A0A087XLS4_POEFO Loading...

NAD(+) hydrolase SARM1

AlphaFold DB , UniProt , Accession A0A087XLS4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 712 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.2	Very low	39.6	Very low	220 Å²	220	130.4 Å²	130.4	100%	1.084	65%	0.654	S	S	*	*				0	-28	0	-70.6	-161	90.9	0	0	114.2	L3 S4	M1-L3 PolarHBondContact O-N 3.14Å; M1-S4 PolarHBondContact O-N 3.35Å
2	L	36.5	Very low	39.4	Very low	152 Å²	152	126.5 Å²	126.5	80%	0.796	64%	0.636	S	S	*	*	H	α-helix	trans	-65	-34.6	178.7	-85.1	135.9	0	0	0	115.3	S4 L5 T6	L2-S4 VanDerWaalsContact C-N 3.33Å; L2-S4 PolarHBondContact O-N 3.12Å; L2-L5 PolarHBondContact O-N 3.24Å; L2-T6 PolarHBondContact O-N 2.87Å; L2-T6 PolarHBondContact O-OG1 3.17Å
3	L	39.8	Very low	39.1	Very low	140 Å²	140	126.8 Å²	126.8	73%	0.733	63%	0.634	S	S	*	*	H	α-helix	trans	-69.5	-26.9	177.7	-105.9	105	0	0	0	114.3	M1 T6 L7	M1-L3 PolarHBondContact O-N 3.14Å; L3-T6 WeakPolarHBondContact CA-OG1 3.49Å; L3-T6 PolarHBondContact O-OG1 2.94Å; L3-T6 VanDerWaalsContact O-OG1 3.09Å; L3-L7 WeakPolarHBondContact O-CB 3.49Å; L3-L7 WeakPolarHBondContact O-CD1 3.3Å; L3-L7 PolarHBondContact O-N 2.53Å
4	S	39.9	Very low	38.9	Very low	88 Å²	88	124.9 Å²	124.9	62%	0.615	62%	0.622	S	S	*	*	H	α-helix	trans	-76	-37	179	-178.9	0	0	0	0	110.9	M1 L2 F8	M1-S4 PolarHBondContact O-N 3.35Å; L2-S4 VanDerWaalsContact C-N 3.33Å; L2-S4 PolarHBondContact O-N 3.12Å; S4-F8 WeakPolarHBondContact O-CB 3.38Å; S4-F8 PolarHBondContact O-N 3.08Å
5	L	36.4	Very low	38.5	Very low	118 Å²	118	129.3 Å²	129.3	62%	0.618	63%	0.629	S	S	*	*	H	α-helix	trans	-70	-37.1	178.5	-143.9	86.1	0	0	0	112	L2 F8 L9	L2-L5 PolarHBondContact O-N 3.24Å; L5-F8 PolarHBondContact O-N 3.02Å; L5-L9 HydrophobicContact CD2-CD1 4.48Å; L5-L9 WeakPolarHBondContact O-CB 3.37Å; L5-L9 VanDerWaalsContact O-CG 3.3Å; L5-L9 WeakPolarHBondContact O-CG 3.25Å; L5-L9 PolarHBondContact O-N 3.26Å
6	T	42.8	Very low	37.9	Very low	84 Å²	84	127.6 Å²	127.6	52%	0.515	62%	0.622	S	S	.	*	H	α-helix	trans	-71.1	-37.5	177.3	51.7	0	0	0	0	112.4	L2 L3 F10	L2-T6 PolarHBondContact O-N 2.87Å; L2-T6 PolarHBondContact O-OG1 3.17Å; L3-T6 WeakPolarHBondContact CA-OG1 3.49Å; L3-T6 PolarHBondContact O-OG1 2.94Å; L3-T6 VanDerWaalsContact O-OG1 3.09Å; T6-F10 WeakPolarHBondContact O-CB 3.4Å; T6-F10 PolarHBondContact O-N 2.83Å
7	L	41.5	Very low	37.5	Very low	94 Å²	94	123.6 Å²	123.6	49%	0.492	61%	0.61	S	S	.	*	H	α-helix	trans	-67.9	-35.6	173.1	-86.8	159.7	0	0	0	112.5	L3 R11	L3-L7 WeakPolarHBondContact O-CB 3.49Å; L3-L7 WeakPolarHBondContact O-CD1 3.3Å; L3-L7 PolarHBondContact O-N 2.53Å; L7-R11 WeakPolarHBondContact O-CB 3.46Å; L7-R11 WeakPolarHBondContact O-CG 3.44Å; L7-R11 PolarHBondContact O-N 3.21Å
8	F	40.3	Very low	37.3	Very low	143 Å²	143	124.3 Å²	124.3	63%	0.627	62%	0.615	S	S	*	*	H	α-helix	trans	-70.6	-42.9	176.4	-163.5	-95.7	0	0	0	111.8	S4 L5 R11 L12	S4-F8 WeakPolarHBondContact O-CB 3.38Å; S4-F8 PolarHBondContact O-N 3.08Å; L5-F8 PolarHBondContact O-N 3.02Å; F8-R11 PolarHBondContact O-N 3.18Å; F8-L12 WeakPolarHBondContact O-CB 3.34Å; F8-L12 PolarHBondContact O-N 3.11Å
9	L	37.2	Very low	36.7	Very low	102 Å²	102	125.6 Å²	125.6	53%	0.534	62%	0.622	S	S	.	*	H	α-helix	trans	-67	-35.9	175.1	-73.2	166.2	0	0	0	112.3	L5 L12 H13	L5-L9 HydrophobicContact CD2-CD1 4.48Å; L5-L9 WeakPolarHBondContact O-CB 3.37Å; L5-L9 VanDerWaalsContact O-CG 3.3Å; L5-L9 WeakPolarHBondContact O-CG 3.25Å; L5-L9 PolarHBondContact O-N 3.26Å; L9-L12 PolarHBondContact O-N 3.3Å; L9-H13 VanDerWaalsContact O-CB 3.3Å; L9-H13 WeakPolarHBondContact O-CB 3.42Å; L9-H13 PolarHBondContact O-N 3.1Å
10	F	39.6	Very low	36.2	Very low	122 Å²	122	128.3 Å²	128.3	54%	0.535	63%	0.63	S	S	.	*	H	α-helix	trans	-66.1	-42.5	173.9	-176	-99.5	0	0	0	112.1	T6 H13 Q14	T6-F10 WeakPolarHBondContact O-CB 3.4Å; T6-F10 PolarHBondContact O-N 2.83Å; F10-H13 PolarHBondContact O-N 2.97Å; F10-Q14 PolarHBondContact O-N 3.01Å
11	R	36.3	Very low	35.7	Very low	171 Å²	171	125.8 Å²	125.8	65%	0.645	63%	0.625	S	S	*	*	H	α-helix	trans	-69.3	-33.5	175.7	-75.3	-174.9	179.4	-167.3	0.2	112.9	L7 F8 R15	L7-R11 WeakPolarHBondContact O-CB 3.46Å; L7-R11 WeakPolarHBondContact O-CG 3.44Å; L7-R11 PolarHBondContact O-N 3.21Å; F8-R11 PolarHBondContact O-N 3.18Å; R11-R15 WeakPolarHBondContact O-CB 3.37Å; R11-R15 WeakPolarHBondContact O-CG 3.28Å; R11-R15 PolarHBondContact O-N 3.38Å
12	L	37.5	Very low	34.9	Very low	84 Å²	84	120.9 Å²	120.9	44%	0.44	61%	0.612	S	S	.	*	H	α-helix	trans	-70.9	-39.2	175	-156.6	77.9	0	0	0	111.3	F8 L9 R15 L16	F8-L12 WeakPolarHBondContact O-CB 3.34Å; F8-L12 PolarHBondContact O-N 3.11Å; L9-L12 PolarHBondContact O-N 3.3Å; L12-R15 PolarHBondContact O-N 3.29Å; L12-L16 HydrophobicContact CG-CD1 4.39Å; L12-L16 WeakPolarHBondContact O-CB 3.17Å; L12-L16 WeakPolarHBondContact O-CG 3.35Å; L12-L16 PolarHBondContact O-N 3.33Å
13	H	35.4	Very low	34.4	Very low	131 Å²	131	118.8 Å²	118.8	61%	0.606	60%	0.602	S	S	*	*	H	α-helix	trans	-65.5	-42.2	173.4	-169.7	-61.9	0	0	0	111.8	L9 F10 R15 L16 S17	L9-H13 VanDerWaalsContact O-CB 3.3Å; L9-H13 WeakPolarHBondContact O-CB 3.42Å; L9-H13 PolarHBondContact O-N 3.1Å; F10-H13 PolarHBondContact O-N 2.97Å; H13-R15 PolarHBondContact O-N 3.49Å; H13-L16 PolarHBondContact O-N 3.09Å; H13-S17 PolarHBondContact CE1-OG 3.13Å; H13-S17 PolarHBondContact ND1-OG 2.89Å; H13-S17 WeakPolarHBondContact O-CB 3.32Å; H13-S17 PolarHBondContact O-N 2.95Å; H13-S17 PolarHBondContact O-OG 3.09Å; H13-S17 VanDerWaalsContact O-OG 3.05Å
14	Q	35.5	Very low	34.2	Very low	100 Å²	100	123 Å²	123	47%	0.467	61%	0.608	S	S	.	*	H	α-helix	trans	-62.1	-41.4	173.8	-102.9	-179.5	-18.5	0	0	112.3	F10 S17 I18	F10-Q14 PolarHBondContact O-N 3.01Å; Q14-S17 PolarHBondContact O-N 3Å; Q14-I18 WeakPolarHBondContact O-CD1 3.49Å; Q14-I18 WeakPolarHBondContact O-CG1 3.27Å; Q14-I18 PolarHBondContact O-N 3.06Å
15	R	33.5	Very low	33.7	Very low	191 Å²	191	124.7 Å²	124.7	72%	0.721	61%	0.61	S	S	*	*	H	α-helix	trans	-67	-37	177.3	-78.3	-174.8	174.1	-163.9	-2.5	113	R11 L12 H13 M19	R11-R15 WeakPolarHBondContact O-CB 3.37Å; R11-R15 WeakPolarHBondContact O-CG 3.28Å; R11-R15 PolarHBondContact O-N 3.38Å; L12-R15 PolarHBondContact O-N 3.29Å; H13-R15 PolarHBondContact O-N 3.49Å; R15-M19 PolarHBondContact O-N 3.18Å
16	L	29	Very low	33.3	Very low	101 Å²	101	125 Å²	125	53%	0.529	62%	0.616	S	S	.	*	H	α-helix	trans	-74.1	-33.5	176.2	-75.7	162.7	0	0	0	112.6	L12 H13	L12-L16 HydrophobicContact CG-CD1 4.39Å; L12-L16 WeakPolarHBondContact O-CB 3.17Å; L12-L16 WeakPolarHBondContact O-CG 3.35Å; L12-L16 PolarHBondContact O-N 3.33Å; H13-L16 PolarHBondContact O-N 3.09Å
17	S	30.4	Very low	32.7	Very low	60 Å²	60	126.3 Å²	126.3	42%	0.42	62%	0.624	S	S	.	*	H	α-helix	trans	-70.1	-29.8	173.4	-64.4	0	0	0	0	113.1	H13 Q14 S21	H13-S17 PolarHBondContact CE1-OG 3.13Å; H13-S17 PolarHBondContact ND1-OG 2.89Å; H13-S17 WeakPolarHBondContact O-CB 3.32Å; H13-S17 PolarHBondContact O-N 2.95Å; H13-S17 PolarHBondContact O-OG 3.09Å; H13-S17 VanDerWaalsContact O-OG 3.05Å; Q14-S17 PolarHBondContact O-N 3Å; S17-S21 WeakPolarHBondContact O-CB 3.39Å; S17-S21 PolarHBondContact O-N 3.09Å
18	I	33.7	Very low	32.2	Very low	136 Å²	136	126.4 Å²	126.4	70%	0.697	63%	0.631	S	S	*	*	H	α-helix	trans	-77	-30.6	176	-68.1	164.2	0	0	0	111.8	Q14 F20	Q14-I18 WeakPolarHBondContact O-CD1 3.49Å; Q14-I18 WeakPolarHBondContact O-CG1 3.27Å; Q14-I18 PolarHBondContact O-N 3.06Å; I18-F20 VanDerWaalsContact C-N 3.31Å; I18-F20 PolarHBondContact O-N 3.36Å
19	M	26.6	Very low	31.6	Very low	150 Å²	150	126.7 Å²	126.7	74%	0.739	64%	0.639	S	S	*	*	H	α-helix	trans	-73.8	-15.3	178.6	-82.4	-176.1	95.7	0	0	114.6	R15	R15-M19 PolarHBondContact O-N 3.18Å
20	F	27.4	Very low	31.4	Very low	179 Å²	179	129.7 Å²	129.7	79%	0.785	64%	0.644	S	S	*	*	S	Bend	trans	-133.8	13.5	-172.8	-76.9	-74	0	0	0	115.9	I18	I18-F20 VanDerWaalsContact C-N 3.31Å; I18-F20 PolarHBondContact O-N 3.36Å
21	S	24.9	Very low	31.1	Very low	76 Å²	76	128 Å²	128	53%	0.531	64%	0.643	S	S	.	*			trans	-92.6	116.6	179.2	-170.2	0	0	0	0	112.3	S17	S17-S21 WeakPolarHBondContact O-CB 3.39Å; S17-S21 PolarHBondContact O-N 3.09Å
22	S	28.3	Very low	30.9	Very low	116 Å²	116	123.2 Å²	123.2	81%	0.811	64%	0.636	S	S	*	*			trans	-88.9	8.5	171.4	65.2	0	0	0	0	114.1
23	D	27.1	Very low	30.6	Very low	109 Å²	109	128.2 Å²	128.2	58%	0.583	65%	0.649	S	S	*	*			trans	-108.6	117.5	-173.4	-70.2	-21.2	0	0	0	112.2	L25	D23-L25 HydrophobicContact CB-CD1 3.84Å; D23-L25 HydrophobicContact CB-CG 3.95Å; D23-L25 PolarHBondContact O-N 3.33Å; D23-L25 VanDerWaalsContact O-N 3.16Å
24	R	33.9	Very low	30.6	Very low	229 Å²	229	128.8 Å²	128.8	86%	0.864	66%	0.656	S	S	*	*			trans	-60.6	107.6	157.2	-76.6	-176.3	174.7	-169.8	-3	107.3
25	L	30.6	Very low	30.7	Very low	123 Å²	123	132.2 Å²	132.2	64%	0.644	67%	0.672	S	S	*	*			trans	-121.4	115	-178.9	-84	163	0	0	0	112.8	D23	D23-L25 HydrophobicContact CB-CD1 3.84Å; D23-L25 HydrophobicContact CB-CG 3.95Å; D23-L25 PolarHBondContact O-N 3.33Å; D23-L25 VanDerWaalsContact O-N 3.16Å
26	T	27.9	Very low	30.5	Very low	123 Å²	123	134.5 Å²	134.5	76%	0.755	68%	0.681	S	S	*	*			trans	58.6	127.7	141.2	53.2	0	0	0	0	120.7
27	V	30.7	Very low	30.6	Very low	113 Å²	113	132.3 Å²	132.3	69%	0.685	68%	0.683	S	S	*	*			trans	-44.3	127.6	170.5	-178.2	0	0	0	0	111.8	V31	V27-V31 HydrophobicContact CG1-CB 4.15Å; V27-V31 HydrophobicContact CG1-CG2 3.81Å
28	P	31.1	Very low	30.9	Very low	96 Å²	96	141.2 Å²	141.2	62%	0.623	71%	0.707	S	S	*	*			trans	-62.5	138.3	176.4	-22.5	32.6	0	0	0	112.9	Y30 V31	P28-Y30 PolarHBondContact O-N 3.32Å; P28-V31 PolarHBondContact O-N 3.39Å
29	D	26	Very low	30.8	Very low	149 Å²	149	140.9 Å²	140.9	80%	0.797	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-8.4	-179.2	-97.5	-29.2	0	0	0	115.6	S32	D29-S32 PolarHBondContact O-OG 3.21Å
30	Y	33	Very low	30.8	Very low	164 Å²	164	137.2 Å²	137.2	64%	0.643	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-27.3	178.3	-168.4	-100.3	0	0	0	113.4	P28 S32 R33	P28-Y30 PolarHBondContact O-N 3.32Å; Y30-S32 PolarHBondContact O-N 3.49Å; Y30-R33 PolarHBondContact O-N 3.13Å; Y30-R33 VanDerWaalsContact O-N 3.08Å
31	V	34.8	Very low	30.8	Very low	87 Å²	87	134.6 Å²	134.6	53%	0.527	72%	0.721	S	S	.	*	G	3₁₀ helix	trans	-63.1	-26.5	-179.8	-178.1	0	0	0	0	111.9	V27 P28 R33	V27-V31 HydrophobicContact CG1-CB 4.15Å; V27-V31 HydrophobicContact CG1-CG2 3.81Å; P28-V31 PolarHBondContact O-N 3.39Å; V31-R33 VanDerWaalsContact C-N 3.29Å; V31-R33 PolarHBondContact O-N 2.89Å
32	S	30.5	Very low	31.3	Very low	70 Å²	70	134.5 Å²	134.5	49%	0.49	73%	0.732	S	S	.	*	G	3₁₀ helix	trans	-69.1	-21.1	176.9	68.6	0	0	0	0	114	D29 Y30	D29-S32 PolarHBondContact O-OG 3.21Å; Y30-S32 PolarHBondContact O-N 3.49Å
33	R	31.5	Very low	31.2	Very low	189 Å²	189	135 Å²	135	71%	0.713	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-78.5	-25.7	-178.1	-69.4	-172.2	-171.1	-174.1	4.5	113.6	Y30 V31 Q35	Y30-R33 PolarHBondContact O-N 3.13Å; Y30-R33 VanDerWaalsContact O-N 3.08Å; V31-R33 VanDerWaalsContact C-N 3.29Å; V31-R33 PolarHBondContact O-N 2.89Å; R33-Q35 VanDerWaalsContact C-N 3.28Å; R33-Q35 PolarHBondContact O-N 3.33Å
34	L	36.5	Very low	31.1	Very low	144 Å²	144	138.5 Å²	138.5	75%	0.754	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-73.8	-16.7	178	-84.7	155.9	0	0	0	113.3
35	Q	36.5	Very low	31.1	Very low	172 Å²	172	133.8 Å²	133.8	80%	0.804	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-81.2	-16.1	178	-73.7	-174.4	-12.5	0	0	114.3	R33 G37	R33-Q35 VanDerWaalsContact C-N 3.28Å; R33-Q35 PolarHBondContact O-N 3.33Å; Q35-G37 PolarHBondContact O-N 2.96Å
36	R	29.1	Very low	31	Very low	239 Å²	239	136.7 Å²	136.7	90%	0.902	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-88.3	0.4	-171.8	-119.1	-179.5	-169.6	-173	3.9	115.6
37	G	32.9	Very low	31.1	Very low	55 Å²	55	137 Å²	137	57%	0.567	76%	0.758	S	S	*	*	S	Bend	trans	-133.1	68.3	-176.3	0	0	0	0	0	113.1	Q35	Q35-G37 PolarHBondContact O-N 2.96Å
38	R	36	Very low	31.1	Very low	247 Å²	247	138.2 Å²	138.2	93%	0.932	77%	0.765	S	S	*	*			trans	176.2	81.2	150	-97.2	156.1	-174.3	-164.3	3.1	111.6
39	S	31	Very low	31	Very low	129 Å²	129	138.5 Å²	138.5	90%	0.902	77%	0.769	S	S	*	*			trans	-92.6	106.8	149.6	53	0	0	0	0	107.5
40	G	26.9	Very low	31.7	Very low	72 Å²	72	138.3 Å²	138.3	74%	0.742	78%	0.776	S	S	*	*			trans	169.5	110.6	173.8	0	0	0	0	0	116.4
41	S	28.1	Very low	32.4	Very low	124 Å²	124	133.3 Å²	133.3	87%	0.867	77%	0.774	S	S	*	*			trans	67.3	116.1	153.1	-163.4	0	0	0	0	119.8
42	G	35.6	Very low	33.6	Very low	75 Å²	75	132.9 Å²	132.9	77%	0.773	77%	0.768	S	S	*	*			trans	-66.3	142.4	169.1	0	0	0	0	0	113.3
43	C	25.1	Very low	35.9	Very low	125 Å²	125	131.7 Å²	131.7	85%	0.845	76%	0.761	S	S	*	*			trans	-155.1	124.3	157.9	-157.9	0	0	0	0	106.9
44	E	25.7	Very low	38.1	Very low	184 Å²	184	126.3 Å²	126.3	86%	0.86	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-62.5	136.4	176.8	-67.3	-172.7	149.9	0	0	110.8	K46	E44-K46 PolarHBondContact O-N 3.21Å
45	P	34.6	Very low	40.2	Very low	129 Å²	129	125 Å²	125	84%	0.838	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-84.2	119.8	173.7	8	8.3	0	0	0	110.9
46	K	26.4	Very low	42.5	Very low	185 Å²	185	116.8 Å²	116.8	80%	0.804	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-66	156.4	163.6	-83.3	179.1	178.4	176.2	0	111.3	E44 V48	E44-K46 PolarHBondContact O-N 3.21Å; K46-V48 PolarHBondContact O-N 3.36Å
47	P	30.9	Very low	45.3	Very low	130 Å²	130	109.7 Å²	109.7	84%	0.844	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-72.9	126.9	-174.9	30.4	-33.1	0	0	0	110.8
48	V	31.8	Very low	47.8	Very low	137 Å²	137	109.7 Å²	109.7	83%	0.83	68%	0.683	S	S	*	*			trans	-111.5	142.1	172.9	-173.7	0	0	0	0	108.3	K46	K46-V48 PolarHBondContact O-N 3.36Å
49	S	28.3	Very low	50.3	Low	102 Å²	102	100.2 Å²	100.2	71%	0.713	65%	0.653	S	S	*	*			trans	-45.6	165.3	176.4	-49.4	0	0	0	0	114.6	G51	S49-G51 PolarHBondContact O-N 3.46Å
