact C-N 3.3Å; Y611-K613 PolarHBondContact O-N 3.35Å; Y611-D614 VanDerWaalsContact CB-OD2 3.3Å; Y611-D614 WeakPolarHBondContact CB-OD2 3.47Å; Y611-D614 PolarHBondContact O-N 3.09Å; Y611-L615 PolarHBondContact O-N 2.59Å; Y611-L615 VanDerWaalsContact O-N 3.15Å
612	M	94.6	Very high	92.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-68.2	-30.2	-171.9	-63.5	-54.5	-58	0	0	112.7	I549 L565 L569 A571 V574 L594 L606 T610 S616 W624	I549-M612 HydrophobicContact CD1-CB 4.47Å; I549-M612 HydrophobicContact CD1-CE 3.82Å; L565-M612 HydrophobicContact CD2-CB 3.82Å; L569-M612 HydrophobicContact CD2-CB 4Å; L569-M612 HydrophobicContact CD2-CG 4.17Å; L569-M612 HydrophobicContact CG-CB 4.28Å; L569-M612 HydrophobicContact CG-CG 4.15Å; L569-M612 PolarHBondContact O-N 2.83Å; A571-M612 HydrophobicContact CB-SD 3.97Å; V574-M612 HydrophobicContact CG2-CG 4.07Å; L594-M612 HydrophobicContact CD2-CE 3.59Å; L594-M612 HydrophobicContact CD2-SD 3.68Å; L606-M612 HydrophobicContact CD1-CE 4.22Å; L606-M612 HydrophobicContact CD1-SD 4.16Å; T610-M612 PolarHBondContact O-N 2.96Å; M612-S616 WeakPolarHBondContact O-CB 3.16Å; M612-S616 PolarHBondContact O-N 3.34Å; M612-W624 HydrophobicContact CE-CD2 3.91Å; M612-W624 HydrophobicContact CE-CE3 3.47Å; M612-W624 VanDerWaalsContact CE-CE3 3.47Å; M612-W624 HydrophobicContact CE-CH2 4.11Å; M612-W624 HydrophobicContact CE-CZ3 3.59Å
613	K	93.1	Very high	92.8	Very high	57 Å²	57	48.3 Å²	48.3	25%	0.248	26%	0.255	C	S	.	.	H	α-helix	trans	-67.6	-51.5	178.7	-173.5	178.4	-178.1	178.2	0	111.6	L565 E567 Y611 L615 S616 Q617	L565-K613 HydrophobicContact CB-CB 4.48Å; E567-K613 WeakPolarHBondContact OE1-CE 3.32Å; E567-K613 IonicContact OE1-NZ 3.73Å; E567-K613 PolarHBondContact OE1-NZ 3.23Å; Y611-K613 VanDerWaalsContact C-N 3.3Å; Y611-K613 PolarHBondContact O-N 3.35Å; K613-L615 VanDerWaalsContact C-N 3.32Å; K613-L615 PolarHBondContact O-N 3.48Å; K613-S616 PolarHBondContact O-N 2.82Å; K613-Q617 WeakPolarHBondContact O-CG 3.09Å; K613-Q617 PolarHBondContact O-N 3.42Å; K613-Q617 VanDerWaalsContact O-N 3.1Å
614	D	93.2	Very high	92.9	Very high	36 Å²	36	46.5 Å²	46.5	19%	0.193	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-42.5	178.4	-59.1	-92.6	0	0	0	111	K242 T243 Y611 Q617 L618	K242-D614 HydrophobicContact CB-CB 4.07Å; K242-D614 VanDerWaalsContact CD-CG 3.5Å; K242-D614 VanDerWaalsContact CD-OD1 3.24Å; K242-D614 WeakPolarHBondContact CD-OD1 3.43Å; K242-D614 WeakPolarHBondContact CD-OD2 3.49Å; K242-D614 IonicContact NZ-OD1 2.85Å; T243-D614 HydrophobicContact CG2-CB 4.44Å; Y611-D614 VanDerWaalsContact CB-OD2 3.3Å; Y611-D614 WeakPolarHBondContact CB-OD2 3.47Å; Y611-D614 PolarHBondContact O-N 3.09Å; D614-Q617 PolarHBondContact O-N 2.69Å; D614-L618 PolarHBondContact O-N 3.49Å