50	P	40.7	Very low	53.1	Low	145 Å²	145	94.6 Å²	94.6	94%	0.942	61%	0.612	S	S	*	*	S	Bend	trans	-78.7	61.8	-165.2	35	-35.2	0	0	0	112.8
51	G	47.2	Very low	56.1	Low	59 Å²	59	98.4 Å²	98.4	61%	0.608	61%	0.608	S	S	*	*	S	Bend	trans	-94.9	150.9	163.3	0	0	0	0	0	110.2	S49 S53	S49-G51 PolarHBondContact O-N 3.46Å; G51-S53 PolarHBondContact O-N 2.91Å
52	L	61	Low	58.9	Low	78 Å²	78	98.8 Å²	98.8	41%	0.408	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-51.8	137.6	168.5	-66.7	169.2	0	0	0	109.4	V56 Q57 L60	L52-V56 HydrophobicContact CB-CB 4.46Å; L52-V56 HydrophobicContact CB-CG1 4.21Å; L52-V56 HydrophobicContact CD1-CG1 4.43Å; L52-V56 HydrophobicContact CD2-CG1 4.14Å; L52-V56 HydrophobicContact CG-CG1 4.5Å; L52-Q57 HydrophobicContact CB-CG 4.11Å; L52-Q57 PolarHBondContact O-NE2 2.79Å; L52-L60 HydrophobicContact CD1-CD1 4.3Å
53	S	77.3	Confident	61.5	Low	46 Å²	46	96 Å²	96	32%	0.322	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-58.4	151.6	-178.9	74.3	0	0	0	0	110.8	G51 D55 V56 Q57	G51-S53 PolarHBondContact O-N 2.91Å; S53-D55 PolarHBondContact O-N 2.96Å; S53-D55 VanDerWaalsContact O-N 3.14Å; S53-V56 PolarHBondContact O-N 2.96Å; S53-V56 VanDerWaalsContact OG-CG2 3.25Å; S53-V56 WeakPolarHBondContact OG-CG2 3.4Å; S53-V56 PolarHBondContact OG-N 2.9Å; S53-Q57 PolarHBondContact O-N 3.15Å
54	A	78.4	Confident	64.8	Low	76 Å²	76	91.4 Å²	91.4	63%	0.628	54%	0.536	S	S	*	.	H	α-helix	trans	-56.3	-32.4	179.7	0	0	0	0	0	112.2	Q57 A58	A54-Q57 PolarHBondContact O-N 3.13Å; A54-A58 PolarHBondContact O-N 2.93Å
55	D	80	Confident	68.1	Low	115 Å²	115	85.9 Å²	85.9	62%	0.615	52%	0.517	S	S	*	.	H	α-helix	trans	-68.7	-41.1	177.7	-58.7	-35.4	0	0	0	112	S53 A58 V59 V106	S53-D55 PolarHBondContact O-N 2.96Å; S53-D55 VanDerWaalsContact O-N 3.14Å; D55-A58 PolarHBondContact O-N 3.12Å; D55-V59 PolarHBondContact O-N 3.28Å; D55-V106 HydrophobicContact CB-CG1 4.29Å
56	V	85.4	Confident	70.9	Confident	0 Å²	0	81.7 Å²	81.7	0%	0	49%	0.493	C	S	.	.	H	α-helix	trans	-64	-44.3	174.8	171.6	0	0	0	0	110.6	L52 S53 A58 V59 L60 V106 Q109 V110	L52-V56 HydrophobicContact CB-CB 4.46Å; L52-V56 HydrophobicContact CB-CG1 4.21Å; L52-V56 HydrophobicContact CD1-CG1 4.43Å; L52-V56 HydrophobicContact CD2-CG1 4.14Å; L52-V56 HydrophobicContact CG-CG1 4.5Å; S53-V56 PolarHBondContact O-N 2.96Å; S53-V56 VanDerWaalsContact OG-CG2 3.25Å; S53-V56 WeakPolarHBondContact OG-CG2 3.4Å; S53-V56 PolarHBondContact OG-N 2.9Å; V56-A58 VanDerWaalsContact C-N 3.28Å; V56-A58 PolarHBondContact O-N 2.89Å; V56-V59 PolarHBondContact O-N 3.43Å; V56-L60 HydrophobicContact CG1-CD1 3.66Å; V56-L60 HydrophobicContact CG1-CG 4.34Å; V56-L60 WeakPolarHBondContact O-CB 3.49Å; V56-L60 VanDerWaalsContact O-CG 3.31Å; V56-L60 WeakPolarHBondContact O-CG 3.41Å; V56-L60 PolarHBondContact O-N 3.12Å; V56-L60 VanDerWaalsContact O-N 3.07Å; V56-V106 HydrophobicContact CG2-CB 3.73Å; V56-V106 HydrophobicContact CG2-CG1 3.78Å; V56-Q109 HydrophobicContact CG1-CB 4.33Å; V56-Q109 HydrophobicContact CG2-CB 4.12Å; V56-V110 HydrophobicContact CB-CG2 4.47Å; V56-V110 HydrophobicContact CG1-CG2 4.03Å; V56-V110 HydrophobicContact CG2-CG2 4.42Å
57	Q	87.4	Confident	74.2	Confident	91 Å²	91	73 Å²	73	43%	0.425	46%	0.455	S	S	.	.	H	α-helix	trans	-63.7	-33	178.6	-67.7	-174.4	7.1	0	0	112.9	L52 S53 A54 K61	L52-Q57 HydrophobicContact CB-CG 4.11Å; L52-Q57 PolarHBondContact O-NE2 2.79Å; S53-Q57 PolarHBondContact O-N 3.15Å; A54-Q57 PolarHBondContact O-N 3.13Å; Q57-K61 VanDerWaalsContact O-CG 3.31Å; Q57-K61 WeakPolarHBondContact O-CG 3.49Å; Q57-K61 PolarHBondContact O-N 3.04Å
58	A	85.9	Confident	77.2	Confident	54 Å²	54	71.8 Å²	71.8	45%	0.446	43%	0.434	S	S	.	.	H	α-helix	trans	-65.4	-48.1	177.8	0	0	0	0	0	111.5	A54 D55 V56 L60 K61	A54-A58 PolarHBondContact O-N 2.93Å; D55-A58 PolarHBondContact O-N 3.12Å; V56-A58 VanDerWaalsContact C-N 3.28Å; V56-A58 PolarHBondContact O-N 2.89Å; A58-L60 PolarHBondContact O-N 3.48Å; A58-K61 PolarHBondContact O-N 3.17Å
59	V	88.4	Confident	80.2	Confident	48 Å²	48	70.5 Å²	70.5	29%	0.291	42%	0.419	S	S	.	.	H	α-helix	trans	-65.1	-39.5	178.9	179.5	0	0	0	0	111.8	D55 V56 K61 D62 S63 L103 V110	D55-V59 PolarHBondContact O-N 3.28Å; V56-V59 PolarHBondContact O-N 3.43Å; V59-K61 VanDerWaalsContact C-N 3.29Å; V59-K61 PolarHBondContact O-N 3.17Å; V59-D62 PolarHBondContact O-N 3.09Å; V59-S63 PolarHBondContact O-N 2.97Å; V59-S63 VanDerWaalsContact O-N 3.16Å; V59-S63 PolarHBondContact O-OG 2.88Å; V59-L103 HydrophobicContact CG1-CD1 3.73Å; V59-V110 HydrophobicContact CB-CG2 4.25Å; V59-V110 HydrophobicContact CG1-CG1 3.8Å; V59-V110 HydrophobicContact CG1-CG2 4.27Å
60	L	90	Very high	83.4	Confident	11 Å²	11	65.8 Å²	65.8	6%	0.058	39%	0.386	C	S	.	.	H	α-helix	trans	-66.7	-29.1	179.1	-71.9	172.2	0	0	0	113.2	L52 V56 A58 D62 S63 L64 V110 E113 I114	L52-L60 HydrophobicContact CD1-CD1 4.3Å; V56-L60 HydrophobicContact CG1-CD1 3.66Å; V56-L60 HydrophobicContact CG1-CG 4.34Å; V56-L60 WeakPolarHBondContact O-CB 3.49Å; V56-L60 VanDerWaalsContact O-CG 3.31Å; V56-L60 WeakPolarHBondContact O-CG 3.41Å; V56-L60 PolarHBondContact O-N 3.12Å; V56-L60 VanDerWaalsContact O-N 3.07Å; A58-L60 PolarHBondContact O-N 3.48Å; L60-D62 VanDerWaalsContact C-N 3.26Å; L60-D62 PolarHBondContact O-N 3.27Å; L60-S63 WeakPolarHBondContact CA-OG 3.29Å; L60-L64 HydrophobicContact CB-CD1 4.05Å; L60-L64 HydrophobicContact CB-CG 4.31Å; L60-L64 HydrophobicContact CD2-CD1 4.42Å; L60-L64 HydrophobicContact CD2-CD2 4.32Å; L60-L64 HydrophobicContact CD2-CG 4.22Å; L60-L64 VanDerWaalsContact O-CB 3.28Å; L60-L64 WeakPolarHBondContact O-CB 3.4Å; L60-L64 WeakPolarHBondContact O-CG 3.45Å; L60-L64 PolarHBondContact O-N 3.11Å; L60-L64 VanDerWaalsContact O-N 3.1Å; L60-V110 HydrophobicContact CD2-CG1 3.94Å; L60-V110 HydrophobicContact CG-CG1 4.45Å; L60-E113 HydrophobicContact CD1-CB 4.13Å; L60-E113 HydrophobicContact CD1-CG 3.85Å; L60-E113 HydrophobicContact CD2-CB 3.97Å; L60-E113 HydrophobicContact CD2-CG 3.91Å; L60-I114 HydrophobicContact CD2-CG1 4.21Å
61	K	90.2	Very high	85.9	Confident	152 Å²	152	59.3 Å²	59.3	66%	0.661	34%	0.343	S	S	*	.	H	α-helix	trans	-63.2	-33.5	177.3	-81.9	173.9	-178.1	-180	0	112.9	Q57 A58 V59 P65	Q57-K61 VanDerWaalsContact O-CG 3.31Å; Q57-K61 WeakPolarHBondContact O-CG 3.49Å; Q57-K61 PolarHBondContact O-N 3.04Å; A58-K61 PolarHBondContact O-N 3.17Å; V59-K61 VanDerWaalsContact C-N 3.29Å; V59-K61 PolarHBondContact O-N 3.17Å; K61-P65 WeakPolarHBondContact O-CD 3.29Å; K61-P65 WeakPolarHBondContact O-CG 3.3Å
62	D	86.2	Confident	88.2	Confident	132 Å²	132	64.5 Å²	64.5	71%	0.706	34%	0.344	S	S	*	.	H	α-helix	trans	-89.2	-38.4	-178.4	-63.6	-21.9	0	0	0	111.9	V59 L60	V59-D62 PolarHBondContact O-N 3.09Å; L60-D62 VanDerWaalsContact C-N 3.26Å; L60-D62 PolarHBondContact O-N 3.27Å
63	S	91.3	Very high	89.8	Confident	17 Å²	17	63.3 Å²	63.3	12%	0.119	34%	0.338	C	S	.	.	H	α-helix	trans	-78.5	-37.8	-175.8	50.9	0	0	0	0	114.2	V59 L60 A66 L67	V59-S63 PolarHBondContact O-N 2.97Å; V59-S63 VanDerWaalsContact O-N 3.16Å; V59-S63 PolarHBondContact O-OG 2.88Å; L60-S63 WeakPolarHBondContact CA-OG 3.29Å; S63-A66 PolarHBondContact O-N 2.85Å; S63-L67 WeakPolarHBondContact O-CB 3.37Å; S63-L67 PolarHBondContact O-N 3.47Å
64	L	93.4	Very high	90.6	Very high	28 Å²	28	61.1 Å²	61.1	15%	0.147	32%	0.323	C	S	.	.	H	α-helix	trans	-65.3	-38.8	-176	-67.1	175.8	0	0	0	114.4	L60 L67 R68 I114 R117	L60-L64 HydrophobicContact CB-CD1 4.05Å; L60-L64 HydrophobicContact CB-CG 4.31Å; L60-L64 HydrophobicContact CD2-CD1 4.42Å; L60-L64 HydrophobicContact CD2-CD2 4.32Å; L60-L64 HydrophobicContact CD2-CG 4.22Å; L60-L64 VanDerWaalsContact O-CB 3.28Å; L60-L64 WeakPolarHBondContact O-CB 3.4Å; L60-L64 WeakPolarHBondContact O-CG 3.45Å; L60-L64 PolarHBondContact O-N 3.11Å; L60-L64 VanDerWaalsContact O-N 3.1Å; L64-L67 HydrophobicContact CD2-CD2 4.32Å; L64-R68 WeakPolarHBondContact O-CG 3.33Å; L64-R68 PolarHBondContact O-N 2.84Å; L64-R68 VanDerWaalsContact O-N 3.07Å; L64-I114 HydrophobicContact CD2-CG1 4.44Å; L64-R117 HydrophobicContact CD2-CB 4.03Å; L64-R117 HydrophobicContact CD2-CG 4.02Å
65	P	94.6	Very high	91.3	Very high	69 Å²	69	62.9 Å²	62.9	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-46.3	173.7	-24.1	35.3	0	0	0	112.8	K61 L67 R68 E69	K61-P65 WeakPolarHBondContact O-CD 3.29Å; K61-P65 WeakPolarHBondContact O-CG 3.3Å; P65-L67 VanDerWaalsContact C-N 3.32Å; P65-L67 PolarHBondContact O-N 2.83Å; P65-R68 PolarHBondContact O-N 3.43Å; P65-E69 PolarHBondContact O-N 2.88Å
66	A	93.4	Very high	92	Very high	40 Å²	40	59.3 Å²	59.3	33%	0.331	30%	0.303	S	S	.	.	H	α-helix	trans	-60.9	-42.7	177.7	0	0	0	0	0	111.3	S63 R68 E69 A70 L96	S63-A66 PolarHBondContact O-N 2.85Å; A66-R68 PolarHBondContact O-N 3.42Å; A66-E69 PolarHBondContact O-N 3.47Å; A66-A70 PolarHBondContact O-N 2.91Å; A66-L96 HydrophobicContact CB-CD1 4.19Å; A66-L96 HydrophobicContact CB-CD2 4.38Å
67	L	95.3	Very high	92.3	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-58.8	-46.2	175.3	-177.4	69.1	0	0	0	112.4	S63 L64 P65 E69 A70 I71 I93 L96 I114 R117 I118	S63-L67 WeakPolarHBondContact O-CB 3.37Å; S63-L67 PolarHBondContact O-N 3.47Å; L64-L67 HydrophobicContact CD2-CD2 4.32Å; P65-L67 VanDerWaalsContact C-N 3.32Å; P65-L67 PolarHBondContact O-N 2.83Å; L67-E69 VanDerWaalsContact C-N 3.29Å; L67-E69 PolarHBondContact O-N 3.47Å; L67-A70 PolarHBondContact O-N 2.92Å; L67-I71 HydrophobicContact CD1-CD1 4.32Å; L67-I71 HydrophobicContact CG-CD1 4.02Å; L67-I71 VanDerWaalsContact O-CG1 3.32Å; L67-I71 WeakPolarHBondContact O-CG1 3.46Å; L67-I71 PolarHBondContact O-N 3.37Å; L67-I93 HydrophobicContact CD1-CG2 4.04Å; L67-L96 HydrophobicContact CB-CD1 4.1Å; L67-L96 HydrophobicContact CD1-CD1 4.21Å; L67-I114 HydrophobicContact CD1-CG2 4.37Å; L67-I114 HydrophobicContact CD2-CB 4.5Å; L67-I114 HydrophobicContact CD2-CG2 3.97Å; L67-R117 HydrophobicContact CD2-CB 3.95Å; L67-R117 HydrophobicContact CD2-CG 4.06Å; L67-I118 HydrophobicContact CD1-CD1 4.12Å; L67-I118 HydrophobicContact CD1-CG1 3.79Å; L67-I118 HydrophobicContact CD2-CG1 4.1Å; L67-I118 HydrophobicContact CG-CG1 4.33Å
68	R	94.7	Very high	92.4	Very high	105 Å²	105	57.7 Å²	57.7	40%	0.396	30%	0.296	S	S	.	.	H	α-helix	trans	-63.9	-35.8	178.6	-76	173.7	-174.1	158.5	6	112.4	L64 P65 A66 R72 D121	L64-R68 WeakPolarHBondContact O-CG 3.33Å; L64-R68 PolarHBondContact O-N 2.84Å; L64-R68 VanDerWaalsContact O-N 3.07Å; P65-R68 PolarHBondContact O-N 3.43Å; A66-R68 PolarHBondContact O-N 3.42Å; R68-R72 WeakPolarHBondContact O-CB 3.24Å; R68-R72 PolarHBondContact O-N 3.32Å; R68-R72 VanDerWaalsContact O-N 3.12Å; R68-D121 WeakPolarHBondContact CG-OD2 3.3Å; R68-D121 IonicContact NE-OD2 3.47Å
69	E	94.6	Very high	92.6	Very high	111 Å²	111	61.5 Å²	61.5	52%	0.519	30%	0.304	S	S	.	.	H	α-helix	trans	-67.4	-47.9	175.1	-173.1	168.3	-171.4	0	0	110.9	P65 A66 L67 I71 R72 N73	P65-E69 PolarHBondContact O-N 2.88Å; A66-E69 PolarHBondContact O-N 3.47Å; L67-E69 VanDerWaalsContact C-N 3.29Å; L67-E69 PolarHBondContact O-N 3.47Å; E69-I71 PolarHBondContact O-N 2.8Å; E69-R72 WeakPolarHBondContact O-CB 3.47Å; E69-R72 PolarHBondContact O-N 2.89Å; E69-R72 VanDerWaalsContact O-N 3.08Å; E69-N73 VanDerWaalsContact O-CG 3.29Å; E69-N73 PolarHBondContact O-N 3.02Å
70	A	94.9	Very high	92.6	Very high	3 Å²	3	65.4 Å²	65.4	3%	0.025	32%	0.324	C	S	.	.	H	α-helix	trans	-60.3	-41.4	177.5	0	0	0	0	0	112.6	A66 L67 R72 N73 L74 E92 I93	A66-A70 PolarHBondContact O-N 2.91Å; L67-A70 PolarHBondContact O-N 2.92Å; A70-R72 VanDerWaalsContact C-N 3.34Å; A70-R72 PolarHBondContact O-N 3.45Å; A70-N73 PolarHBondContact O-N 3.18Å; A70-L74 WeakPolarHBondContact O-CB 3.47Å; A70-L74 PolarHBondContact O-N 3.24Å; A70-E92 HydrophobicContact CB-CB 4.22Å; A70-I93 HydrophobicContact CB-CD1 4.41Å; A70-I93 HydrophobicContact CB-CG1 3.64Å
71	I	94.8	Very high	92.5	Very high	8 Å²	8	69.8 Å²	69.8	4%	0.041	36%	0.355	C	S	.	.	H	α-helix	trans	-64.7	-38.2	174.7	-66.9	169.1	0	0	0	111.4	L67 E69 L74 K75 I93 I118 D121	L67-I71 HydrophobicContact CD1-CD1 4.32Å; L67-I71 HydrophobicContact CG-CD1 4.02Å; L67-I71 VanDerWaalsContact O-CG1 3.32Å; L67-I71 WeakPolarHBondContact O-CG1 3.46Å; L67-I71 PolarHBondContact O-N 3.37Å; E69-I71 PolarHBondContact O-N 2.8Å; I71-L74 WeakPolarHBondContact O-CB 3.43Å; I71-L74 PolarHBondContact O-N 2.83Å; I71-K75 PolarHBondContact O-N 3.01Å; I71-I93 HydrophobicContact CG1-CD1 3.9Å; I71-I93 HydrophobicContact CG1-CG1 4.47Å; I71-I118 HydrophobicContact CD1-CG1 4.26Å; I71-D121 HydrophobicContact CD1-CB 3.95Å; I71-D121 HydrophobicContact CG2-CB 4.32Å
72	R	94.7	Very high	92.5	Very high	168 Å²	168	66 Å²	66	63%	0.634	34%	0.342	S	S	*	.	H	α-helix	trans	-66.1	-42.7	176.4	-168.3	-170.4	-51.7	155.5	9.4	111.2	R68 E69 A70 L74 K75 A76	R68-R72 WeakPolarHBondContact O-CB 3.24Å; R68-R72 PolarHBondContact O-N 3.32Å; R68-R72 VanDerWaalsContact O-N 3.12Å; E69-R72 WeakPolarHBondContact O-CB 3.47Å; E69-R72 PolarHBondContact O-N 2.89Å; E69-R72 VanDerWaalsContact O-N 3.08Å; A70-R72 VanDerWaalsContact C-N 3.34Å; A70-R72 PolarHBondContact O-N 3.45Å; R72-L74 VanDerWaalsContact C-N 3.34Å; R72-K75 PolarHBondContact O-N 3.39Å; R72-A76 PolarHBondContact O-N 3.15Å
73	N	94	Very high	92.7	Very high	53 Å²	53	62.6 Å²	62.6	28%	0.283	33%	0.328	S	S	.	.	H	α-helix	trans	-62.3	-43.3	175.6	-67.1	-13.4	0	0	0	110.6	E69 A70 K75 A76 A77 A89	E69-N73 VanDerWaalsContact O-CG 3.29Å; E69-N73 PolarHBondContact O-N 3.02Å; A70-N73 PolarHBondContact O-N 3.18Å; N73-K75 VanDerWaalsContact C-N 3.32Å; N73-K75 PolarHBondContact O-N 3.4Å; N73-A76 PolarHBondContact O-N 3.44Å; N73-A77 VanDerWaalsContact O-CB 3.24Å; N73-A77 WeakPolarHBondContact O-CB 3.22Å; N73-A77 PolarHBondContact O-N 3.39Å; N73-A89 HydrophobicContact CB-CB 4.36Å
74	L	94.7	Very high	92.6	Very high	1 Å²	1	66.2 Å²	66.2	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-58	-44.9	174.9	-176.3	62.1	0	0	0	112	A70 I71 R72 K78 T86 A89 V90 I93 L126 L130	A70-L74 WeakPolarHBondContact O-CB 3.47Å; A70-L74 PolarHBondContact O-N 3.24Å; I71-L74 WeakPolarHBondContact O-CB 3.43Å; I71-L74 PolarHBondContact O-N 2.83Å; R72-L74 VanDerWaalsContact C-N 3.34Å; L74-K78 WeakPolarHBondContact O-CB 3.13Å; L74-K78 PolarHBondContact O-N 2.88Å; L74-T86 HydrophobicContact CD1-CG2 3.93Å; L74-A89 HydrophobicContact CB-CB 3.84Å; L74-A89 HydrophobicContact CD1-CB 4.04Å; L74-V90 HydrophobicContact CD1-CG2 3.72Å; L74-I93 HydrophobicContact CB-CD1 4.48Å; L74-I93 HydrophobicContact CD2-CD1 3.92Å; L74-L126 HydrophobicContact CD2-CB 4.32Å; L74-L126 HydrophobicContact CD2-CD1 4.4Å; L74-L126 HydrophobicContact CG-CD1 4.47Å; L74-L130 HydrophobicContact CD1-CD1 4.04Å
75	K	94.1	Very high	92.5	Very high	112 Å²	112	67.6 Å²	67.6	49%	0.487	35%	0.352	S	S	.	.	H	α-helix	trans	-61.9	-47.7	177.9	-170.6	176.7	179	179.1	0	111.5	I71 R72 N73 K78 E79 L126	I71-K75 PolarHBondContact O-N 3.01Å; R72-K75 PolarHBondContact O-N 3.39Å; N73-K75 VanDerWaalsContact C-N 3.32Å; N73-K75 PolarHBondContact O-N 3.4Å; K75-K78 PolarHBondContact O-N 3.22Å; K75-E79 VanDerWaalsContact CE-OE1 3.28Å; K75-E79 WeakPolarHBondContact CE-OE1 3.36Å; K75-E79 WeakPolarHBondContact O-CG 3.11Å; K75-E79 PolarHBondContact O-N 3.17Å; K75-L126 HydrophobicContact CB-CD1 3.97Å; K75-L126 HydrophobicContact CG-CD1 4.4Å
76	A	93.8	Very high	92.5	Very high	41 Å²	41	64.5 Å²	64.5	34%	0.339	33%	0.332	S	S	.	.	H	α-helix	trans	-66.5	-43.2	-179.9	0	0	0	0	0	112.4	R72 N73 K78 E79 N80	R72-A76 PolarHBondContact O-N 3.15Å; N73-A76 PolarHBondContact O-N 3.44Å; A76-K78 VanDerWaalsContact C-N 3.29Å; A76-K78 PolarHBondContact O-N 3.24Å; A76-E79 PolarHBondContact O-N 3.28Å; A76-N80 WeakPolarHBondContact O-CB 3.16Å; A76-N80 VanDerWaalsContact O-CG 3.29Å; A76-N80 PolarHBondContact O-N 2.76Å; A76-N80 PolarHBondContact O-ND2 2.55Å; A76-N80 VanDerWaalsContact O-ND2 3.13Å
77	A	91.6	Very high	92.4	Very high	5 Å²	5	67 Å²	67	4%	0.041	33%	0.333	C	S	.	.	H	α-helix	trans	-59.2	-42.6	177.4	0	0	0	0	0	111.6	N73 N80 S81 D82 E85	N73-A77 VanDerWaalsContact O-CB 3.24Å; N73-A77 WeakPolarHBondContact O-CB 3.22Å; N73-A77 PolarHBondContact O-N 3.39Å; A77-N80 CarbonylContact O-C 3.34Å; A77-N80 PolarHBondContact O-N 2.69Å; A77-S81 PolarHBondContact O-N 3.29Å; A77-D82 PolarHBondContact O-N 3.02Å; A77-E85 HydrophobicContact CB-CB 3.74Å; A77-E85 HydrophobicContact CB-CG 3.86Å
78	K	89.2	Confident	92.3	Very high	51 Å²	51	72.8 Å²	72.8	22%	0.222	36%	0.355	C	S	.	.	H	α-helix	trans	-65.6	-45.7	176.5	-174.8	-180	-174	168.3	0	112.8	L74 K75 A76 N80 S81 L126 L130	L74-K78 WeakPolarHBondContact O-CB 3.13Å; L74-K78 PolarHBondContact O-N 2.88Å; K75-K78 PolarHBondContact O-N 3.22Å; A76-K78 VanDerWaalsContact C-N 3.29Å; A76-K78 PolarHBondContact O-N 3.24Å; K78-N80 PolarHBondContact O-N 3.27Å; K78-S81 PolarHBondContact O-N 3.3Å; K78-L126 HydrophobicContact CD-CD2 3.89Å; K78-L130 HydrophobicContact CD-CD2 4.17Å; K78-L130 HydrophobicContact CG-CD2 4.46Å
79	E	90.2	Very high	92.3	Very high	135 Å²	135	67.8 Å²	67.8	63%	0.631	34%	0.336	S	S	*	.	H	α-helix	trans	-59.3	-36.6	176.6	-74.7	172.2	-173.2	0	0	111.4	K75 A76 S81	K75-E79 VanDerWaalsContact CE-OE1 3.28Å; K75-E79 WeakPolarHBondContact CE-OE1 3.36Å; K75-E79 WeakPolarHBondContact O-CG 3.11Å; K75-E79 PolarHBondContact O-N 3.17Å; A76-E79 PolarHBondContact O-N 3.28Å; E79-S81 VanDerWaalsContact C-N 3.3Å; E79-S81 PolarHBondContact O-N 3.31Å
80	N	89.8	Confident	92.3	Very high	130 Å²	130	62.6 Å²	62.6	70%	0.695	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-1.5	176.7	-64.7	-32.1	0	0	0	114.1	A76 A77 K78 D82	A76-N80 WeakPolarHBondContact O-CB 3.16Å; A76-N80 VanDerWaalsContact O-CG 3.29Å; A76-N80 PolarHBondContact O-N 2.76Å; A76-N80 PolarHBondContact O-ND2 2.55Å; A76-N80 VanDerWaalsContact O-ND2 3.13Å; A77-N80 CarbonylContact O-C 3.34Å; A77-N80 PolarHBondContact O-N 2.69Å; K78-N80 PolarHBondContact O-N 3.27Å; N80-D82 PolarHBondContact O-N 2.95Å
81	S	86.5	Confident	92.3	Very high	103 Å²	103	64.6 Å²	64.6	72%	0.72	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	30.2	-174	-56.8	0	0	0	0	114.2	A77 K78 E79 S83	A77-S81 PolarHBondContact O-N 3.29Å; K78-S81 PolarHBondContact O-N 3.3Å; E79-S81 VanDerWaalsContact C-N 3.3Å; E79-S81 PolarHBondContact O-N 3.31Å; S81-S83 PolarHBondContact O-N 2.78Å
82	D	91.1	Very high	92.3	Very high	72 Å²	72	67.6 Å²	67.6	39%	0.385	34%	0.342	S	S	.	.			trans	-84.3	106.4	177.8	-170.3	-29	0	0	0	110.2	A77 N80 D84 E85 T86	A77-D82 PolarHBondContact O-N 3.02Å; N80-D82 PolarHBondContact O-N 2.95Å; D82-D84 PolarHBondContact OD1-N 2.7Å; D82-E85 HydrophobicContact CB-CB 4Å; D82-E85 PolarHBondContact OD1-N 3.35Å; D82-T86 VanDerWaalsContact O-CB 3.26Å; D82-T86 WeakPolarHBondContact O-CB 3.23Å; D82-T86 PolarHBondContact O-N 3.34Å; D82-T86 PolarHBondContact O-OG1 2.9Å
83	S	89.4	Confident	92.4	Very high	60 Å²	60	59.7 Å²	59.7	42%	0.42	31%	0.313	S	S	.	.	H	α-helix	trans	-69.5	-34.6	-177	-63.1	0	0	0	0	113	S81 R87	S81-S83 PolarHBondContact O-N 2.78Å; S83-R87 WeakPolarHBondContact O-CG 3.32Å; S83-R87 PolarHBondContact O-N 3.26Å; S83-R87 VanDerWaalsContact O-N 3.09Å
84	D	89.9	Confident	92.4	Very high	93 Å²	93	58.6 Å²	58.6	50%	0.497	31%	0.305	S	S	.	.	H	α-helix	trans	-75.2	-41.4	-178.1	-82.2	-13	0	0	0	111.2	D82 T86 R87 R88	D82-D84 PolarHBondContact OD1-N 2.7Å; D84-T86 VanDerWaalsContact C-N 3.35Å; D84-R87 PolarHBondContact O-N 3.35Å; D84-R87 IonicContact OD1-CZ 3.41Å; D84-R87 IonicContact OD1-NE 2.91Å; D84-R87 IonicContact OD1-NH2 3.69Å; D84-R87 PolarHBondContact OD1-NH2 2.83Å; D84-R88 PolarHBondContact O-N 2.73Å
85	E	92.1	Very high	92.3	Very high	58 Å²	58	63.7 Å²	63.7	27%	0.271	33%	0.328	S	S	.	.	H	α-helix	trans	-68.7	-36.9	176.1	-158.7	64.4	-147.9	0	0	111.3	A77 D82 R88 A89	A77-E85 HydrophobicContact CB-CB 3.74Å; A77-E85 HydrophobicContact CB-CG 3.86Å; D82-E85 HydrophobicContact CB-CB 4Å; D82-E85 PolarHBondContact OD1-N 3.35Å; E85-R88 VanDerWaalsContact CD-NH1 3.27Å; E85-R88 PolarHBondContact O-N 2.94Å; E85-R88 IonicContact OE1-NH1 2.68Å; E85-R88 PolarHBondContact OE1-NH1 3.01Å; E85-R88 VanDerWaalsContact OE1-NH1 3.14Å; E85-R88 IonicContact OE2-CZ 2.71Å; E85-R88 IonicContact OE2-NH1 3.08Å; E85-R88 PolarHBondContact OE2-NH1 3Å; E85-R88 IonicContact OE2-NH2 3.83Å; E85-A89 WeakPolarHBondContact O-CB 3.44Å; E85-A89 PolarHBondContact O-N 2.82Å
86	T	93.1	Very high	92.3	Very high	4 Å²	4	59.9 Å²	59.9	3%	0.025	31%	0.313	C	S	.	.	H	α-helix	trans	-60.6	-47.2	174.3	-61.8	0	0	0	0	111	L74 D82 D84 R88 A89 V90 L130 I138	L74-T86 HydrophobicContact CD1-CG2 3.93Å; D82-T86 VanDerWaalsContact O-CB 3.26Å; D82-T86 WeakPolarHBondContact O-CB 3.23Å; D82-T86 PolarHBondContact O-N 3.34Å; D82-T86 PolarHBondContact O-OG1 2.9Å; D84-T86 VanDerWaalsContact C-N 3.35Å; T86-R88 VanDerWaalsContact C-N 3.35Å; T86-R88 PolarHBondContact O-N 3.17Å; T86-A89 PolarHBondContact O-N 3.44Å; T86-V90 WeakPolarHBondContact O-CG2 3.47Å; T86-V90 PolarHBondContact O-N 3Å; T86-L130 HydrophobicContact CG2-CD1 4.12Å; T86-L130 HydrophobicContact CG2-CD2 3.92Å; T86-I138 HydrophobicContact CG2-CD1 4.17Å; T86-I138 HydrophobicContact CG2-CG2 4.01Å
87	R	92.8	Very high	92.2	Very high	91 Å²	91	57.9 Å²	57.9	34%	0.343	30%	0.297	S	S	.	.	H	α-helix	trans	-61.3	-43.3	177.1	-73.7	-172.3	-55.3	155.7	7.9	111.9	S83 D84 V90 A91 E137 I138	S83-R87 WeakPolarHBondContact O-CG 3.32Å; S83-R87 PolarHBondContact O-N 3.26Å; S83-R87 VanDerWaalsContact O-N 3.09Å; D84-R87 PolarHBondContact O-N 3.35Å; D84-R87 IonicContact OD1-CZ 3.41Å; D84-R87 IonicContact OD1-NE 2.91Å; D84-R87 IonicContact OD1-NH2 3.69Å; D84-R87 PolarHBondContact OD1-NH2 2.83Å; R87-V90 PolarHBondContact O-N 3.45Å; R87-A91 WeakPolarHBondContact O-CB 3.49Å; R87-A91 PolarHBondContact O-N 2.88Å; R87-E137 IonicContact CZ-OE2 3.1Å; R87-E137 IonicContact NE-OE2 3.15Å; R87-E137 IonicContact NH1-OE2 2.85Å; R87-E137 PolarHBondContact NH1-OE2 3.03Å; R87-I138 HydrophobicContact CG-CG1 3.88Å
88	R	93.4	Very high	92.1	Very high	124 Å²	124	62 Å²	62	47%	0.468	32%	0.315	S	S	.	.	H	α-helix	trans	-61.5	-47.5	178.6	-167.9	-175.9	-57	135	14.6	111.5	D84 E85 T86 V90 A91 E92	D84-R88 PolarHBondContact O-N 2.73Å; E85-R88 VanDerWaalsContact CD-NH1 3.27Å; E85-R88 PolarHBondContact O-N 2.94Å; E85-R88 IonicContact OE1-NH1 2.68Å; E85-R88 PolarHBondContact OE1-NH1 3.01Å; E85-R88 VanDerWaalsContact OE1-NH1 3.14Å; E85-R88 IonicContact OE2-CZ 2.71Å; E85-R88 IonicContact OE2-NH1 3.08Å; E85-R88 PolarHBondContact OE2-NH1 3Å; E85-R88 IonicContact OE2-NH2 3.83Å; T86-R88 VanDerWaalsContact C-N 3.35Å; T86-R88 PolarHBondContact O-N 3.17Å; R88-V90 PolarHBondContact O-N 2.92Å; R88-A91 PolarHBondContact O-N 2.77Å; R88-E92 WeakPolarHBondContact O-CG 3.46Å; R88-E92 PolarHBondContact O-N 3.01Å
89	A	94.6	Very high	92.1	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.008	33%	0.327	C	S	.	.	H	α-helix	trans	-64.2	-38.6	179.6	0	0	0	0	0	112.5	N73 L74 E85 T86 E92 I93	N73-A89 HydrophobicContact CB-CB 4.36Å; L74-A89 HydrophobicContact CB-CB 3.84Å; L74-A89 HydrophobicContact CD1-CB 4.04Å; E85-A89 WeakPolarHBondContact O-CB 3.44Å; E85-A89 PolarHBondContact O-N 2.82Å; T86-A89 PolarHBondContact O-N 3.44Å; A89-E92 PolarHBondContact O-N 3.3Å; A89-I93 VanDerWaalsContact O-CG1 3.31Å; A89-I93 WeakPolarHBondContact O-CG1 3.5Å; A89-I93 PolarHBondContact O-N 3.36Å; A89-I93 VanDerWaalsContact O-N 3.12Å
90	V	94.9	Very high	92	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-62.3	-44.9	173	170.8	0	0	0	0	111.2	L74 T86 R87 R88 E92 I93 Y94 L130 E141 L145	L74-V90 HydrophobicContact CD1-CG2 3.72Å; T86-V90 WeakPolarHBondContact O-CG2 3.47Å; T86-V90 PolarHBondContact O-N 3Å; R87-V90 PolarHBondContact O-N 3.45Å; R88-V90 PolarHBondContact O-N 2.92Å; V90-E92 PolarHBondContact O-N 3.15Å; V90-I93 PolarHBondContact O-N 2.54Å; V90-Y94 WeakPolarHBondContact O-CB 3.35Å; V90-Y94 PolarHBondContact O-N 3.32Å; V90-L130 HydrophobicContact CG2-CD1 4.12Å; V90-E141 HydrophobicContact CG1-CB 3.95Å; V90-L145 HydrophobicContact CG1-CB 4.24Å; V90-L145 HydrophobicContact CG1-CD2 4.05Å
91	A	94	Very high	91.8	Very high	45 Å²	45	53.4 Å²	53.4	37%	0.372	27%	0.271	S	S	.	.	H	α-helix	trans	-64.1	-38.7	178.7	0	0	0	0	0	112.6	R87 R88 Y94 Q95	R87-A91 WeakPolarHBondContact O-CB 3.49Å; R87-A91 PolarHBondContact O-N 2.88Å; R88-A91 PolarHBondContact O-N 2.77Å; A91-Y94 PolarHBondContact O-N 3.48Å; A91-Q95 WeakPolarHBondContact O-CB 3.3Å; A91-Q95 PolarHBondContact O-N 2.97Å
92	E	94.9	Very high	91.6	Very high	71 Å²	71	52.3 Å²	52.3	33%	0.332	26%	0.26	S	S	.	.	H	α-helix	trans	-62	-45.2	174.6	-74.6	171.4	-170.4	0	0	111.8	A70 R88 A89 V90 Q95 L96	A70-E92 HydrophobicContact CB-CB 4.22Å; R88-E92 WeakPolarHBondContact O-CG 3.46Å; R88-E92 PolarHBondContact O-N 3.01Å; A89-E92 PolarHBondContact O-N 3.3Å; V90-E92 PolarHBondContact O-N 3.15Å; E92-Q95 PolarHBondContact O-N 2.97Å; E92-L96 WeakPolarHBondContact O-CG 3.41Å; E92-L96 PolarHBondContact O-N 2.76Å; E92-L96 VanDerWaalsContact O-N 3.17Å
93	I	96	Very high	91.2	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.015	26%	0.255	C	S	.	.	H	α-helix	trans	-64.8	-43.2	176.3	-62	166.1	0	0	0	110.3	L67 A70 I71 L74 A89 V90 Q95 L96 V97 I118 L145	L67-I93 HydrophobicContact CD1-CG2 4.04Å; A70-I93 HydrophobicContact CB-CD1 4.41Å; A70-I93 HydrophobicContact CB-CG1 3.64Å; I71-I93 HydrophobicContact CG1-CD1 3.9Å; I71-I93 HydrophobicContact CG1-CG1 4.47Å; L74-I93 HydrophobicContact CB-CD1 4.48Å; L74-I93 HydrophobicContact CD2-CD1 3.92Å; A89-I93 VanDerWaalsContact O-CG1 3.31Å; A89-I93 WeakPolarHBondContact O-CG1 3.5Å; A89-I93 PolarHBondContact O-N 3.36Å; A89-I93 VanDerWaalsContact O-N 3.12Å; V90-I93 PolarHBondContact O-N 2.54Å; I93-Q95 VanDerWaalsContact C-N 3.33Å; I93-Q95 PolarHBondContact O-N 3.21Å; I93-L96 PolarHBondContact O-N 2.81Å; I93-V97 HydrophobicContact CG2-CG2 4.45Å; I93-V97 WeakPolarHBondContact O-CG2 3.5Å; I93-V97 PolarHBondContact O-N 2.93Å; I93-V97 VanDerWaalsContact O-N 3.07Å; I93-I118 HydrophobicContact CG2-CD1 3.81Å; I93-I118 HydrophobicContact CG2-CG1 4.37Å; I93-L145 HydrophobicContact CB-CD2 3.84Å; I93-L145 HydrophobicContact CG2-CD1 3.9Å; I93-L145 HydrophobicContact CG2-CD2 3.66Å; I93-L145 HydrophobicContact CG2-CG 4.43Å
94	Y	94.1	Very high	90.4	Very high	30 Å²	30	52.8 Å²	52.8	12%	0.118	26%	0.263	C	S	.	.	H	α-helix	trans	-57.4	-46.2	177	179.9	-86.7	0	0	0	111.8	V90 A91 L96 V97 E98 K144 L145 Q148	V90-Y94 WeakPolarHBondContact O-CB 3.35Å; V90-Y94 PolarHBondContact O-N 3.32Å; A91-Y94 PolarHBondContact O-N 3.48Å; Y94-L96 PolarHBondContact O-N 3.3Å; Y94-V97 PolarHBondContact O-N 3.29Å; Y94-E98 HydrophobicContact CE1-CB 4.24Å; Y94-E98 WeakPolarHBondContact CE1-OE2 3.31Å; Y94-E98 WeakPolarHBondContact O-CB 3.22Å; Y94-E98 PolarHBondContact O-N 3.15Å; Y94-K144 HydrophobicContact CD2-CD 4.39Å; Y94-K144 HydrophobicContact CD2-CG 4.39Å; Y94-K144 HydrophobicContact CE2-CD 3.82Å; Y94-K144 HydrophobicContact CE2-CG 3.76Å; Y94-K144 VanDerWaalsContact CZ-CE 3.44Å; Y94-K144 VanDerWaalsContact OH-CE 3.24Å; Y94-K144 WeakPolarHBondContact OH-CE 3.46Å; Y94-K144 PolarHBondContact OH-NZ 3.29Å; Y94-L145 HydrophobicContact CD2-CB 4.27Å; Y94-L145 HydrophobicContact CD2-CD1 4.5Å; Y94-Q148 HydrophobicContact CE2-CG 3.77Å
95	Q	93.3	Very high	89.5	Confident	107 Å²	107	54.7 Å²	54.7	50%	0.5	28%	0.278	S	S	.	.	H	α-helix	trans	-60.6	-44.1	178.5	-174.2	-179.5	-14	0	0	111.8	A91 E92 I93 V97 E98 E99	A91-Q95 WeakPolarHBondContact O-CB 3.3Å; A91-Q95 PolarHBondContact O-N 2.97Å; E92-Q95 PolarHBondContact O-N 2.97Å; I93-Q95 VanDerWaalsContact C-N 3.33Å; I93-Q95 PolarHBondContact O-N 3.21Å; Q95-V97 VanDerWaalsContact C-N 3.3Å; Q95-V97 PolarHBondContact O-N 2.77Å; Q95-E98 PolarHBondContact O-N 3.26Å; Q95-E99 HydrophobicContact CG-CG 4.4Å; Q95-E99 WeakPolarHBondContact CG-OE1 3.39Å; Q95-E99 PolarHBondContact NE2-OE1 3.22Å; Q95-E99 WeakPolarHBondContact O-CB 3.28Å; Q95-E99 VanDerWaalsContact O-CG 3.28Å; Q95-E99 WeakPolarHBondContact O-CG 3.3Å; Q95-E99 PolarHBondContact O-N 2.91Å