615	L	93.1	Very high	92.8	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68	-39.9	178.8	-170.8	65.2	0	0	0	112.6	E596 L606 T610 Y611 K613 Q617 L618 N619 W624	E596-L615 HydrophobicContact CB-CD2 4.5Å; L606-L615 HydrophobicContact CD1-CD2 3.67Å; L606-L615 HydrophobicContact CD2-CD2 3.44Å; L606-L615 VanDerWaalsContact CD2-CD2 3.44Å; L606-L615 HydrophobicContact CG-CD2 4.2Å; T610-L615 HydrophobicContact CG2-CB 4.21Å; T610-L615 HydrophobicContact CG2-CD2 3.79Å; Y611-L615 PolarHBondContact O-N 2.59Å; Y611-L615 VanDerWaalsContact O-N 3.15Å; K613-L615 VanDerWaalsContact C-N 3.32Å; K613-L615 PolarHBondContact O-N 3.48Å; L615-Q617 VanDerWaalsContact C-N 3.27Å; L615-Q617 PolarHBondContact O-N 3.24Å; L615-L618 HydrophobicContact CD1-CD2 4.29Å; L615-L618 WeakPolarHBondContact O-CB 3.2Å; L615-L618 PolarHBondContact O-N 2.8Å; L615-L618 VanDerWaalsContact O-N 3.13Å; L615-N619 PolarHBondContact O-N 3.08Å; L615-W624 HydrophobicContact CB-CH2 4.26Å; L615-W624 HydrophobicContact CD2-CH2 3.79Å; L615-W624 HydrophobicContact CD2-CZ3 3.57Å; L615-W624 HydrophobicContact CG-CH2 3.8Å; L615-W624 HydrophobicContact CG-CZ3 4.12Å
616	S	91.8	Very high	92.7	Very high	22 Å²	22	46.1 Å²	46.1	15%	0.154	24%	0.243	C	C	.	.	H	α-helix	trans	-65.4	-29.4	176.4	-176.8	0	0	0	0	112.9	M612 K613 N619 P620	M612-S616 WeakPolarHBondContact O-CB 3.16Å; M612-S616 PolarHBondContact O-N 3.34Å; K613-S616 PolarHBondContact O-N 2.82Å; S616-N619 CarbonylContact O-C 3.58Å; S616-P620 VanDerWaalsContact O-CA 3.27Å; S616-P620 WeakPolarHBondContact O-CA 3.07Å
617	Q	92.1	Very high	92.4	Very high	131 Å²	131	49 Å²	49	61%	0.612	26%	0.255	S	S	*	.	H	α-helix	trans	-73.1	-36.7	172	-70.3	174.5	5.8	0	0	111.6	K613 D614 L615 N619	K613-Q617 WeakPolarHBondContact O-CG 3.09Å; K613-Q617 PolarHBondContact O-N 3.42Å; K613-Q617 VanDerWaalsContact O-N 3.1Å; D614-Q617 PolarHBondContact O-N 2.69Å; L615-Q617 VanDerWaalsContact C-N 3.27Å; L615-Q617 PolarHBondContact O-N 3.24Å; Q617-N619 VanDerWaalsContact C-N 3.34Å
618	L	92.4	Very high	92	Very high	71 Å²	71	50.1 Å²	50.1	37%	0.372	27%	0.27	S	S	.	.	H	α-helix	trans	-67.4	-34.1	176.3	-176.1	63.4	0	0	0	112.3	T243 N600 D614 L615	T243-L618 HydrophobicContact CG2-CD2 4.13Å; N600-L618 PolarHBondContact ND2-O 2.84Å; D614-L618 PolarHBondContact O-N 3.49Å; L615-L618 HydrophobicContact CD1-CD2 4.29Å; L615-L618 WeakPolarHBondContact O-CB 3.2Å; L615-L618 PolarHBondContact O-N 2.8Å; L615-L618 VanDerWaalsContact O-N 3.13Å