96	L	93.6	Very high	88.9	Confident	32 Å²	32	53.1 Å²	53.1	17%	0.168	27%	0.272	C	S	.	.	H	α-helix	trans	-62.4	-37.3	177.5	-70	171.6	0	0	0	112.6	A66 L67 E92 I93 Y94 A100	A66-L96 HydrophobicContact CB-CD1 4.19Å; A66-L96 HydrophobicContact CB-CD2 4.38Å; L67-L96 HydrophobicContact CB-CD1 4.1Å; L67-L96 HydrophobicContact CD1-CD1 4.21Å; E92-L96 WeakPolarHBondContact O-CG 3.41Å; E92-L96 PolarHBondContact O-N 2.76Å; E92-L96 VanDerWaalsContact O-N 3.17Å; I93-L96 PolarHBondContact O-N 2.81Å; Y94-L96 PolarHBondContact O-N 3.3Å; L96-A100 WeakPolarHBondContact O-CB 3.5Å; L96-A100 PolarHBondContact O-N 3.16Å
97	V	92.4	Very high	88.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-69.7	-46.2	176.9	172	0	0	0	0	110.8	I93 Y94 Q95 A100 W101 I114 I118 L145 Q148 I149	I93-V97 HydrophobicContact CG2-CG2 4.45Å; I93-V97 WeakPolarHBondContact O-CG2 3.5Å; I93-V97 PolarHBondContact O-N 2.93Å; I93-V97 VanDerWaalsContact O-N 3.07Å; Y94-V97 PolarHBondContact O-N 3.29Å; Q95-V97 VanDerWaalsContact C-N 3.3Å; Q95-V97 PolarHBondContact O-N 2.77Å; V97-A100 WeakPolarHBondContact O-CB 3.27Å; V97-A100 PolarHBondContact O-N 3.38Å; V97-W101 PolarHBondContact O-N 3.17Å; V97-W101 VanDerWaalsContact O-N 3.08Å; V97-I114 HydrophobicContact CG2-CG2 3.95Å; V97-I118 HydrophobicContact CG2-CD1 3.63Å; V97-L145 HydrophobicContact CG2-CD1 4.19Å; V97-Q148 HydrophobicContact CG1-CB 4.02Å; V97-I149 HydrophobicContact CG1-CG2 4.04Å; V97-I149 HydrophobicContact CG2-CG2 3.89Å
98	E	89.1	Confident	88	Confident	90 Å²	90	51.8 Å²	51.8	42%	0.421	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-45.2	178.8	-175.4	173.5	-133.7	0	0	111.5	Y94 Q95 A100 W101 V102	Y94-E98 HydrophobicContact CE1-CB 4.24Å; Y94-E98 WeakPolarHBondContact CE1-OE2 3.31Å; Y94-E98 WeakPolarHBondContact O-CB 3.22Å; Y94-E98 PolarHBondContact O-N 3.15Å; Q95-E98 PolarHBondContact O-N 3.26Å; E98-A100 VanDerWaalsContact C-N 3.26Å; E98-A100 PolarHBondContact O-N 2.97Å; E98-W101 PolarHBondContact O-N 2.9Å; E98-V102 WeakPolarHBondContact O-CG2 3.25Å; E98-V102 PolarHBondContact O-N 2.93Å
99	E	89.1	Confident	87.7	Confident	103 Å²	103	50.3 Å²	50.3	48%	0.481	27%	0.265	S	S	.	.	H	α-helix	trans	-57.7	-40.3	174.9	-75.8	175.9	-170.6	0	0	111.4	Q95 L103	Q95-E99 HydrophobicContact CG-CG 4.4Å; Q95-E99 WeakPolarHBondContact CG-OE1 3.39Å; Q95-E99 PolarHBondContact NE2-OE1 3.22Å; Q95-E99 WeakPolarHBondContact O-CB 3.28Å; Q95-E99 VanDerWaalsContact O-CG 3.28Å; Q95-E99 WeakPolarHBondContact O-CG 3.3Å; Q95-E99 PolarHBondContact O-N 2.91Å; E99-L103 WeakPolarHBondContact O-CG 3.42Å
100	A	89.3	Confident	87.5	Confident	4 Å²	4	50.3 Å²	50.3	3%	0.033	27%	0.265	C	S	.	.	H	α-helix	trans	-66.8	-40.9	178.8	0	0	0	0	0	113.2	L96 V97 E98 V102 L103 G107 V110 A111 I114	L96-A100 WeakPolarHBondContact O-CB 3.5Å; L96-A100 PolarHBondContact O-N 3.16Å; V97-A100 WeakPolarHBondContact O-CB 3.27Å; V97-A100 PolarHBondContact O-N 3.38Å; E98-A100 VanDerWaalsContact C-N 3.26Å; E98-A100 PolarHBondContact O-N 2.97Å; A100-V102 VanDerWaalsContact C-N 3.34Å; A100-V102 PolarHBondContact O-N 2.93Å; A100-L103 PolarHBondContact O-N 3.41Å; A100-G107 CarbonylContact O-C 3.46Å; A100-G107 WeakPolarHBondContact O-CA 3.34Å; A100-V110 HydrophobicContact CB-CG1 4.05Å; A100-A111 HydrophobicContact CB-CB 3.93Å; A100-I114 HydrophobicContact CB-CD1 3.59Å
101	W	84.8	Confident	87.3	Confident	29 Å²	29	50.3 Å²	50.3	11%	0.11	27%	0.265	C	S	.	.	H	α-helix	trans	-67.2	-32.6	-179.7	-78.8	119.1	0	0	0	113.3	V97 E98 L103 R108 A111 Q148 I151 A314	V97-W101 PolarHBondContact O-N 3.17Å; V97-W101 VanDerWaalsContact O-N 3.08Å; E98-W101 PolarHBondContact O-N 2.9Å; W101-L103 VanDerWaalsContact C-N 3.33Å; W101-R108 HydrophobicContact CZ3-CG 4.38Å; W101-A111 HydrophobicContact CD2-CB 3.52Å; W101-A111 HydrophobicContact CE3-CB 3.78Å; W101-A111 HydrophobicContact CG-CB 3.98Å; W101-A111 HydrophobicContact CH2-CB 4.15Å; W101-A111 HydrophobicContact CZ2-CB 3.94Å; W101-A111 HydrophobicContact CZ3-CB 4.09Å; W101-Q148 PolarHBondContact NE1-O 2.78Å; W101-I151 HydrophobicContact CH2-CG2 4.2Å; W101-I151 HydrophobicContact CZ2-CG2 3.97Å; W101-A314 HydrophobicContact CB-CB 4.22Å
102	V	83.1	Confident	87.1	Confident	80 Å²	80	51.2 Å²	51.2	49%	0.485	26%	0.261	S	S	.	.	H	α-helix	trans	-84.4	-7.3	-176.5	-177.3	0	0	0	0	112.7	E98 A100	E98-V102 WeakPolarHBondContact O-CG2 3.25Å; E98-V102 PolarHBondContact O-N 2.93Å; A100-V102 VanDerWaalsContact C-N 3.34Å; A100-V102 PolarHBondContact O-N 2.93Å
103	L	81.4	Confident	87	Confident	53 Å²	53	51.1 Å²	51.1	28%	0.277	26%	0.261	S	S	.	.			trans	-63.7	125.9	179.5	-74.8	169.9	0	0	0	111.9	V59 E99 A100 W101 G107 V110	V59-L103 HydrophobicContact CG1-CD1 3.73Å; E99-L103 WeakPolarHBondContact O-CG 3.42Å; A100-L103 PolarHBondContact O-N 3.41Å; W101-L103 VanDerWaalsContact C-N 3.33Å; L103-G107 VanDerWaalsContact O-CA 3.29Å; L103-G107 WeakPolarHBondContact O-CA 3.46Å; L103-G107 PolarHBondContact O-N 2.99Å; L103-G107 VanDerWaalsContact O-N 3.16Å; L103-V110 HydrophobicContact CD1-CB 4.43Å; L103-V110 HydrophobicContact CD1-CG1 4.22Å; L103-V110 HydrophobicContact CD1-CG2 4.44Å
104	P	71.9	Confident	86.9	Confident	90 Å²	90	51 Å²	51	58%	0.584	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	146.3	177.3	28.6	-34	0	0	0	110.2	V106	P104-V106 PolarHBondContact O-N 3.38Å
105	T	72.4	Confident	87	Confident	133 Å²	133	49.6 Å²	49.6	82%	0.816	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	-41.9	174.9	66.8	0	0	0	0	117.6
106	V	80	Confident	87	Confident	24 Å²	24	45.8 Å²	45.8	15%	0.145	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-9.8	-176.4	-65.1	0	0	0	0	114	D55 V56 P104 R108 Q109 V110	D55-V106 HydrophobicContact CB-CG1 4.29Å; V56-V106 HydrophobicContact CG2-CB 3.73Å; V56-V106 HydrophobicContact CG2-CG1 3.78Å; P104-V106 PolarHBondContact O-N 3.38Å; V106-R108 PolarHBondContact O-N 3.39Å; V106-Q109 PolarHBondContact O-N 3.45Å; V106-Q109 VanDerWaalsContact O-N 3.1Å; V106-V110 HydrophobicContact CB-CG2 4.49Å; V106-V110 HydrophobicContact CG2-CG2 4.42Å; V106-V110 PolarHBondContact O-N 3.38Å
107	G	82.8	Confident	87.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-54.2	-47.8	-169.1	0	0	0	0	0	115.3	A100 L103 Q109 V110 A111	A100-G107 CarbonylContact O-C 3.46Å; A100-G107 WeakPolarHBondContact O-CA 3.34Å; L103-G107 VanDerWaalsContact O-CA 3.29Å; L103-G107 WeakPolarHBondContact O-CA 3.46Å; L103-G107 PolarHBondContact O-N 2.99Å; L103-G107 VanDerWaalsContact O-N 3.16Å; G107-Q109 VanDerWaalsContact C-N 3.35Å; G107-Q109 PolarHBondContact O-N 3.43Å; G107-V110 PolarHBondContact O-N 2.9Å; G107-V110 VanDerWaalsContact O-N 3.14Å; G107-A111 VanDerWaalsContact O-CB 3.28Å; G107-A111 WeakPolarHBondContact O-CB 3.35Å; G107-A111 PolarHBondContact O-N 2.95Å
108	R	83.9	Confident	87.3	Confident	67 Å²	67	47.3 Å²	47.3	25%	0.253	24%	0.241	S	C	.	.	H	α-helix	trans	-55.9	-43.5	176.8	-177.1	176.5	-177.1	143.3	9.2	114	W101 V106 V110 A111 E112 Q318	W101-R108 HydrophobicContact CZ3-CG 4.38Å; V106-R108 PolarHBondContact O-N 3.39Å; R108-V110 VanDerWaalsContact C-N 3.34Å; R108-A111 PolarHBondContact O-N 3.45Å; R108-E112 HydrophobicContact CG-CG 4.28Å; R108-E112 WeakPolarHBondContact CG-OE1 3.41Å; R108-E112 IonicContact CZ-OE1 3.2Å; R108-E112 IonicContact NE-OE1 3.22Å; R108-E112 PolarHBondContact NE-OE1 2.91Å; R108-E112 IonicContact NH2-OE1 2.66Å; R108-E112 VanDerWaalsContact O-CB 3.24Å; R108-E112 WeakPolarHBondContact O-CB 3.48Å; R108-E112 WeakPolarHBondContact O-CG 3.37Å; R108-E112 PolarHBondContact O-N 3.41Å; R108-Q318 HydrophobicContact CB-CG 4.45Å; R108-Q318 VanDerWaalsContact N-NE2 3.1Å
109	Q	85.9	Confident	87.6	Confident	94 Å²	94	46 Å²	46	44%	0.439	23%	0.232	S	C	.	.	H	α-helix	trans	-67.8	-39.2	179.6	-67.1	-177	6.6	0	0	111	V56 V106 G107 E113	V56-Q109 HydrophobicContact CG1-CB 4.33Å; V56-Q109 HydrophobicContact CG2-CB 4.12Å; V106-Q109 PolarHBondContact O-N 3.45Å; V106-Q109 VanDerWaalsContact O-N 3.1Å; G107-Q109 VanDerWaalsContact C-N 3.35Å; G107-Q109 PolarHBondContact O-N 3.43Å; Q109-E113 PolarHBondContact O-N 3.44Å; Q109-E113 VanDerWaalsContact O-N 3.16Å
110	V	90.2	Very high	87.9	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-66	-47	176.1	177	0	0	0	0	110.7	V56 V59 L60 A100 L103 V106 G107 R108 E113 I114	V56-V110 HydrophobicContact CB-CG2 4.47Å; V56-V110 HydrophobicContact CG1-CG2 4.03Å; V56-V110 HydrophobicContact CG2-CG2 4.42Å; V59-V110 HydrophobicContact CB-CG2 4.25Å; V59-V110 HydrophobicContact CG1-CG1 3.8Å; V59-V110 HydrophobicContact CG1-CG2 4.27Å; L60-V110 HydrophobicContact CD2-CG1 3.94Å; L60-V110 HydrophobicContact CG-CG1 4.45Å; A100-V110 HydrophobicContact CB-CG1 4.05Å; L103-V110 HydrophobicContact CD1-CB 4.43Å; L103-V110 HydrophobicContact CD1-CG1 4.22Å; L103-V110 HydrophobicContact CD1-CG2 4.44Å; V106-V110 HydrophobicContact CB-CG2 4.49Å; V106-V110 HydrophobicContact CG2-CG2 4.42Å; V106-V110 PolarHBondContact O-N 3.38Å; G107-V110 PolarHBondContact O-N 2.9Å; G107-V110 VanDerWaalsContact O-N 3.14Å; R108-V110 VanDerWaalsContact C-N 3.34Å; V110-E113 PolarHBondContact O-N 3.28Å; V110-I114 HydrophobicContact CG1-CD1 3.84Å; V110-I114 WeakPolarHBondContact O-CG1 3.21Å; V110-I114 PolarHBondContact O-N 3.28Å
111	A	90.3	Very high	88.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-42.7	179.9	0	0	0	0	0	112	A100 W101 G107 R108 E113 I114 C115	A100-A111 HydrophobicContact CB-CB 3.93Å; W101-A111 HydrophobicContact CD2-CB 3.52Å; W101-A111 HydrophobicContact CE3-CB 3.78Å; W101-A111 HydrophobicContact CG-CB 3.98Å; W101-A111 HydrophobicContact CH2-CB 4.15Å; W101-A111 HydrophobicContact CZ2-CB 3.94Å; W101-A111 HydrophobicContact CZ3-CB 4.09Å; G107-A111 VanDerWaalsContact O-CB 3.28Å; G107-A111 WeakPolarHBondContact O-CB 3.35Å; G107-A111 PolarHBondContact O-N 2.95Å; R108-A111 PolarHBondContact O-N 3.45Å; A111-E113 VanDerWaalsContact C-N 3.32Å; A111-E113 PolarHBondContact O-N 3.01Å; A111-I114 PolarHBondContact O-N 3.47Å; A111-C115 VanDerWaalsContact O-CB 3.3Å; A111-C115 WeakPolarHBondContact O-CB 3.26Å; A111-C115 PolarHBondContact O-N 3.49Å; A111-C115 PolarHBondContact O-SG 2.81Å
112	E	90.7	Very high	88.5	Confident	65 Å²	65	48.4 Å²	48.4	30%	0.304	26%	0.256	S	S	.	.	H	α-helix	trans	-58.8	-43.2	174.1	-77.7	172.6	-177.5	0	0	111	R108 N116 I151	R108-E112 HydrophobicContact CG-CG 4.28Å; R108-E112 WeakPolarHBondContact CG-OE1 3.41Å; R108-E112 IonicContact CZ-OE1 3.2Å; R108-E112 IonicContact NE-OE1 3.22Å; R108-E112 PolarHBondContact NE-OE1 2.91Å; R108-E112 IonicContact NH2-OE1 2.66Å; R108-E112 VanDerWaalsContact O-CB 3.24Å; R108-E112 WeakPolarHBondContact O-CB 3.48Å; R108-E112 WeakPolarHBondContact O-CG 3.37Å; R108-E112 PolarHBondContact O-N 3.41Å; E112-N116 WeakPolarHBondContact O-CB 3.38Å; E112-N116 PolarHBondContact O-N 3.03Å; E112-N116 PolarHBondContact O-ND2 3.27Å; E112-N116 VanDerWaalsContact O-ND2 3.1Å; E112-I151 HydrophobicContact CG-CG2 4.35Å; E112-I151 WeakPolarHBondContact O-CD1 3.42Å
113	E	93.2	Very high	89	Confident	68 Å²	68	44.6 Å²	44.6	32%	0.318	23%	0.233	S	C	.	.	H	α-helix	trans	-68.6	-42.4	176.8	-175.4	59	-155.1	0	0	112.6	L60 Q109 V110 A111 C115 N116 R117	L60-E113 HydrophobicContact CD1-CB 4.13Å; L60-E113 HydrophobicContact CD1-CG 3.85Å; L60-E113 HydrophobicContact CD2-CB 3.97Å; L60-E113 HydrophobicContact CD2-CG 3.91Å; Q109-E113 PolarHBondContact O-N 3.44Å; Q109-E113 VanDerWaalsContact O-N 3.16Å; V110-E113 PolarHBondContact O-N 3.28Å; A111-E113 VanDerWaalsContact C-N 3.32Å; A111-E113 PolarHBondContact O-N 3.01Å; E113-C115 PolarHBondContact O-N 3.18Å; E113-N116 PolarHBondContact O-N 3.44Å; E113-R117 WeakPolarHBondContact O-CB 3.46Å; E113-R117 PolarHBondContact O-N 2.93Å
114	I	94.5	Very high	89.7	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-46.9	174.6	-76.3	169.8	0	0	0	110.6	L60 L64 L67 V97 A100 V110 A111 N116 R117 I118	L60-I114 HydrophobicContact CD2-CG1 4.21Å; L64-I114 HydrophobicContact CD2-CG1 4.44Å; L67-I114 HydrophobicContact CD1-CG2 4.37Å; L67-I114 HydrophobicContact CD2-CB 4.5Å; L67-I114 HydrophobicContact CD2-CG2 3.97Å; V97-I114 HydrophobicContact CG2-CG2 3.95Å; A100-I114 HydrophobicContact CB-CD1 3.59Å; V110-I114 HydrophobicContact CG1-CD1 3.84Å; V110-I114 WeakPolarHBondContact O-CG1 3.21Å; V110-I114 PolarHBondContact O-N 3.28Å; A111-I114 PolarHBondContact O-N 3.47Å; I114-N116 VanDerWaalsContact C-N 3.35Å; I114-N116 PolarHBondContact O-N 3.06Å; I114-R117 WeakPolarHBondContact O-CB 3.36Å; I114-R117 PolarHBondContact O-N 3.1Å; I114-R117 VanDerWaalsContact O-N 3.12Å; I114-I118 HydrophobicContact CG2-CD1 4.17Å; I114-I118 WeakPolarHBondContact O-CG1 3.36Å; I114-I118 PolarHBondContact O-N 3.11Å
115	C	94.9	Very high	90.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.6	-39.9	178.3	-68.6	0	0	0	0	112	A111 E113 R117 I118 R119 I149 I151 N154	A111-C115 VanDerWaalsContact O-CB 3.3Å; A111-C115 WeakPolarHBondContact O-CB 3.26Å; A111-C115 PolarHBondContact O-N 3.49Å; A111-C115 PolarHBondContact O-SG 2.81Å; E113-C115 PolarHBondContact O-N 3.18Å; C115-R117 VanDerWaalsContact C-N 3.32Å; C115-I118 PolarHBondContact O-N 2.9Å; C115-R119 PolarHBondContact O-N 2.73Å; C115-I149 HydrophobicContact CB-CB 4.45Å; C115-I151 HydrophobicContact CB-CD1 3.58Å; C115-I151 HydrophobicContact CB-CG1 3.81Å; C115-I151 HydrophobicContact CB-CG2 4.04Å; C115-N154 PolarHBondContact O-ND2 3.27Å
116	N	94.5	Very high	91.8	Very high	26 Å²	26	37.1 Å²	37.1	14%	0.139	18%	0.181	C	C	.	.	H	α-helix	trans	-62.7	-41	172.6	-84.7	-43	0	0	0	111.4	E112 E113 I114 R119 L120 E153	E112-N116 WeakPolarHBondContact O-CB 3.38Å; E112-N116 PolarHBondContact O-N 3.03Å; E112-N116 PolarHBondContact O-ND2 3.27Å; E112-N116 VanDerWaalsContact O-ND2 3.1Å; E113-N116 PolarHBondContact O-N 3.44Å; I114-N116 VanDerWaalsContact C-N 3.35Å; I114-N116 PolarHBondContact O-N 3.06Å; N116-R119 PolarHBondContact O-N 3.45Å; N116-R119 PolarHBondContact OD1-NH2 2.88Å; N116-L120 WeakPolarHBondContact O-CG 3.36Å; N116-L120 PolarHBondContact O-N 3.32Å; N116-E153 WeakPolarHBondContact OD1-CB 3.39Å
117	R	95.2	Very high	92.5	Very high	63 Å²	63	36.1 Å²	36.1	24%	0.238	17%	0.174	C	C	.	.	H	α-helix	trans	-66.3	-40.6	177.8	-168	71.1	-158.7	169.8	3.5	112.4	L64 L67 E113 I114 C115 R119 L120 D121	L64-R117 HydrophobicContact CD2-CB 4.03Å; L64-R117 HydrophobicContact CD2-CG 4.02Å; L67-R117 HydrophobicContact CD2-CB 3.95Å; L67-R117 HydrophobicContact CD2-CG 4.06Å; E113-R117 WeakPolarHBondContact O-CB 3.46Å; E113-R117 PolarHBondContact O-N 2.93Å; I114-R117 WeakPolarHBondContact O-CB 3.36Å; I114-R117 PolarHBondContact O-N 3.1Å; I114-R117 VanDerWaalsContact O-N 3.12Å; C115-R117 VanDerWaalsContact C-N 3.32Å; R117-R119 PolarHBondContact O-N 3.28Å; R117-L120 PolarHBondContact O-N 3.03Å; R117-D121 WeakPolarHBondContact CG-OD2 3.3Å; R117-D121 IonicContact CZ-OD1 3.72Å; R117-D121 IonicContact CZ-OD2 3.42Å; R117-D121 VanDerWaalsContact NE-CG 3.27Å; R117-D121 IonicContact NE-OD1 2.7Å; R117-D121 PolarHBondContact NE-OD1 3.11Å; R117-D121 IonicContact NE-OD2 3.08Å; R117-D121 PolarHBondContact NE-OD2 3.48Å; R117-D121 IonicContact NH2-OD1 3.73Å; R117-D121 PolarHBondContact NH2-OD1 3.24Å; R117-D121 IonicContact NH2-OD2 3.85Å; R117-D121 PolarHBondContact NH2-OD2 3.25Å; R117-D121 WeakPolarHBondContact O-CB 3.38Å; R117-D121 PolarHBondContact O-N 3.24Å
118	I	95.9	Very high	93.1	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-53.6	-44.2	173.1	-69.7	168.2	0	0	0	110.7	L67 I71 I93 V97 I114 C115 G123 L124 I149	L67-I118 HydrophobicContact CD1-CD1 4.12Å; L67-I118 HydrophobicContact CD1-CG1 3.79Å; L67-I118 HydrophobicContact CD2-CG1 4.1Å; L67-I118 HydrophobicContact CG-CG1 4.33Å; I71-I118 HydrophobicContact CD1-CG1 4.26Å; I93-I118 HydrophobicContact CG2-CD1 3.81Å; I93-I118 HydrophobicContact CG2-CG1 4.37Å; V97-I118 HydrophobicContact CG2-CD1 3.63Å; I114-I118 HydrophobicContact CG2-CD1 4.17Å; I114-I118 WeakPolarHBondContact O-CG1 3.36Å; I114-I118 PolarHBondContact O-N 3.11Å; C115-I118 PolarHBondContact O-N 2.9Å; I118-G123 WeakPolarHBondContact O-CA 3.39Å; I118-G123 PolarHBondContact O-N 3.2Å; I118-L124 PolarHBondContact O-N 3.25Å; I118-I149 HydrophobicContact CD1-CG2 3.84Å; I118-I149 HydrophobicContact CG2-CD1 4Å
119	R	95.4	Very high	93.5	Very high	62 Å²	62	37.1 Å²	37.1	23%	0.234	18%	0.182	C	C	.	.	H	α-helix	trans	-67.2	-47.7	176.6	177.4	177.7	54.1	77.7	2.9	112.4	C115 N116 R117 D121 G122 L124 N154 Y157	C115-R119 PolarHBondContact O-N 2.73Å; N116-R119 PolarHBondContact O-N 3.45Å; N116-R119 PolarHBondContact OD1-NH2 2.88Å; R117-R119 PolarHBondContact O-N 3.28Å; R119-D121 VanDerWaalsContact C-N 3.29Å; R119-D121 PolarHBondContact O-N 3.15Å; R119-G122 PolarHBondContact O-N 3.02Å; R119-G122 VanDerWaalsContact O-N 3.13Å; R119-L124 HydrophobicContact CB-CB 4.3Å; R119-L124 HydrophobicContact CB-CD2 4.2Å; R119-L124 HydrophobicContact CG-CD2 4.02Å; R119-N154 VanDerWaalsContact CB-OD1 3.3Å; R119-N154 WeakPolarHBondContact CB-OD1 3.49Å; R119-N154 WeakPolarHBondContact CD-OD1 3.46Å; R119-N154 PolarHBondContact NE-OD1 2.91Å; R119-Y157 HydrophobicContact CG-CD2 4.32Å; R119-Y157 HydrophobicContact CG-CG 4.49Å
120	L	94.8	Very high	93.8	Very high	108 Å²	108	32.9 Å²	32.9	57%	0.565	16%	0.162	S	C	*	.	H	α-helix	trans	-65.3	-30.4	-177.6	-69.3	175.2	0	0	0	113.3	N116 R117 G122	N116-L120 WeakPolarHBondContact O-CG 3.36Å; N116-L120 PolarHBondContact O-N 3.32Å; R117-L120 PolarHBondContact O-N 3.03Å; L120-G122 VanDerWaalsContact C-N 3.28Å
121	D	94.1	Very high	93.8	Very high	52 Å²	52	33.1 Å²	33.1	28%	0.278	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	6.2	176.8	-72.2	-24.3	0	0	0	113.4	R68 I71 R117 R119 G123	R68-D121 WeakPolarHBondContact CG-OD2 3.3Å; R68-D121 IonicContact NE-OD2 3.47Å; I71-D121 HydrophobicContact CD1-CB 3.95Å; I71-D121 HydrophobicContact CG2-CB 4.32Å; R117-D121 WeakPolarHBondContact CG-OD2 3.3Å; R117-D121 IonicContact CZ-OD1 3.72Å; R117-D121 IonicContact CZ-OD2 3.42Å; R117-D121 VanDerWaalsContact NE-CG 3.27Å; R117-D121 IonicContact NE-OD1 2.7Å; R117-D121 PolarHBondContact NE-OD1 3.11Å; R117-D121 IonicContact NE-OD2 3.08Å; R117-D121 PolarHBondContact NE-OD2 3.48Å; R117-D121 IonicContact NH2-OD1 3.73Å; R117-D121 PolarHBondContact NH2-OD1 3.24Å; R117-D121 IonicContact NH2-OD2 3.85Å; R117-D121 PolarHBondContact NH2-OD2 3.25Å; R117-D121 WeakPolarHBondContact O-CB 3.38Å; R117-D121 PolarHBondContact O-N 3.24Å; R119-D121 VanDerWaalsContact C-N 3.29Å; R119-D121 PolarHBondContact O-N 3.15Å; D121-G123 VanDerWaalsContact C-N 3.29Å; D121-G123 PolarHBondContact O-N 3.35Å
122	G	93.3	Very high	93.8	Very high	27 Å²	27	39.4 Å²	39.4	28%	0.278	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	5.9	177.9	0	0	0	0	0	114.7	R119 L120 L124 E125 L126	R119-G122 PolarHBondContact O-N 3.02Å; R119-G122 VanDerWaalsContact O-N 3.13Å; L120-G122 VanDerWaalsContact C-N 3.28Å; G122-L124 VanDerWaalsContact C-N 3.32Å; G122-L124 PolarHBondContact O-N 2.94Å; G122-E125 PolarHBondContact O-N 3.12Å; G122-L126 WeakPolarHBondContact O-CG 3.43Å; G122-L126 PolarHBondContact O-N 3.41Å
123	G	94.3	Very high	93.7	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-61.1	-38.7	177.1	0	0	0	0	0	112.8	I118 D121 E125 L126 L127	I118-G123 WeakPolarHBondContact O-CA 3.39Å; I118-G123 PolarHBondContact O-N 3.2Å; D121-G123 VanDerWaalsContact C-N 3.29Å; D121-G123 PolarHBondContact O-N 3.35Å; G123-E125 PolarHBondContact O-N 2.86Å; G123-L126 WeakPolarHBondContact O-CB 3.41Å; G123-L126 PolarHBondContact O-N 2.79Å; G123-L127 WeakPolarHBondContact O-CG 3.39Å; G123-L127 PolarHBondContact O-N 3.06Å
124	L	95	Very high	93.3	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-63.6	-39.8	178.7	-175.3	60.3	0	0	0	112.6	I118 R119 G122 L127 L128 L146 I149 N154 Y157 V158	I118-L124 PolarHBondContact O-N 3.25Å; R119-L124 HydrophobicContact CB-CB 4.3Å; R119-L124 HydrophobicContact CB-CD2 4.2Å; R119-L124 HydrophobicContact CG-CD2 4.02Å; G122-L124 VanDerWaalsContact C-N 3.32Å; G122-L124 PolarHBondContact O-N 2.94Å; L124-L127 PolarHBondContact O-N 3.06Å; L124-L128 WeakPolarHBondContact O-CG 3.44Å; L124-L128 PolarHBondContact O-N 3.23Å; L124-L128 VanDerWaalsContact O-N 3.08Å; L124-L146 HydrophobicContact CD1-CD1 3.56Å; L124-I149 HydrophobicContact CD1-CD1 3.78Å; L124-N154 HydrophobicContact CD2-CB 4.16Å; L124-Y157 HydrophobicContact CD2-CD1 3.45Å; L124-Y157 VanDerWaalsContact CD2-CD1 3.45Å; L124-Y157 HydrophobicContact CD2-CE1 4.14Å; L124-Y157 HydrophobicContact CD2-CG 3.88Å; L124-Y157 HydrophobicContact CG-CD1 4.04Å; L124-Y157 HydrophobicContact CG-CE1 4.29Å; L124-V158 HydrophobicContact CD1-CG2 4.22Å; L124-V158 HydrophobicContact CD2-CG2 4.25Å
125	E	94.7	Very high	93	Very high	96 Å²	96	42.7 Å²	42.7	45%	0.449	23%	0.23	S	C	.	.	H	α-helix	trans	-66.4	-41.2	175.7	-171.9	177.3	165.1	0	0	111.3	G122 G123 L127 L128 Q129	G122-E125 PolarHBondContact O-N 3.12Å; G123-E125 PolarHBondContact O-N 2.86Å; E125-L127 VanDerWaalsContact C-N 3.33Å; E125-L127 PolarHBondContact O-N 3.37Å; E125-L128 PolarHBondContact O-N 3.28Å; E125-Q129 VanDerWaalsContact O-CG 3.31Å; E125-Q129 WeakPolarHBondContact O-CG 3.48Å; E125-Q129 PolarHBondContact O-N 3.22Å; E125-Q129 PolarHBondContact OE1-NE2 3.31Å
126	L	94.4	Very high	92.6	Very high	22 Å²	22	46 Å²	46	12%	0.115	25%	0.25	C	S	.	.	H	α-helix	trans	-58.2	-45.8	174.2	-70.3	171.6	0	0	0	111.2	L74 K75 K78 G122 G123 Q129 L130	L74-L126 HydrophobicContact CD2-CB 4.32Å; L74-L126 HydrophobicContact CD2-CD1 4.4Å; L74-L126 HydrophobicContact CG-CD1 4.47Å; K75-L126 HydrophobicContact CB-CD1 3.97Å; K75-L126 HydrophobicContact CG-CD1 4.4Å; K78-L126 HydrophobicContact CD-CD2 3.89Å; G122-L126 WeakPolarHBondContact O-CG 3.43Å; G122-L126 PolarHBondContact O-N 3.41Å; G123-L126 WeakPolarHBondContact O-CB 3.41Å; G123-L126 PolarHBondContact O-N 2.79Å; L126-Q129 PolarHBondContact O-N 2.93Å; L126-L130 VanDerWaalsContact O-CG 3.31Å; L126-L130 WeakPolarHBondContact O-CG 3.5Å; L126-L130 PolarHBondContact O-N 2.96Å
127	L	94.9	Very high	92.3	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-61.4	-45	178.2	-68.4	171.5	0	0	0	112.3	G123 L124 E125 Q129 L130 Q131 L145 I149	G123-L127 WeakPolarHBondContact O-CG 3.39Å; G123-L127 PolarHBondContact O-N 3.06Å; L124-L127 PolarHBondContact O-N 3.06Å; E125-L127 VanDerWaalsContact C-N 3.33Å; E125-L127 PolarHBondContact O-N 3.37Å; L127-Q129 VanDerWaalsContact C-N 3.27Å; L127-Q129 PolarHBondContact O-N 3.39Å; L127-L130 HydrophobicContact CD2-CD1 4.41Å; L127-L130 WeakPolarHBondContact O-CB 3.35Å; L127-L130 PolarHBondContact O-N 3.44Å; L127-L130 VanDerWaalsContact O-N 3.09Å; L127-Q131 WeakPolarHBondContact O-CG 3.4Å; L127-Q131 PolarHBondContact O-N 3.34Å; L127-L145 HydrophobicContact CD1-CD2 3.92Å; L127-L145 HydrophobicContact CD1-CG 3.95Å; L127-L145 HydrophobicContact CD2-CD2 3.72Å; L127-L145 HydrophobicContact CD2-CG 4.3Å; L127-L145 HydrophobicContact CG-CD2 4.44Å; L127-I149 HydrophobicContact CD1-CD1 3.51Å
128	L	94.4	Very high	92.1	Very high	8 Å²	8	47.6 Å²	47.6	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-61.6	-36.2	176.9	-72	172.2	0	0	0	112.5	L124 E125 Q131 L146 Y157 V165	L124-L128 WeakPolarHBondContact O-CG 3.44Å; L124-L128 PolarHBondContact O-N 3.23Å; L124-L128 VanDerWaalsContact O-N 3.08Å; E125-L128 PolarHBondContact O-N 3.28Å; L128-Q131 WeakPolarHBondContact O-CB 3.43Å; L128-L146 HydrophobicContact CD2-CD2 4.21Å; L128-Y157 HydrophobicContact CD1-CE1 4.11Å; L128-V165 WeakPolarHBondContact O-CG1 3.27Å
129	Q	93.1	Very high	91.9	Very high	80 Å²	80	48.2 Å²	48.2	37%	0.374	26%	0.263	S	S	.	.	H	α-helix	trans	-73.2	-32.3	174.8	-67.7	170.3	3.9	0	0	111.8	E125 L126 L127 Q131 Q132	E125-Q129 VanDerWaalsContact O-CG 3.31Å; E125-Q129 WeakPolarHBondContact O-CG 3.48Å; E125-Q129 PolarHBondContact O-N 3.22Å; E125-Q129 PolarHBondContact OE1-NE2 3.31Å; L126-Q129 PolarHBondContact O-N 2.93Å; L127-Q129 VanDerWaalsContact C-N 3.27Å; L127-Q129 PolarHBondContact O-N 3.39Å; Q129-Q131 VanDerWaalsContact C-N 3.26Å; Q129-Q131 PolarHBondContact O-N 2.89Å; Q129-Q132 PolarHBondContact O-N 3.42Å; Q129-Q132 VanDerWaalsContact O-N 3.14Å
130	L	92.7	Very high	91.6	Very high	5 Å²	5	47.6 Å²	47.6	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-65.6	-28.6	176.1	-71	174.8	0	0	0	112.5	L74 K78 T86 V90 L126 L127 Q132 T133 I138	L74-L130 HydrophobicContact CD1-CD1 4.04Å; K78-L130 HydrophobicContact CD-CD2 4.17Å; K78-L130 HydrophobicContact CG-CD2 4.46Å; T86-L130 HydrophobicContact CG2-CD1 4.12Å; T86-L130 HydrophobicContact CG2-CD2 3.92Å; V90-L130 HydrophobicContact CG2-CD1 4.12Å; L126-L130 VanDerWaalsContact O-CG 3.31Å; L126-L130 WeakPolarHBondContact O-CG 3.5Å; L126-L130 PolarHBondContact O-N 2.96Å; L127-L130 HydrophobicContact CD2-CD1 4.41Å; L127-L130 WeakPolarHBondContact O-CB 3.35Å; L127-L130 PolarHBondContact O-N 3.44Å; L127-L130 VanDerWaalsContact O-N 3.09Å; L130-Q132 PolarHBondContact O-N 2.89Å; L130-Q132 VanDerWaalsContact O-N 3.11Å; L130-T133 WeakPolarHBondContact CA-OG1 3.42Å; L130-T133 WeakPolarHBondContact O-CB 3.26Å; L130-T133 PolarHBondContact O-N 3.01Å; L130-T133 VanDerWaalsContact O-N 3.16Å; L130-T133 PolarHBondContact O-OG1 3.25Å; L130-I138 HydrophobicContact CB-CG2 4.24Å; L130-I138 HydrophobicContact CD1-CG2 4.41Å; L130-I138 HydrophobicContact CD2-CG2 4.02Å; L130-I138 HydrophobicContact CG-CG2 4.44Å
131	Q	90.5	Very high	91.4	Very high	7 Å²	7	46 Å²	46	3%	0.033	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-15.4	172.5	-59.2	-49.3	-46.4	0	0	113.9	L127 L128 Q129 S142 A143 V165 L169	L127-Q131 WeakPolarHBondContact O-CG 3.4Å; L127-Q131 PolarHBondContact O-N 3.34Å; L128-Q131 WeakPolarHBondContact O-CB 3.43Å; Q129-Q131 VanDerWaalsContact C-N 3.26Å; Q129-Q131 PolarHBondContact O-N 2.89Å; Q131-S142 VanDerWaalsContact NE2-C 3.27Å; Q131-S142 PolarHBondContact NE2-OG 3.01Å; Q131-A143 VanDerWaalsContact NE2-N 3.18Å; Q131-V165 HydrophobicContact CB-CG1 3.49Å; Q131-V165 VanDerWaalsContact CB-CG1 3.49Å; Q131-V165 HydrophobicContact CG-CG1 4.08Å; Q131-L169 HydrophobicContact CB-CD1 4.19Å; Q131-L169 HydrophobicContact CG-CD1 4.19Å
132	Q	89.3	Confident	91.4	Very high	132 Å²	132	43.6 Å²	43.6	62%	0.617	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.8	4.4	-178	-57.9	174.6	39.6	0	0	112.5	Q129 L130 V165	Q129-Q132 PolarHBondContact O-N 3.42Å; Q129-Q132 VanDerWaalsContact O-N 3.14Å; L130-Q132 PolarHBondContact O-N 2.89Å; L130-Q132 VanDerWaalsContact O-N 3.11Å; Q132-V165 HydrophobicContact CG-CG1 4.07Å; Q132-V165 VanDerWaalsContact NE2-CG2 3.26Å
133	T	88.8	Confident	91.3	Very high	54 Å²	54	42.3 Å²	42.3	33%	0.331	22%	0.224	S	C	.	.	S	Bend	trans	-74.2	158.5	179.7	-35.7	0	0	0	0	110.4	L130 A135 I139	L130-T133 WeakPolarHBondContact CA-OG1 3.42Å; L130-T133 WeakPolarHBondContact O-CB 3.26Å; L130-T133 PolarHBondContact O-N 3.01Å; L130-T133 VanDerWaalsContact O-N 3.16Å; L130-T133 PolarHBondContact O-OG1 3.25Å; T133-A135 VanDerWaalsContact C-N 3.31Å; T133-A135 HydrophobicContact CG2-CB 4.3Å; T133-I139 WeakPolarHBondContact O-CD1 3.3Å
134	S	85.1	Confident	91.2	Very high	119 Å²	119	46 Å²	46	83%	0.832	24%	0.24	S	C	*	.	S	Bend	trans	-77.5	-15.9	172.2	53.6	0	0	0	0	113.7	V136	S134-V136 PolarHBondContact O-N 2.95Å