619	N	93.1	Very high	91.3	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.016	26%	0.259	C	S	.	.			trans	-136.1	79.4	178.4	-168	11.9	0	0	0	111.9	E596 G598 G599 N600 L615 S616 Q617 A621 A622	E596-N619 WeakPolarHBondContact OE1-CB 3.38Å; E596-N619 PolarHBondContact OE1-ND2 2.92Å; G598-N619 PolarHBondContact O-ND2 3.41Å; G599-N619 WeakPolarHBondContact CA-OD1 3.45Å; N600-N619 PolarHBondContact N-OD1 3.11Å; N600-N619 WeakPolarHBondContact OD1-CB 3.25Å; N600-N619 PolarHBondContact OD1-ND2 3.45Å; N600-N619 PolarHBondContact OD1-OD1 3.37Å; L615-N619 PolarHBondContact O-N 3.08Å; S616-N619 CarbonylContact O-C 3.58Å; Q617-N619 VanDerWaalsContact C-N 3.34Å; N619-A621 PolarHBondContact O-N 2.97Å; N619-A622 HydrophobicContact CB-CB 4.16Å; N619-A622 VanDerWaalsContact O-CB 3.25Å; N619-A622 WeakPolarHBondContact O-CB 3.49Å; N619-A622 PolarHBondContact O-N 3.16Å; N619-A622 VanDerWaalsContact O-N 3.14Å
620	P	89.4	Confident	89.7	Confident	111 Å²	111	51.1 Å²	51.1	72%	0.721	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-17.5	-175.1	27	-35.3	0	0	0	113.8	S616	S616-P620 VanDerWaalsContact O-CA 3.27Å; S616-P620 WeakPolarHBondContact O-CA 3.07Å
621	A	88.9	Confident	87.6	Confident	69 Å²	69	63 Å²	63	57%	0.57	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	12	177.7	0	0	0	0	0	113	N619	N619-A621 PolarHBondContact O-N 2.97Å
622	A	92.3	Very high	87.2	Confident	13 Å²	13	62.5 Å²	62.5	11%	0.107	32%	0.324	C	S	.	.			trans	-72.7	140	178.3	0	0	0	0	0	112.2	E596 N619 W624	E596-A622 HydrophobicContact CG-CB 3.85Å; N619-A622 HydrophobicContact CB-CB 4.16Å; N619-A622 VanDerWaalsContact O-CB 3.25Å; N619-A622 WeakPolarHBondContact O-CB 3.49Å; N619-A622 PolarHBondContact O-N 3.16Å; N619-A622 VanDerWaalsContact O-N 3.14Å; A622-W624 HydrophobicContact CB-CH2 4.13Å; A622-W624 HydrophobicContact CB-CZ2 3.86Å
623	E	93.1	Very high	86.8	Confident	114 Å²	114	65.7 Å²	65.7	53%	0.533	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	138.8	161.1	-63.6	-177.6	-178.2	0	0	109.5	I597	I597-E623 PolarHBondContact N-O 3.34Å; I597-E623 PolarHBondContact O-N 3.47Å