135	A	87.8	Confident	91.2	Very high	30 Å²	30	46 Å²	46	25%	0.248	24%	0.24	C	C	.	.			trans	-82.1	99.6	-177.1	0	0	0	0	0	111.4	T133 E137 I138 I139	T133-A135 VanDerWaalsContact C-N 3.31Å; T133-A135 HydrophobicContact CG2-CB 4.3Å; A135-E137 VanDerWaalsContact C-N 3.32Å; A135-E137 PolarHBondContact O-N 3.01Å; A135-I138 HydrophobicContact CB-CB 4.27Å; A135-I138 HydrophobicContact CB-CD1 3.84Å; A135-I138 HydrophobicContact CB-CG1 4.04Å; A135-I138 WeakPolarHBondContact O-CB 3.34Å; A135-I138 PolarHBondContact O-N 3.39Å; A135-I139 PolarHBondContact O-N 3.5Å
136	V	86.9	Confident	91.2	Very high	70 Å²	70	41.4 Å²	41.4	42%	0.424	22%	0.219	S	C	.	.	H	α-helix	trans	-56.8	-39.8	-174.6	178.9	0	0	0	0	113.2	S134 I138 I139 Y140	S134-V136 PolarHBondContact O-N 2.95Å; V136-I138 VanDerWaalsContact C-N 3.3Å; V136-I138 PolarHBondContact O-N 2.91Å; V136-I139 WeakPolarHBondContact O-CB 3.48Å; V136-I139 PolarHBondContact O-N 3.38Å; V136-I139 VanDerWaalsContact O-N 3.16Å; V136-Y140 HydrophobicContact CG1-CD1 4.32Å; V136-Y140 HydrophobicContact CG1-CD2 4.31Å; V136-Y140 HydrophobicContact CG1-CE1 3.53Å; V136-Y140 HydrophobicContact CG1-CE2 3.56Å; V136-Y140 WeakPolarHBondContact CG1-OH 3.34Å; V136-Y140 PolarHBondContact O-N 3.35Å
137	E	88.4	Confident	91	Very high	114 Å²	114	41.4 Å²	41.4	53%	0.533	22%	0.218	S	C	.	.	H	α-helix	trans	-61.4	-38	177.3	-63.2	-177.8	-176.8	0	0	112.8	R87 A135 I139 Y140 E141	R87-E137 IonicContact CZ-OE2 3.1Å; R87-E137 IonicContact NE-OE2 3.15Å; R87-E137 IonicContact NH1-OE2 2.85Å; R87-E137 PolarHBondContact NH1-OE2 3.03Å; A135-E137 VanDerWaalsContact C-N 3.32Å; A135-E137 PolarHBondContact O-N 3.01Å; E137-I139 VanDerWaalsContact C-N 3.35Å; E137-Y140 PolarHBondContact O-N 3Å; E137-E141 PolarHBondContact O-N 3.06Å; E137-E141 VanDerWaalsContact O-N 3.17Å
138	I	90.9	Very high	90.8	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-69.2	-38.6	178	-62.5	179.4	0	0	0	109.8	T86 R87 L130 A135 V136 Y140 S142	T86-I138 HydrophobicContact CG2-CD1 4.17Å; T86-I138 HydrophobicContact CG2-CG2 4.01Å; R87-I138 HydrophobicContact CG-CG1 3.88Å; L130-I138 HydrophobicContact CB-CG2 4.24Å; L130-I138 HydrophobicContact CD1-CG2 4.41Å; L130-I138 HydrophobicContact CD2-CG2 4.02Å; L130-I138 HydrophobicContact CG-CG2 4.44Å; A135-I138 HydrophobicContact CB-CB 4.27Å; A135-I138 HydrophobicContact CB-CD1 3.84Å; A135-I138 HydrophobicContact CB-CG1 4.04Å; A135-I138 WeakPolarHBondContact O-CB 3.34Å; A135-I138 PolarHBondContact O-N 3.39Å; V136-I138 VanDerWaalsContact C-N 3.3Å; V136-I138 PolarHBondContact O-N 2.91Å; I138-Y140 VanDerWaalsContact C-N 3.33Å; I138-Y140 PolarHBondContact O-N 3.36Å; I138-S142 WeakPolarHBondContact O-CB 3.26Å; I138-S142 PolarHBondContact O-N 3.47Å; I138-S142 PolarHBondContact O-OG 3.09Å
139	I	90.6	Very high	90.8	Very high	15 Å²	15	42.2 Å²	42.2	8%	0.077	22%	0.222	C	C	.	.	H	α-helix	trans	-58.2	-48.5	175	-59.1	175.2	0	0	0	109.5	T133 A135 V136 E137 S142 A143 L169 L178	T133-I139 WeakPolarHBondContact O-CD1 3.3Å; A135-I139 PolarHBondContact O-N 3.5Å; V136-I139 WeakPolarHBondContact O-CB 3.48Å; V136-I139 PolarHBondContact O-N 3.38Å; V136-I139 VanDerWaalsContact O-N 3.16Å; E137-I139 VanDerWaalsContact C-N 3.35Å; I139-S142 PolarHBondContact O-N 3.02Å; I139-S142 PolarHBondContact O-OG 3.06Å; I139-A143 WeakPolarHBondContact O-CB 3.3Å; I139-A143 PolarHBondContact O-N 3.02Å; I139-L169 HydrophobicContact CG2-CD2 4.24Å; I139-L178 HydrophobicContact CG2-CD1 3.71Å
140	Y	90.4	Very high	90.8	Very high	49 Å²	49	38.7 Å²	38.7	19%	0.192	21%	0.205	C	C	.	.	H	α-helix	trans	-60.1	-52.9	-179	-59.5	-22.7	0	0	0	113	V136 E137 I138 S142 A143 K144 D175 Q177 L178	V136-Y140 HydrophobicContact CG1-CD1 4.32Å; V136-Y140 HydrophobicContact CG1-CD2 4.31Å; V136-Y140 HydrophobicContact CG1-CE1 3.53Å; V136-Y140 HydrophobicContact CG1-CE2 3.56Å; V136-Y140 WeakPolarHBondContact CG1-OH 3.34Å; V136-Y140 PolarHBondContact O-N 3.35Å; E137-Y140 PolarHBondContact O-N 3Å; I138-Y140 VanDerWaalsContact C-N 3.33Å; I138-Y140 PolarHBondContact O-N 3.36Å; Y140-S142 VanDerWaalsContact C-N 3.34Å; Y140-S142 PolarHBondContact O-N 3.04Å; Y140-A143 PolarHBondContact O-N 2.98Å; Y140-K144 WeakPolarHBondContact O-CB 3.22Å; Y140-K144 PolarHBondContact O-N 3.13Å; Y140-D175 VanDerWaalsContact OH-CG 3.31Å; Y140-D175 PolarHBondContact OH-OD1 3.16Å; Y140-D175 VanDerWaalsContact OH-OD1 3.13Å; Y140-D175 PolarHBondContact OH-OD2 3.48Å; Y140-Q177 HydrophobicContact CD1-CB 4.36Å; Y140-Q177 HydrophobicContact CD1-CG 3.96Å; Y140-Q177 HydrophobicContact CD2-CB 4.22Å; Y140-Q177 HydrophobicContact CD2-CG 3.45Å; Y140-Q177 VanDerWaalsContact CD2-CG 3.45Å; Y140-Q177 HydrophobicContact CE1-CB 4Å; Y140-Q177 HydrophobicContact CE1-CG 4.08Å; Y140-Q177 HydrophobicContact CE2-CB 3.81Å; Y140-Q177 HydrophobicContact CE2-CG 3.55Å; Y140-Q177 HydrophobicContact CG-CB 4.46Å; Y140-Q177 HydrophobicContact CG-CG 3.64Å; Y140-L178 HydrophobicContact CD1-CB 4.46Å; Y140-L178 HydrophobicContact CD1-CD1 4.36Å; Y140-L178 HydrophobicContact CE1-CB 3.96Å; Y140-L178 HydrophobicContact CE1-CD1 4.48Å
141	E	90.6	Very high	90.7	Very high	75 Å²	75	38.9 Å²	38.9	35%	0.35	21%	0.206	S	C	.	.	H	α-helix	trans	-64.7	-40.7	-178.1	-65.9	-59.1	151.5	0	0	111.5	V90 E137 K144 L145	V90-E141 HydrophobicContact CG1-CB 3.95Å; E137-E141 PolarHBondContact O-N 3.06Å; E137-E141 VanDerWaalsContact O-N 3.17Å; E141-K144 PolarHBondContact O-N 2.89Å; E141-L145 PolarHBondContact O-N 2.68Å
142	S	93.3	Very high	90.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-72.5	-31.8	178.5	62.1	0	0	0	0	112.9	Q131 I138 I139 Y140 L145 L146	Q131-S142 VanDerWaalsContact NE2-C 3.27Å; Q131-S142 PolarHBondContact NE2-OG 3.01Å; I138-S142 WeakPolarHBondContact O-CB 3.26Å; I138-S142 PolarHBondContact O-N 3.47Å; I138-S142 PolarHBondContact O-OG 3.09Å; I139-S142 PolarHBondContact O-N 3.02Å; I139-S142 PolarHBondContact O-OG 3.06Å; Y140-S142 VanDerWaalsContact C-N 3.34Å; Y140-S142 PolarHBondContact O-N 3.04Å; S142-L145 PolarHBondContact O-N 3.35Å; S142-L146 WeakPolarHBondContact O-CB 3.07Å; S142-L146 PolarHBondContact O-N 2.71Å
143	A	92.1	Very high	90.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-69.6	-40.1	174.2	0	0	0	0	0	111.1	Q131 I139 Y140 L146 E147 I185	Q131-A143 VanDerWaalsContact NE2-N 3.18Å; I139-A143 WeakPolarHBondContact O-CB 3.3Å; I139-A143 PolarHBondContact O-N 3.02Å; Y140-A143 PolarHBondContact O-N 2.98Å; A143-L146 PolarHBondContact O-N 3.46Å; A143-E147 PolarHBondContact O-N 3.48Å; A143-I185 HydrophobicContact CB-CD1 4.13Å
144	K	91	Very high	91.1	Very high	80 Å²	80	37.2 Å²	37.2	35%	0.348	20%	0.202	S	C	.	.	H	α-helix	trans	-61.3	-42.3	173.2	-166.6	-166.2	180	-162.5	0	111.8	Y94 Y140 E141 E147 Q148	Y94-K144 HydrophobicContact CD2-CD 4.39Å; Y94-K144 HydrophobicContact CD2-CG 4.39Å; Y94-K144 HydrophobicContact CE2-CD 3.82Å; Y94-K144 HydrophobicContact CE2-CG 3.76Å; Y94-K144 VanDerWaalsContact CZ-CE 3.44Å; Y94-K144 VanDerWaalsContact OH-CE 3.24Å; Y94-K144 WeakPolarHBondContact OH-CE 3.46Å; Y94-K144 PolarHBondContact OH-NZ 3.29Å; Y140-K144 WeakPolarHBondContact O-CB 3.22Å; Y140-K144 PolarHBondContact O-N 3.13Å; E141-K144 PolarHBondContact O-N 2.89Å; K144-E147 WeakPolarHBondContact O-CB 3.45Å; K144-Q148 WeakPolarHBondContact O-CG 3.49Å
145	L	94.5	Very high	91.6	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66.2	-42.8	172.3	172.7	57.8	0	0	0	112	V90 I93 Y94 V97 L127 E141 S142 E147 Q148 I149	V90-L145 HydrophobicContact CG1-CB 4.24Å; V90-L145 HydrophobicContact CG1-CD2 4.05Å; I93-L145 HydrophobicContact CB-CD2 3.84Å; I93-L145 HydrophobicContact CG2-CD1 3.9Å; I93-L145 HydrophobicContact CG2-CD2 3.66Å; I93-L145 HydrophobicContact CG2-CG 4.43Å; Y94-L145 HydrophobicContact CD2-CB 4.27Å; Y94-L145 HydrophobicContact CD2-CD1 4.5Å; V97-L145 HydrophobicContact CG2-CD1 4.19Å; L127-L145 HydrophobicContact CD1-CD2 3.92Å; L127-L145 HydrophobicContact CD1-CG 3.95Å; L127-L145 HydrophobicContact CD2-CD2 3.72Å; L127-L145 HydrophobicContact CD2-CG 4.3Å; L127-L145 HydrophobicContact CG-CD2 4.44Å; E141-L145 PolarHBondContact O-N 2.68Å; S142-L145 PolarHBondContact O-N 3.35Å; L145-E147 VanDerWaalsContact C-N 3.31Å; L145-E147 PolarHBondContact O-N 3.49Å; L145-Q148 PolarHBondContact O-N 3.21Å; L145-I149 HydrophobicContact CD1-CG2 3.9Å; L145-I149 PolarHBondContact O-N 2.68Å
146	L	94.8	Very high	91.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58	-45.2	178.5	-179.9	58.7	0	0	0	111.2	L124 L128 S142 A143 Q148 I149 L150 I185	L124-L146 HydrophobicContact CD1-CD1 3.56Å; L128-L146 HydrophobicContact CD2-CD2 4.21Å; S142-L146 WeakPolarHBondContact O-CB 3.07Å; S142-L146 PolarHBondContact O-N 2.71Å; A143-L146 PolarHBondContact O-N 3.46Å; L146-Q148 VanDerWaalsContact C-N 3.3Å; L146-Q148 PolarHBondContact O-N 3.44Å; L146-I149 HydrophobicContact CD1-CD1 4.32Å; L146-I149 HydrophobicContact CD1-CG1 4.31Å; L146-I149 VanDerWaalsContact O-CG1 3.28Å; L146-I149 WeakPolarHBondContact O-CG1 3.43Å; L146-I149 PolarHBondContact O-N 3.19Å; L146-L150 HydrophobicContact CD1-CD2 4.36Å; L146-L150 WeakPolarHBondContact O-CG 3.46Å; L146-I185 HydrophobicContact CB-CD1 4.34Å; L146-I185 HydrophobicContact CD2-CD1 3.92Å; L146-I185 HydrophobicContact CD2-CG1 4.46Å; L146-I185 HydrophobicContact CG-CD1 4.23Å; L146-I185 HydrophobicContact CG-CG1 4.35Å
147	E	91.9	Very high	92.4	Very high	21 Å²	21	33.2 Å²	33.2	10%	0.098	16%	0.159	C	C	.	.	H	α-helix	trans	-49.6	-49.2	174.9	-174.6	-163.5	127	0	0	112.1	A143 K144 L145 I149 I185 H223	A143-E147 PolarHBondContact O-N 3.48Å; K144-E147 WeakPolarHBondContact O-CB 3.45Å; L145-E147 VanDerWaalsContact C-N 3.31Å; L145-E147 PolarHBondContact O-N 3.49Å; E147-I149 VanDerWaalsContact C-N 3.28Å; E147-I149 PolarHBondContact O-N 3.05Å; E147-I185 HydrophobicContact CB-CG1 4.19Å; E147-H223 IonicContact OE1-CE1 2.8Å; E147-H223 IonicContact OE1-NE2 2.67Å
148	Q	90.4	Very high	92.7	Very high	28 Å²	28	27.8 Å²	27.8	13%	0.131	13%	0.134	C	C	.	.	H	α-helix	trans	-76.1	-8.7	-173.3	-63.2	-62.8	-55.3	0	0	114.9	Y94 V97 W101 K144 L145 L146	Y94-Q148 HydrophobicContact CE2-CG 3.77Å; V97-Q148 HydrophobicContact CG1-CB 4.02Å; W101-Q148 PolarHBondContact NE1-O 2.78Å; K144-Q148 WeakPolarHBondContact O-CG 3.49Å; L145-Q148 PolarHBondContact O-N 3.21Å; L146-Q148 VanDerWaalsContact C-N 3.3Å; L146-Q148 PolarHBondContact O-N 3.44Å
149	I	93.4	Very high	92.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	6.1	-178.7	67.2	171.5	0	0	0	113.5	V97 C115 I118 L124 L127 L145 L146 E147 I151 N154	V97-I149 HydrophobicContact CG1-CG2 4.04Å; V97-I149 HydrophobicContact CG2-CG2 3.89Å; C115-I149 HydrophobicContact CB-CB 4.45Å; I118-I149 HydrophobicContact CD1-CG2 3.84Å; I118-I149 HydrophobicContact CG2-CD1 4Å; L124-I149 HydrophobicContact CD1-CD1 3.78Å; L127-I149 HydrophobicContact CD1-CD1 3.51Å; L145-I149 HydrophobicContact CD1-CG2 3.9Å; L145-I149 PolarHBondContact O-N 2.68Å; L146-I149 HydrophobicContact CD1-CD1 4.32Å; L146-I149 HydrophobicContact CD1-CG1 4.31Å; L146-I149 VanDerWaalsContact O-CG1 3.28Å; L146-I149 WeakPolarHBondContact O-CG1 3.43Å; L146-I149 PolarHBondContact O-N 3.19Å; E147-I149 VanDerWaalsContact C-N 3.28Å; E147-I149 PolarHBondContact O-N 3.05Å; I149-I151 PolarHBondContact O-N 3.49Å; I149-N154 VanDerWaalsContact O-CB 3.32Å; I149-N154 WeakPolarHBondContact O-CB 3.35Å; I149-N154 PolarHBondContact O-ND2 3.5Å
150	L	92.8	Very high	93	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.026	17%	0.167	C	C	.	.			trans	-78.4	58.1	-178.4	-73.1	167.4	0	0	0	112.9	L146 R155 V158 I185 H188 M189	L146-L150 HydrophobicContact CD1-CD2 4.36Å; L146-L150 WeakPolarHBondContact O-CG 3.46Å; L150-R155 HydrophobicContact CB-CG 4.13Å; L150-R155 HydrophobicContact CD2-CG 4.3Å; L150-R155 PolarHBondContact O-NH1 2.67Å; L150-V158 HydrophobicContact CD2-CB 4.44Å; L150-V158 HydrophobicContact CD2-CG2 3.97Å; L150-I185 HydrophobicContact CD1-CB 4.22Å; L150-I185 HydrophobicContact CD1-CG1 4.25Å; L150-I185 HydrophobicContact CD1-CG2 3.95Å; L150-H188 HydrophobicContact CB-CB 3.68Å; L150-H188 HydrophobicContact CD1-CB 3.72Å; L150-H188 HydrophobicContact CG-CB 4.32Å; L150-M189 HydrophobicContact CD2-SD 4.04Å
151	I	90.8	Very high	93	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.051	19%	0.185	C	C	.	.			trans	-71	173.8	165.9	64.7	162.7	0	0	0	111.7	W101 E112 C115 I149 E153 N154 R155	W101-I151 HydrophobicContact CH2-CG2 4.2Å; W101-I151 HydrophobicContact CZ2-CG2 3.97Å; E112-I151 HydrophobicContact CG-CG2 4.35Å; E112-I151 WeakPolarHBondContact O-CD1 3.42Å; C115-I151 HydrophobicContact CB-CD1 3.58Å; C115-I151 HydrophobicContact CB-CG1 3.81Å; C115-I151 HydrophobicContact CB-CG2 4.04Å; I149-I151 PolarHBondContact O-N 3.49Å; I151-E153 PolarHBondContact O-N 3.44Å; I151-N154 HydrophobicContact CG1-CB 3.98Å; I151-N154 PolarHBondContact O-N 3.41Å; I151-N154 VanDerWaalsContact O-N 3.13Å; I151-R155 WeakPolarHBondContact O-CG 3.32Å; I151-R155 PolarHBondContact O-N 3.35Å
152	S	89.9	Confident	93	Very high	67 Å²	67	35.6 Å²	35.6	47%	0.469	17%	0.168	S	C	.	.	H	α-helix	trans	-54	-49.5	-171.2	-161.8	0	0	0	0	114.1	N154 R155 D156	S152-N154 VanDerWaalsContact C-N 3.34Å; S152-N154 PolarHBondContact O-N 2.8Å; S152-R155 VanDerWaalsContact CA-NH2 3.32Å; S152-R155 PolarHBondContact O-N 3.05Å; S152-D156 PolarHBondContact O-N 2.91Å
153	E	92.3	Very high	92.9	Very high	91 Å²	91	36.3 Å²	36.3	43%	0.425	17%	0.172	S	C	.	.	H	α-helix	trans	-69	-34.5	-178.5	-64	74.3	-168.3	0	0	111.7	N116 I151 Y157	N116-E153 WeakPolarHBondContact OD1-CB 3.39Å; I151-E153 PolarHBondContact O-N 3.44Å; E153-Y157 PolarHBondContact O-N 3.49Å
154	N	95.1	Very high	92.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-74.5	-35.1	178.2	-70.9	-0.2	0	0	0	111.2	C115 R119 L124 I149 I151 S152 Y157 V158	C115-N154 PolarHBondContact O-ND2 3.27Å; R119-N154 VanDerWaalsContact CB-OD1 3.3Å; R119-N154 WeakPolarHBondContact CB-OD1 3.49Å; R119-N154 WeakPolarHBondContact CD-OD1 3.46Å; R119-N154 PolarHBondContact NE-OD1 2.91Å; L124-N154 HydrophobicContact CD2-CB 4.16Å; I149-N154 VanDerWaalsContact O-CB 3.32Å; I149-N154 WeakPolarHBondContact O-CB 3.35Å; I149-N154 PolarHBondContact O-ND2 3.5Å; I151-N154 HydrophobicContact CG1-CB 3.98Å; I151-N154 PolarHBondContact O-N 3.41Å; I151-N154 VanDerWaalsContact O-N 3.13Å; S152-N154 VanDerWaalsContact C-N 3.34Å; S152-N154 PolarHBondContact O-N 2.8Å; N154-Y157 PolarHBondContact O-N 3.26Å; N154-V158 WeakPolarHBondContact O-CB 3.42Å; N154-V158 VanDerWaalsContact O-CG2 3.3Å; N154-V158 WeakPolarHBondContact O-CG2 3.24Å; N154-V158 PolarHBondContact O-N 3.06Å
155	R	95.3	Very high	93	Very high	31 Å²	31	35.3 Å²	35.3	12%	0.117	18%	0.182	C	C	.	.	H	α-helix	trans	-61.3	-42.3	171.3	-70.9	-173.5	-59.9	-98.4	6.8	111.9	L150 I151 S152 V158 A159 H188 M189 H192	L150-R155 HydrophobicContact CB-CG 4.13Å; L150-R155 HydrophobicContact CD2-CG 4.3Å; L150-R155 PolarHBondContact O-NH1 2.67Å; I151-R155 WeakPolarHBondContact O-CG 3.32Å; I151-R155 PolarHBondContact O-N 3.35Å; S152-R155 VanDerWaalsContact CA-NH2 3.32Å; S152-R155 PolarHBondContact O-N 3.05Å; R155-V158 PolarHBondContact O-N 3.45Å; R155-A159 VanDerWaalsContact O-CB 3.29Å; R155-A159 WeakPolarHBondContact O-CB 3.23Å; R155-A159 PolarHBondContact O-N 2.91Å; R155-H188 WeakPolarHBondContact CD-O 3.45Å; R155-M189 HydrophobicContact CB-SD 4.42Å; R155-M189 HydrophobicContact CG-SD 4.24Å; R155-H192 HydrophobicContact CB-CB 4.32Å
156	D	95.4	Very high	92.9	Very high	54 Å²	54	35.4 Å²	35.4	29%	0.289	18%	0.182	S	C	.	.	H	α-helix	trans	-61.7	-43.9	175.8	178.4	65.8	0	0	0	111.6	S152 A159 R160 H192	S152-D156 PolarHBondContact O-N 2.91Å; D156-A159 PolarHBondContact O-N 3.28Å; D156-R160 VanDerWaalsContact CG-NE 3.35Å; D156-R160 WeakPolarHBondContact O-CG 3.49Å; D156-R160 PolarHBondContact O-N 2.83Å; D156-R160 VanDerWaalsContact O-N 3.16Å; D156-R160 IonicContact OD1-CZ 3.61Å; D156-R160 VanDerWaalsContact OD1-CZ 3.28Å; D156-R160 IonicContact OD1-NE 2.69Å; D156-R160 PolarHBondContact OD1-NE 3.5Å; D156-R160 IonicContact OD1-NH2 3.14Å; D156-R160 PolarHBondContact OD1-NH2 3.3Å; D156-R160 IonicContact OD2-CZ 3.36Å; D156-R160 VanDerWaalsContact OD2-CZ 3.23Å; D156-R160 IonicContact OD2-NE 3.54Å; D156-R160 PolarHBondContact OD2-NE 3.1Å; D156-R160 VanDerWaalsContact OD2-NE 3.15Å; D156-R160 IonicContact OD2-NH2 2.65Å; D156-R160 PolarHBondContact OD2-NH2 2.89Å; D156-R160 VanDerWaalsContact OD2-NH2 3.1Å; D156-H192 VanDerWaalsContact CA-NE2 3.33Å; D156-H192 WeakPolarHBondContact CA-NE2 3.42Å; D156-H192 IonicContact OD1-NE2 2.71Å
157	Y	95.6	Very high	92.7	Very high	50 Å²	50	36.1 Å²	36.1	20%	0.196	19%	0.186	C	C	.	.	H	α-helix	trans	-60.3	-48.6	175.2	-174.7	-81.7	0	0	0	111.9	R119 L124 L128 E153 N154 A159 R160 I161	R119-Y157 HydrophobicContact CG-CD2 4.32Å; R119-Y157 HydrophobicContact CG-CG 4.49Å; L124-Y157 HydrophobicContact CD2-CD1 3.45Å; L124-Y157 VanDerWaalsContact CD2-CD1 3.45Å; L124-Y157 HydrophobicContact CD2-CE1 4.14Å; L124-Y157 HydrophobicContact CD2-CG 3.88Å; L124-Y157 HydrophobicContact CG-CD1 4.04Å; L124-Y157 HydrophobicContact CG-CE1 4.29Å; L128-Y157 HydrophobicContact CD1-CE1 4.11Å; E153-Y157 PolarHBondContact O-N 3.49Å; N154-Y157 PolarHBondContact O-N 3.26Å; Y157-A159 PolarHBondContact O-N 3.09Å; Y157-R160 PolarHBondContact O-N 2.76Å; Y157-I161 HydrophobicContact CD2-CD1 4.06Å; Y157-I161 HydrophobicContact CE1-CB 4.21Å; Y157-I161 HydrophobicContact CE1-CD1 4.09Å; Y157-I161 HydrophobicContact CE1-CG2 4.4Å; Y157-I161 HydrophobicContact CE2-CD1 3.56Å; Y157-I161 PolarHBondContact O-N 3.37Å
158	V	95.7	Very high	92.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.203	C	C	.	.	I	π-helix	trans	-63.9	-41.6	179.5	170.6	0	0	0	0	111.2	L124 L150 N154 R155 R160 I161 G162 L163 I166 M189	L124-V158 HydrophobicContact CD1-CG2 4.22Å; L124-V158 HydrophobicContact CD2-CG2 4.25Å; L150-V158 HydrophobicContact CD2-CB 4.44Å; L150-V158 HydrophobicContact CD2-CG2 3.97Å; N154-V158 WeakPolarHBondContact O-CB 3.42Å; N154-V158 VanDerWaalsContact O-CG2 3.3Å; N154-V158 WeakPolarHBondContact O-CG2 3.24Å; N154-V158 PolarHBondContact O-N 3.06Å; R155-V158 PolarHBondContact O-N 3.45Å; V158-R160 PolarHBondContact O-N 3.03Å; V158-I161 PolarHBondContact O-N 2.91Å; V158-G162 CarbonylContact O-C 3.57Å; V158-G162 VanDerWaalsContact O-C 3.31Å; V158-G162 VanDerWaalsContact O-CA 3.29Å; V158-G162 WeakPolarHBondContact O-CA 3.48Å; V158-G162 PolarHBondContact O-N 3.01Å; V158-L163 PolarHBondContact O-N 3.47Å; V158-I166 HydrophobicContact CG1-CD1 3.22Å; V158-I166 HydrophobicContact CG1-CG1 4.44Å; V158-M189 HydrophobicContact CB-CE 4.22Å; V158-M189 HydrophobicContact CB-SD 4.11Å; V158-M189 HydrophobicContact CG1-CE 3.75Å; V158-M189 HydrophobicContact CG1-SD 3.66Å
159	A	94.8	Very high	92.5	Very high	14 Å²	14	38.3 Å²	38.3	12%	0.116	20%	0.199	C	C	.	.	I	π-helix	trans	-59.9	-35.2	177.3	0	0	0	0	0	112.4	R155 D156 Y157 M189 T196	R155-A159 VanDerWaalsContact O-CB 3.29Å; R155-A159 WeakPolarHBondContact O-CB 3.23Å; R155-A159 PolarHBondContact O-N 2.91Å; D156-A159 PolarHBondContact O-N 3.28Å; Y157-A159 PolarHBondContact O-N 3.09Å; A159-M189 HydrophobicContact CB-CE 4.08Å; A159-T196 HydrophobicContact CB-CG2 4.19Å
160	R	92.8	Very high	92.2	Very high	187 Å²	187	38.5 Å²	38.5	71%	0.706	20%	0.2	S	C	*	.	I	π-helix	trans	-82.2	-40.6	-179.4	-67.3	175.2	-167.7	-152.9	6.4	113.8	D156 Y157 V158	D156-R160 VanDerWaalsContact CG-NE 3.35Å; D156-R160 WeakPolarHBondContact O-CG 3.49Å; D156-R160 PolarHBondContact O-N 2.83Å; D156-R160 VanDerWaalsContact O-N 3.16Å; D156-R160 IonicContact OD1-CZ 3.61Å; D156-R160 VanDerWaalsContact OD1-CZ 3.28Å; D156-R160 IonicContact OD1-NE 2.69Å; D156-R160 PolarHBondContact OD1-NE 3.5Å; D156-R160 IonicContact OD1-NH2 3.14Å; D156-R160 PolarHBondContact OD1-NH2 3.3Å; D156-R160 IonicContact OD2-CZ 3.36Å; D156-R160 VanDerWaalsContact OD2-CZ 3.23Å; D156-R160 IonicContact OD2-NE 3.54Å; D156-R160 PolarHBondContact OD2-NE 3.1Å; D156-R160 VanDerWaalsContact OD2-NE 3.15Å; D156-R160 IonicContact OD2-NH2 2.65Å; D156-R160 PolarHBondContact OD2-NH2 2.89Å; D156-R160 VanDerWaalsContact OD2-NH2 3.1Å; Y157-R160 PolarHBondContact O-N 2.76Å; V158-R160 PolarHBondContact O-N 3.03Å
161	I	90.6	Very high	92	Very high	108 Å²	108	47.1 Å²	47.1	55%	0.554	23%	0.232	S	C	*	.	I	π-helix	trans	-116.8	-36.9	-166.3	-58.9	174.3	0	0	0	111.9	Y157 V158	Y157-I161 HydrophobicContact CD2-CD1 4.06Å; Y157-I161 HydrophobicContact CE1-CB 4.21Å; Y157-I161 HydrophobicContact CE1-CD1 4.09Å; Y157-I161 HydrophobicContact CE1-CG2 4.4Å; Y157-I161 HydrophobicContact CE2-CD1 3.56Å; Y157-I161 PolarHBondContact O-N 3.37Å; V158-I161 PolarHBondContact O-N 2.91Å
162	G	89.9	Confident	91.6	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.01	25%	0.254	C	S	.	.	I	π-helix	trans	-101.5	-7.4	-170.1	0	0	0	0	0	116.1	V158 G164 V165 I166	V158-G162 CarbonylContact O-C 3.57Å; V158-G162 VanDerWaalsContact O-C 3.31Å; V158-G162 VanDerWaalsContact O-CA 3.29Å; V158-G162 WeakPolarHBondContact O-CA 3.48Å; V158-G162 PolarHBondContact O-N 3.01Å; G162-G164 VanDerWaalsContact C-N 3.3Å; G162-G164 PolarHBondContact O-N 3.15Å; G162-V165 VanDerWaalsContact O-CB 3.29Å; G162-V165 WeakPolarHBondContact O-CB 3.28Å; G162-V165 PolarHBondContact O-N 3.27Å; G162-I166 PolarHBondContact O-N 3.28Å
163	L	92.9	Very high	91.2	Very high	15 Å²	15	51.4 Å²	51.4	8%	0.079	25%	0.245	C	C	.	.	H	α-helix	trans	-60.1	-39.8	-169.1	-170	66.2	0	0	0	112.7	V158 V165 I166 L167 M189 T196 Q199 L200	V158-L163 PolarHBondContact O-N 3.47Å; L163-V165 VanDerWaalsContact C-N 3.26Å; L163-V165 PolarHBondContact O-N 3.3Å; L163-I166 PolarHBondContact O-N 3.11Å; L163-L167 HydrophobicContact CG-CD1 4.09Å; L163-L167 HydrophobicContact CG-CG 4.49Å; L163-L167 WeakPolarHBondContact O-CG 3.42Å; L163-L167 PolarHBondContact O-N 2.89Å; L163-M189 HydrophobicContact CD1-CE 4.18Å; L163-T196 HydrophobicContact CD1-CG2 4.28Å; L163-Q199 HydrophobicContact CD2-CB 3.94Å; L163-L200 HydrophobicContact CD1-CD2 3.66Å; L163-L200 HydrophobicContact CD1-CG 4.23Å
164	G	91.9	Very high	90.8	Very high	43 Å²	43	54.3 Å²	54.3	44%	0.443	26%	0.263	S	S	.	.	H	α-helix	trans	-62.8	-31	177.3	0	0	0	0	0	113.5	G162 N168	G162-G164 VanDerWaalsContact C-N 3.3Å; G162-G164 PolarHBondContact O-N 3.15Å; G164-N168 PolarHBondContact O-N 2.94Å; G164-N168 VanDerWaalsContact O-N 3.11Å; G164-N168 PolarHBondContact O-ND2 3.35Å
165	V	92.2	Very high	90.3	Very high	17 Å²	17	56.3 Å²	56.3	10%	0.103	27%	0.274	C	S	.	.	H	α-helix	trans	-66.4	-48.3	176.3	-175.8	0	0	0	0	110	L128 Q131 Q132 G162 L163 L167 N168 L169	L128-V165 WeakPolarHBondContact O-CG1 3.27Å; Q131-V165 HydrophobicContact CB-CG1 3.49Å; Q131-V165 VanDerWaalsContact CB-CG1 3.49Å; Q131-V165 HydrophobicContact CG-CG1 4.08Å; Q132-V165 HydrophobicContact CG-CG1 4.07Å; Q132-V165 VanDerWaalsContact NE2-CG2 3.26Å; G162-V165 VanDerWaalsContact O-CB 3.29Å; G162-V165 WeakPolarHBondContact O-CB 3.28Å; G162-V165 PolarHBondContact O-N 3.27Å; L163-V165 VanDerWaalsContact C-N 3.26Å; L163-V165 PolarHBondContact O-N 3.3Å; V165-L167 VanDerWaalsContact C-N 3.33Å; V165-L167 PolarHBondContact O-N 3.28Å; V165-N168 PolarHBondContact O-N 3.48Å; V165-N168 VanDerWaalsContact O-N 3.15Å; V165-L169 PolarHBondContact O-N 3.38Å
166	I	92.1	Very high	89.9	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-44.3	178.8	-61.4	171.8	0	0	0	110.3	V158 G162 L163 N168 L169 T170 I185 L186 M189	V158-I166 HydrophobicContact CG1-CD1 3.22Å; V158-I166 HydrophobicContact CG1-CG1 4.44Å; G162-I166 PolarHBondContact O-N 3.28Å; L163-I166 PolarHBondContact O-N 3.11Å; I166-N168 PolarHBondContact O-N 2.92Å; I166-L169 WeakPolarHBondContact O-CB 2.76Å; I166-L169 PolarHBondContact O-N 3.08Å; I166-L169 VanDerWaalsContact O-N 3.07Å; I166-T170 PolarHBondContact O-N 3.2Å; I166-I185 HydrophobicContact CD1-CG2 3.61Å; I166-I185 HydrophobicContact CG1-CG2 4.02Å; I166-I185 HydrophobicContact CG2-CG2 3.8Å; I166-L186 HydrophobicContact CG2-CD2 4.04Å; I166-M189 HydrophobicContact CD1-CG 4.11Å; I166-M189 HydrophobicContact CD1-SD 4.47Å
167	L	91.1	Very high	89.4	Confident	15 Å²	15	58.7 Å²	58.7	8%	0.079	29%	0.294	C	S	.	.	H	α-helix	trans	-65.1	-21.9	177.9	-71.5	172	0	0	0	114.1	L163 V165 T170 L200 N203 A205	L163-L167 HydrophobicContact CG-CD1 4.09Å; L163-L167 HydrophobicContact CG-CG 4.49Å; L163-L167 WeakPolarHBondContact O-CG 3.42Å; L163-L167 PolarHBondContact O-N 2.89Å; V165-L167 VanDerWaalsContact C-N 3.33Å; V165-L167 PolarHBondContact O-N 3.28Å; L167-T170 PolarHBondContact O-OG1 3.45Å; L167-L200 HydrophobicContact CD2-CD2 3.99Å; L167-N203 HydrophobicContact CD1-CB 3.6Å; L167-N203 HydrophobicContact CD2-CB 3.67Å; L167-N203 HydrophobicContact CG-CB 4.2Å; L167-A205 HydrophobicContact CD2-CB 4.05Å
168	N	90.2	Very high	88.9	Confident	87 Å²	87	56.4 Å²	56.4	47%	0.465	29%	0.286	S	S	.	.	H	α-helix	trans	-76.5	-36.7	171.8	-76.9	-26.7	0	0	0	111.3	G164 V165 I166 T170 R171	G164-N168 PolarHBondContact O-N 2.94Å; G164-N168 VanDerWaalsContact O-N 3.11Å; G164-N168 PolarHBondContact O-ND2 3.35Å; V165-N168 PolarHBondContact O-N 3.48Å; V165-N168 VanDerWaalsContact O-N 3.15Å; I166-N168 PolarHBondContact O-N 2.92Å; N168-T170 VanDerWaalsContact C-N 3.32Å; N168-T170 PolarHBondContact O-N 3.1Å; N168-R171 WeakPolarHBondContact O-CB 3.41Å; N168-R171 PolarHBondContact O-N 3.23Å
169	L	87.4	Confident	88.7	Confident	9 Å²	9	56.6 Å²	56.6	5%	0.047	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-34.6	177.1	-60.1	175.2	0	0	0	112	Q131 I139 V165 I166 R171 Q172 L178 V182	Q131-L169 HydrophobicContact CB-CD1 4.19Å; Q131-L169 HydrophobicContact CG-CD1 4.19Å; I139-L169 HydrophobicContact CG2-CD2 4.24Å; V165-L169 PolarHBondContact O-N 3.38Å; I166-L169 WeakPolarHBondContact O-CB 2.76Å; I166-L169 PolarHBondContact O-N 3.08Å; I166-L169 VanDerWaalsContact O-N 3.07Å; L169-R171 PolarHBondContact O-N 3.29Å; L169-R171 VanDerWaalsContact O-N 3.08Å; L169-Q172 PolarHBondContact O-N 3.07Å; L169-Q172 VanDerWaalsContact O-N 3.15Å; L169-L178 HydrophobicContact CD2-CD1 4.44Å; L169-V182 HydrophobicContact CB-CG1 4.41Å; L169-V182 HydrophobicContact CB-CG2 3.73Å; L169-V182 HydrophobicContact CD1-CG2 4.14Å
170	T	88.1	Confident	88.5	Confident	4 Å²	4	60 Å²	60	3%	0.025	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-12.4	178.2	60.7	0	0	0	0	114.2	I166 L167 N168 Q173 V182 L186 A205	I166-T170 PolarHBondContact O-N 3.2Å; L167-T170 PolarHBondContact O-OG1 3.45Å; N168-T170 VanDerWaalsContact C-N 3.32Å; N168-T170 PolarHBondContact O-N 3.1Å; T170-Q173 WeakPolarHBondContact O-CG 3.49Å; T170-V182 HydrophobicContact CG2-CG1 3.76Å; T170-L186 HydrophobicContact CG2-CD1 3.84Å; T170-L186 HydrophobicContact CG2-CD2 4.15Å; T170-L186 HydrophobicContact CG2-CG 4.29Å; T170-A205 HydrophobicContact CG2-CB 4.38Å
171	R	87.4	Confident	88.3	Confident	185 Å²	185	51.4 Å²	51.4	70%	0.698	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-21.3	176.8	-60.3	179.5	179.4	-178.3	-0.8	112.8	N168 L169 Q173	N168-R171 WeakPolarHBondContact O-CB 3.41Å; N168-R171 PolarHBondContact O-N 3.23Å; L169-R171 PolarHBondContact O-N 3.29Å; L169-R171 VanDerWaalsContact O-N 3.08Å; R171-Q173 PolarHBondContact O-N 3.11Å
172	Q	83.5	Confident	88.4	Confident	107 Å²	107	46.3 Å²	46.3	50%	0.5	24%	0.239	S	C	.	.			trans	-92.1	74.6	179.4	-66.7	-178.5	-2.1	0	0	109.9	L169 L178	L169-Q172 PolarHBondContact O-N 3.07Å; L169-Q172 VanDerWaalsContact O-N 3.15Å; Q172-L178 HydrophobicContact CB-CD2 3.84Å; Q172-L178 VanDerWaalsContact OE1-CD2 3.28Å
173	Q	82.1	Confident	88.6	Confident	60 Å²	60	46.2 Å²	46.2	28%	0.28	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-24.2	-170.1	-65.4	-178.1	-6.3	0	0	114.4	T170 R171 A208 F211 W212	T170-Q173 WeakPolarHBondContact O-CG 3.49Å; R171-Q173 PolarHBondContact O-N 3.11Å; Q173-A208 HydrophobicContact CG-CB 4.48Å; Q173-F211 HydrophobicContact CB-CD1 3.81Å; Q173-F211 HydrophobicContact CB-CE1 3.74Å; Q173-F211 HydrophobicContact CB-CZ 4.45Å; Q173-F211 HydrophobicContact CG-CD1 4.36Å; Q173-W212 PolarHBondContact O-NE1 2.9Å; Q173-W212 VanDerWaalsContact O-NE1 3.12Å