624	W	94.6	Very high	86.5	Confident	9 Å²	9	66.2 Å²	66.2	3%	0.034	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	117.4	-177.2	-50.7	97.8	0	0	0	109.6	I549 V551 Q552 L594 Y595 E596 L606 M612 L615 A622	I549-W624 HydrophobicContact CD1-CD2 4.49Å; I549-W624 HydrophobicContact CD1-CG 4.29Å; V551-W624 CarbonylContact C-O 3.59Å; V551-W624 WeakPolarHBondContact CA-O 3.13Å; V551-W624 HydrophobicContact CB-CB 4.42Å; V551-W624 HydrophobicContact CG1-CB 4.47Å; V551-W624 HydrophobicContact CG2-CB 3.95Å; Q552-W624 PolarHBondContact N-O 3.27Å; L594-W624 HydrophobicContact CD1-CB 4.43Å; Y595-W624 WeakPolarHBondContact O-CA 3.35Å; E596-W624 HydrophobicContact CB-CE3 4.31Å; E596-W624 HydrophobicContact CB-CZ3 3.88Å; E596-W624 HydrophobicContact CG-CH2 4.29Å; E596-W624 HydrophobicContact CG-CZ3 3.92Å; L606-W624 HydrophobicContact CD1-CE3 4.24Å; L606-W624 HydrophobicContact CD1-CZ3 3.96Å; M612-W624 HydrophobicContact CE-CD2 3.91Å; M612-W624 HydrophobicContact CE-CE3 3.47Å; M612-W624 VanDerWaalsContact CE-CE3 3.47Å; M612-W624 HydrophobicContact CE-CH2 4.11Å; M612-W624 HydrophobicContact CE-CZ3 3.59Å; L615-W624 HydrophobicContact CB-CH2 4.26Å; L615-W624 HydrophobicContact CD2-CH2 3.79Å; L615-W624 HydrophobicContact CD2-CZ3 3.57Å; L615-W624 HydrophobicContact CG-CH2 3.8Å; L615-W624 HydrophobicContact CG-CZ3 4.12Å; A622-W624 HydrophobicContact CB-CH2 4.13Å; A622-W624 HydrophobicContact CB-CZ2 3.86Å
625	V	93.8	Very high	86.1	Confident	10 Å²	10	68 Å²	68	6%	0.061	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.1	-173.1	-170.9	0	0	0	0	110.9	Q552 Y595 I597 K627	Q552-V625 HydrophobicContact CB-CG1 4.42Å; Q552-V625 HydrophobicContact CB-CG2 4.3Å; Q552-V625 CarbonylContact O-C 3.55Å; Q552-V625 VanDerWaalsContact O-CA 3.32Å; Q552-V625 WeakPolarHBondContact O-CA 3.44Å; Y595-V625 WeakPolarHBondContact CA-O 3.36Å; Y595-V625 WeakPolarHBondContact CB-O 3.45Å; Y595-V625 PolarHBondContact N-O 2.84Å; Y595-V625 PolarHBondContact O-N 3.26Å; I597-V625 HydrophobicContact CD1-CB 4Å; I597-V625 HydrophobicContact CD1-CG2 3.84Å; V625-K627 HydrophobicContact CG1-CD 4.41Å; V625-K627 HydrophobicContact CG1-CG 3.82Å
626	I	92.3	Very high	85.6	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	126.5	170.6	-56.1	178.1	0	0	0	107.9	V551 Q552 A553 Q555 F556 L575 F578 L592 C593 L594	V551-I626 HydrophobicContact CG1-CD1 4.1Å; V551-I626 HydrophobicContact CG1-CG1 3.89Å; Q552-I626 PolarHBondContact O-N 2.98Å; A553-I626 HydrophobicContact CB-CB 4.11Å; A553-I626 HydrophobicContact CB-CD1 4.18Å; A553-I626 HydrophobicContact CB-CG1 4.4Å; Q555-I626 VanDerWaalsContact NE2-C 3.32Å; Q555-I626 PolarHBondContact NE2-O 3.37Å; Q555-I626 PolarHBondContact OE1-O 2.87Å; F556-I626 HydrophobicContact CE2-CG2 4.32Å; L575-I626 HydrophobicContact CD1-CD1 4.24Å; L575-I626 HydrophobicContact CD1-CG2 3.79Å; F578-I626 HydrophobicContact CB-CD1 4.06Å; F578-I626 HydrophobicContact CD1-CD1 4.34Å; F578-I626 HydrophobicContact CD2-CD1 3.33Å; F578-I626 HydrophobicContact CE2-CD1 3.71Å; F578-I626 HydrophobicContact CG-CD1 3.67Å; F578-I626 HydrophobicContact CZ-CD1 4.37Å; L592-I626 HydrophobicContact CB-CG2 4.29Å; L592-I626 HydrophobicContact CD2-CG2 4.47Å; C593-I626 WeakPolarHBondContact O-CA 3.25Å; L594-I626 HydrophobicContact CD1-CG1 3.76Å
627	K	89.1	Confident	85.2	Confident	70 Å²	70	75.6 Å²	75.6	30%	0.304	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	164.5	176.3	-54.8	179.3	-179.4	177.5	0	110.5	L592 C593 Y595 E603 V625	L592-K627 WeakPolarHBondContact CA-O 3.24Å; C593-K627 PolarHBondContact N-O 3.19Å; C593-K627 PolarHBondContact O-N 2.97Å; Y595-K627 HydrophobicContact CD2-CB 3.8Å; Y595-K627 HydrophobicContact CD2-CD 4.16Å; Y595-K627 HydrophobicContact CD2-CG 3.99Å; Y595-K627 HydrophobicContact CE2-CB 3.64Å; Y595-K627 HydrophobicContact CE2-CD 4.43Å; Y595-K627 HydrophobicContact CE2-CG 4.3Å; Y595-K627 HydrophobicContact CG-CD 4.37Å; E603-K627 IonicContact OE1-NZ 4Å; E603-K627 PolarHBondContact OE1-NZ 2.68Å; V625-K627 HydrophobicContact CG1-CD 4.41Å; V625-K627 HydrophobicContact CG1-CG 3.82Å
628	A	83.8	Confident	84.7	Confident	63 Å²	63	71.6 Å²	71.6	52%	0.521	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	140.5	167.4	0	0	0	0	0	110.1	D591 Q630	D591-A628 CarbonylContact O-C 3.5Å; D591-A628 WeakPolarHBondContact O-CA 3.37Å; A628-Q630 PolarHBondContact O-N 3.28Å
629	V	75.1	Confident	84.1	Confident	52 Å²	52	71.7 Å²	71.7	32%	0.315	38%	0.378	S	S	.	.			trans	-64.8	118.3	176.5	-178.4	0	0	0	0	108.4	D591 C593 R631	D591-V629 PolarHBondContact O-N 3.32Å; C593-V629 HydrophobicContact CB-CG2 3.84Å; V629-R631 HydrophobicContact CB-CG 4.49Å; V629-R631 HydrophobicContact CG1-CG 3.85Å; V629-R631 PolarHBondContact O-N 2.83Å; V629-R631 VanDerWaalsContact O-N 3.12Å
630	Q	59.1	Low	83.4	Confident	169 Å²	169	77.4 Å²	77.4	79%	0.79	41%	0.408	S	S	*	.			trans	-73	98.9	167	-68.5	178	-3.5	0	0	106.8	A628	A628-Q630 PolarHBondContact O-N 3.28Å
631	R	49.2	Very low	82.8	Confident	249 Å²	249	74.4 Å²	74.4	94%	0.94	38%	0.38	S	S	*	.			trans	-88.4	0	176.3	-72.9	-170.1	-174.3	170.6	8.1	111.8	E590 D591 V629	E590-R631 PolarHBondContact O-NH2 3.44Å; D591-R631 IonicContact OD1-NH2 2.67Å; V629-R631 HydrophobicContact CB-CG 4.49Å; V629-R631 HydrophobicContact CG1-CG 3.85Å; V629-R631 PolarHBondContact O-N 2.83Å; V629-R631 VanDerWaalsContact O-N 3.12Å

Retrieved 631 of 631 residues in 993.5 ms (Link to these results)

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