174	D	82.3	Confident	88.6	Confident	153 Å²	153	45.5 Å²	45.5	82%	0.818	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-12.3	-173.5	-59.1	-43.3	0	0	0	113.7	A176	D174-A176 PolarHBondContact O-N 3.14Å
175	D	86.3	Confident	88.7	Confident	42 Å²	42	43.5 Å²	43.5	23%	0.225	21%	0.214	C	C	.	.			trans	-84.9	104.6	-179.7	-173.6	-26.5	0	0	0	110.9	Y140 Q177 L178 A179	Y140-D175 VanDerWaalsContact OH-CG 3.31Å; Y140-D175 PolarHBondContact OH-OD1 3.16Å; Y140-D175 VanDerWaalsContact OH-OD1 3.13Å; Y140-D175 PolarHBondContact OH-OD2 3.48Å; D175-Q177 VanDerWaalsContact C-N 3.32Å; D175-Q177 PolarHBondContact O-N 3.19Å; D175-Q177 PolarHBondContact OD1-N 3.06Å; D175-L178 HydrophobicContact CB-CB 3.83Å; D175-L178 PolarHBondContact O-N 3.41Å; D175-L178 PolarHBondContact OD1-N 3.02Å; D175-A179 VanDerWaalsContact O-CB 3.26Å; D175-A179 WeakPolarHBondContact O-CB 3.4Å; D175-A179 PolarHBondContact O-N 2.69Å
176	A	85.3	Confident	88.9	Confident	58 Å²	58	42.7 Å²	42.7	48%	0.479	21%	0.209	S	C	.	.	H	α-helix	trans	-62.8	-34.4	-177.6	0	0	0	0	0	113.7	D174 R180	D174-A176 PolarHBondContact O-N 3.14Å; A176-R180 PolarHBondContact O-N 3.3Å
177	Q	85.9	Confident	89	Confident	76 Å²	76	43.9 Å²	43.9	36%	0.355	22%	0.215	S	C	.	.	H	α-helix	trans	-76.4	-40.6	-178.6	-174.3	66	7.5	0	0	110.3	Y140 D175 R180	Y140-Q177 HydrophobicContact CD1-CB 4.36Å; Y140-Q177 HydrophobicContact CD1-CG 3.96Å; Y140-Q177 HydrophobicContact CD2-CB 4.22Å; Y140-Q177 HydrophobicContact CD2-CG 3.45Å; Y140-Q177 VanDerWaalsContact CD2-CG 3.45Å; Y140-Q177 HydrophobicContact CE1-CB 4Å; Y140-Q177 HydrophobicContact CE1-CG 4.08Å; Y140-Q177 HydrophobicContact CE2-CB 3.81Å; Y140-Q177 HydrophobicContact CE2-CG 3.55Å; Y140-Q177 HydrophobicContact CG-CB 4.46Å; Y140-Q177 HydrophobicContact CG-CG 3.64Å; D175-Q177 VanDerWaalsContact C-N 3.32Å; D175-Q177 PolarHBondContact O-N 3.19Å; D175-Q177 PolarHBondContact OD1-N 3.06Å; Q177-R180 PolarHBondContact O-N 3.22Å
178	L	85.8	Confident	89.1	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-64.5	-41.1	173.3	-169	60.6	0	0	0	111.6	I139 Y140 L169 Q172 D175 R180 S181 V182	I139-L178 HydrophobicContact CG2-CD1 3.71Å; Y140-L178 HydrophobicContact CD1-CB 4.46Å; Y140-L178 HydrophobicContact CD1-CD1 4.36Å; Y140-L178 HydrophobicContact CE1-CB 3.96Å; Y140-L178 HydrophobicContact CE1-CD1 4.48Å; L169-L178 HydrophobicContact CD2-CD1 4.44Å; Q172-L178 HydrophobicContact CB-CD2 3.84Å; Q172-L178 VanDerWaalsContact OE1-CD2 3.28Å; D175-L178 HydrophobicContact CB-CB 3.83Å; D175-L178 PolarHBondContact O-N 3.41Å; D175-L178 PolarHBondContact OD1-N 3.02Å; L178-R180 VanDerWaalsContact C-N 3.26Å; L178-R180 PolarHBondContact O-N 3.35Å; L178-S181 PolarHBondContact O-N 3.04Å; L178-V182 HydrophobicContact CD1-CG2 3.75Å; L178-V182 HydrophobicContact CG-CG2 3.73Å; L178-V182 WeakPolarHBondContact O-CB 3.43Å; L178-V182 VanDerWaalsContact O-CG2 3.29Å; L178-V182 WeakPolarHBondContact O-CG2 3.22Å; L178-V182 PolarHBondContact O-N 3.2Å
179	A	90.4	Very high	89.4	Confident	4 Å²	4	40.2 Å²	40.2	3%	0.033	19%	0.194	C	C	.	.	H	α-helix	trans	-57.4	-37.5	178.8	0	0	0	0	0	112.3	D175 S183 W212 V220	D175-A179 VanDerWaalsContact O-CB 3.26Å; D175-A179 WeakPolarHBondContact O-CB 3.4Å; D175-A179 PolarHBondContact O-N 2.69Å; A179-S183 WeakPolarHBondContact O-CB 3.48Å; A179-S183 PolarHBondContact O-N 2.97Å; A179-S183 PolarHBondContact O-OG 3.48Å; A179-W212 HydrophobicContact CB-CD2 4.21Å; A179-W212 HydrophobicContact CB-CG 4.49Å; A179-W212 HydrophobicContact CB-CZ2 4Å; A179-V220 HydrophobicContact CB-CG2 4.41Å
180	R	90.9	Very high	89.8	Confident	87 Å²	87	39.8 Å²	39.8	33%	0.328	19%	0.192	S	C	.	.	H	α-helix	trans	-58	-52.9	175.6	-73.3	175.3	-172.9	122.6	7.9	112	A176 Q177 L178 S183 G184 D217 V220 H223	A176-R180 PolarHBondContact O-N 3.3Å; Q177-R180 PolarHBondContact O-N 3.22Å; L178-R180 VanDerWaalsContact C-N 3.26Å; L178-R180 PolarHBondContact O-N 3.35Å; R180-S183 PolarHBondContact O-OG 2.86Å; R180-G184 PolarHBondContact O-N 3.28Å; R180-D217 IonicContact CZ-OD2 3.72Å; R180-D217 IonicContact NE-OD2 2.69Å; R180-D217 PolarHBondContact NE-OD2 3.04Å; R180-D217 IonicContact NH2-OD2 2.97Å; R180-D217 PolarHBondContact NH2-OD2 2.93Å; R180-V220 HydrophobicContact CB-CG2 4.35Å; R180-V220 HydrophobicContact CG-CG2 3.57Å; R180-H223 PolarHBondContact O-CE1 3.48Å; R180-H223 PolarHBondContact O-ND1 3.34Å
181	S	88.2	Confident	90	Very high	6 Å²	6	41.6 Å²	41.6	4%	0.042	20%	0.2	C	C	.	.	H	α-helix	trans	-73.9	-41.2	-177.6	-56.2	0	0	0	0	112.4	L178 G184 I185	L178-S181 PolarHBondContact O-N 3.04Å; S181-G184 PolarHBondContact O-N 3.12Å; S181-I185 WeakPolarHBondContact O-CG1 3.35Å; S181-I185 PolarHBondContact O-N 2.84Å
182	V	93.1	Very high	90.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68	-39.4	-178.8	178.3	0	0	0	0	111.3	L169 T170 L178 G184 I185 L186 W212	L169-V182 HydrophobicContact CB-CG1 4.41Å; L169-V182 HydrophobicContact CB-CG2 3.73Å; L169-V182 HydrophobicContact CD1-CG2 4.14Å; T170-V182 HydrophobicContact CG2-CG1 3.76Å; L178-V182 HydrophobicContact CD1-CG2 3.75Å; L178-V182 HydrophobicContact CG-CG2 3.73Å; L178-V182 WeakPolarHBondContact O-CB 3.43Å; L178-V182 VanDerWaalsContact O-CG2 3.29Å; L178-V182 WeakPolarHBondContact O-CG2 3.22Å; L178-V182 PolarHBondContact O-N 3.2Å; V182-G184 VanDerWaalsContact C-N 3.3Å; V182-G184 PolarHBondContact O-N 3.04Å; V182-I185 PolarHBondContact O-N 2.62Å; V182-L186 HydrophobicContact CG1-CD1 4.47Å; V182-L186 HydrophobicContact CG1-CG 4.4Å; V182-L186 WeakPolarHBondContact O-CB 3.5Å; V182-L186 WeakPolarHBondContact O-CG 3.48Å; V182-L186 PolarHBondContact O-N 3.22Å; V182-W212 HydrophobicContact CB-CH2 4.02Å; V182-W212 HydrophobicContact CG1-CH2 3.73Å; V182-W212 HydrophobicContact CG1-CZ3 4.35Å
183	S	93.9	Very high	90.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61	-39.6	173.8	58.3	0	0	0	0	112	A179 R180 L186 E187 H223	A179-S183 WeakPolarHBondContact O-CB 3.48Å; A179-S183 PolarHBondContact O-N 2.97Å; A179-S183 PolarHBondContact O-OG 3.48Å; R180-S183 PolarHBondContact O-OG 2.86Å; S183-L186 PolarHBondContact O-N 3.42Å; S183-E187 PolarHBondContact O-N 3.26Å; S183-H223 WeakPolarHBondContact OG-CB 3.35Å; S183-H223 PolarHBondContact OG-ND1 3.22Å
184	G	92.6	Very high	91.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.4	-38.4	174.7	0	0	0	0	0	113.1	R180 S181 V182 E187 H188 H223	R180-G184 PolarHBondContact O-N 3.28Å; S181-G184 PolarHBondContact O-N 3.12Å; V182-G184 VanDerWaalsContact C-N 3.3Å; V182-G184 PolarHBondContact O-N 3.04Å; G184-E187 WeakPolarHBondContact O-CB 3.45Å; G184-E187 PolarHBondContact O-N 3.16Å; G184-H188 PolarHBondContact O-N 3.05Å; G184-H188 PolarHBondContact O-ND1 3.18Å; G184-H223 WeakPolarHBondContact CA-ND1 3.45Å; G184-H223 PolarHBondContact N-ND1 3.19Å
185	I	94.8	Very high	92	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.2	-46.7	172.2	-69.3	162.3	0	0	0	110.4	A143 L146 E147 L150 I166 S181 V182 E187 H188 M189	A143-I185 HydrophobicContact CB-CD1 4.13Å; L146-I185 HydrophobicContact CB-CD1 4.34Å; L146-I185 HydrophobicContact CD2-CD1 3.92Å; L146-I185 HydrophobicContact CD2-CG1 4.46Å; L146-I185 HydrophobicContact CG-CD1 4.23Å; L146-I185 HydrophobicContact CG-CG1 4.35Å; E147-I185 HydrophobicContact CB-CG1 4.19Å; L150-I185 HydrophobicContact CD1-CB 4.22Å; L150-I185 HydrophobicContact CD1-CG1 4.25Å; L150-I185 HydrophobicContact CD1-CG2 3.95Å; I166-I185 HydrophobicContact CD1-CG2 3.61Å; I166-I185 HydrophobicContact CG1-CG2 4.02Å; I166-I185 HydrophobicContact CG2-CG2 3.8Å; S181-I185 WeakPolarHBondContact O-CG1 3.35Å; S181-I185 PolarHBondContact O-N 2.84Å; V182-I185 PolarHBondContact O-N 2.62Å; I185-E187 VanDerWaalsContact C-N 3.32Å; I185-E187 PolarHBondContact O-N 2.66Å; I185-H188 PolarHBondContact O-N 3.36Å; I185-M189 HydrophobicContact CG2-CG 4.21Å; I185-M189 VanDerWaalsContact O-CG 3.32Å; I185-M189 WeakPolarHBondContact O-CG 3.23Å; I185-M189 PolarHBondContact O-N 2.99Å
186	L	96.3	Very high	92.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.7	-41.1	178.3	-72.8	-177.6	0	0	0	111.7	I166 T170 V182 S183 H188 M189 F190 L200 A205 L209 W212	I166-L186 HydrophobicContact CG2-CD2 4.04Å; T170-L186 HydrophobicContact CG2-CD1 3.84Å; T170-L186 HydrophobicContact CG2-CD2 4.15Å; T170-L186 HydrophobicContact CG2-CG 4.29Å; V182-L186 HydrophobicContact CG1-CD1 4.47Å; V182-L186 HydrophobicContact CG1-CG 4.4Å; V182-L186 WeakPolarHBondContact O-CB 3.5Å; V182-L186 WeakPolarHBondContact O-CG 3.48Å; V182-L186 PolarHBondContact O-N 3.22Å; S183-L186 PolarHBondContact O-N 3.42Å; L186-H188 VanDerWaalsContact C-N 3.25Å; L186-H188 PolarHBondContact O-N 2.79Å; L186-M189 PolarHBondContact O-N 3.46Å; L186-M189 VanDerWaalsContact O-N 3.11Å; L186-F190 HydrophobicContact CB-CD2 4.29Å; L186-F190 HydrophobicContact CB-CE2 4.17Å; L186-F190 WeakPolarHBondContact O-CD2 3.41Å; L186-F190 PolarHBondContact O-N 3.4Å; L186-L200 HydrophobicContact CD2-CD2 3.93Å; L186-A205 HydrophobicContact CD1-CB 4.18Å; L186-A205 HydrophobicContact CD2-CB 3.87Å; L186-L209 HydrophobicContact CB-CD2 4.35Å; L186-L209 HydrophobicContact CD1-CD1 4.46Å; L186-L209 HydrophobicContact CD1-CD2 3.87Å; L186-L209 HydrophobicContact CD1-CG 3.91Å; L186-W212 HydrophobicContact CD1-CZ3 4.13Å
187	E	94.5	Very high	93	Very high	27 Å²	27	27.9 Å²	27.9	13%	0.126	13%	0.131	C	C	.	.	H	α-helix	trans	-48.4	-50	174.4	-178.6	-170.2	144.4	0	0	111.7	S183 G184 I185 H223 V226 A227 N230	S183-E187 PolarHBondContact O-N 3.26Å; G184-E187 WeakPolarHBondContact O-CB 3.45Å; G184-E187 PolarHBondContact O-N 3.16Å; I185-E187 VanDerWaalsContact C-N 3.32Å; I185-E187 PolarHBondContact O-N 2.66Å; E187-H223 IonicContact OE2-CD2 2.68Å; E187-H223 PolarHBondContact OE2-CD2 3.42Å; E187-H223 IonicContact OE2-CG 3.51Å; E187-V226 VanDerWaalsContact CD-CG1 3.44Å; E187-V226 HydrophobicContact CG-CB 3.74Å; E187-V226 HydrophobicContact CG-CG1 3.53Å; E187-V226 WeakPolarHBondContact OE1-CG1 3.39Å; E187-A227 HydrophobicContact CB-CB 4.1Å; E187-N230 PolarHBondContact O-ND2 2.74Å
188	H	93.4	Very high	93.5	Very high	25 Å²	25	25.2 Å²	25.2	12%	0.116	12%	0.12	C	C	.	.	H	α-helix	trans	-71.2	-39.6	179.2	-69.9	87	0	0	0	112.3	L150 R155 G184 I185 L186 F190 K191	L150-H188 HydrophobicContact CB-CB 3.68Å; L150-H188 HydrophobicContact CD1-CB 3.72Å; L150-H188 HydrophobicContact CG-CB 4.32Å; R155-H188 WeakPolarHBondContact CD-O 3.45Å; G184-H188 PolarHBondContact O-N 3.05Å; G184-H188 PolarHBondContact O-ND1 3.18Å; I185-H188 PolarHBondContact O-N 3.36Å; L186-H188 VanDerWaalsContact C-N 3.25Å; L186-H188 PolarHBondContact O-N 2.79Å; H188-F190 VanDerWaalsContact C-N 3.35Å; H188-F190 PolarHBondContact O-N 3.45Å; H188-K191 WeakPolarHBondContact O-CB 3.43Å; H188-K191 PolarHBondContact O-N 3.06Å; H188-K191 VanDerWaalsContact O-N 3.11Å
189	M	96.2	Very high	93.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-69.1	-30.5	-178.3	-68.8	-55.6	-59	0	0	113.2	L150 R155 V158 A159 L163 I166 I185 L186 K191 H192 T196 L200	L150-M189 HydrophobicContact CD2-SD 4.04Å; R155-M189 HydrophobicContact CB-SD 4.42Å; R155-M189 HydrophobicContact CG-SD 4.24Å; V158-M189 HydrophobicContact CB-CE 4.22Å; V158-M189 HydrophobicContact CB-SD 4.11Å; V158-M189 HydrophobicContact CG1-CE 3.75Å; V158-M189 HydrophobicContact CG1-SD 3.66Å; A159-M189 HydrophobicContact CB-CE 4.08Å; L163-M189 HydrophobicContact CD1-CE 4.18Å; I166-M189 HydrophobicContact CD1-CG 4.11Å; I166-M189 HydrophobicContact CD1-SD 4.47Å; I185-M189 HydrophobicContact CG2-CG 4.21Å; I185-M189 VanDerWaalsContact O-CG 3.32Å; I185-M189 WeakPolarHBondContact O-CG 3.23Å; I185-M189 PolarHBondContact O-N 2.99Å; L186-M189 PolarHBondContact O-N 3.46Å; L186-M189 VanDerWaalsContact O-N 3.11Å; M189-K191 PolarHBondContact O-N 3.13Å; M189-H192 WeakPolarHBondContact O-CB 3.49Å; M189-H192 PolarHBondContact O-N 3.1Å; M189-T196 HydrophobicContact CE-CG2 3.97Å; M189-L200 HydrophobicContact CB-CD1 3.88Å
190	F	95.8	Very high	94.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-11.8	172.1	-80.9	-64.1	0	0	0	113.9	L186 H188 S197 L200 I201 A205 L209 A227 N230 C231	L186-F190 HydrophobicContact CB-CD2 4.29Å; L186-F190 HydrophobicContact CB-CE2 4.17Å; L186-F190 WeakPolarHBondContact O-CD2 3.41Å; L186-F190 PolarHBondContact O-N 3.4Å; H188-F190 VanDerWaalsContact C-N 3.35Å; H188-F190 PolarHBondContact O-N 3.45Å; F190-S197 PolarHBondContact O-OG 3.43Å; F190-L200 HydrophobicContact CD1-CD1 3.9Å; F190-L200 HydrophobicContact CD2-CD1 4.37Å; F190-L200 HydrophobicContact CE1-CB 3.73Å; F190-L200 HydrophobicContact CE1-CD1 3.84Å; F190-L200 HydrophobicContact CE1-CG 4.47Å; F190-L200 HydrophobicContact CE2-CD1 4.28Å; F190-L200 HydrophobicContact CG-CD1 4.16Å; F190-L200 HydrophobicContact CZ-CB 3.79Å; F190-L200 HydrophobicContact CZ-CD1 4.04Å; F190-I201 HydrophobicContact CE1-CG1 4.13Å; F190-A205 HydrophobicContact CZ-CB 4.44Å; F190-L209 HydrophobicContact CD2-CD1 4.04Å; F190-L209 HydrophobicContact CE2-CD1 3.43Å; F190-L209 VanDerWaalsContact CE2-CD1 3.43Å; F190-L209 HydrophobicContact CZ-CD1 4.24Å; F190-A227 HydrophobicContact CD2-CB 4.16Å; F190-N230 HydrophobicContact CB-CB 4.03Å; F190-C231 HydrophobicContact CB-CB 4.27Å; F190-C231 HydrophobicContact CD1-CB 3.65Å; F190-C231 HydrophobicContact CE1-CB 4.13Å; F190-C231 HydrophobicContact CG-CB 3.96Å
191	K	92.4	Very high	94.5	Very high	42 Å²	42	25.3 Å²	25.3	18%	0.183	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-6.3	173.9	-174.6	169.3	178.1	176.2	0	113.5	H188 M189 Y234 D324	H188-K191 WeakPolarHBondContact O-CB 3.43Å; H188-K191 PolarHBondContact O-N 3.06Å; H188-K191 VanDerWaalsContact O-N 3.11Å; M189-K191 PolarHBondContact O-N 3.13Å; K191-Y234 HydrophobicContact CB-CD2 4.2Å; K191-Y234 HydrophobicContact CB-CE2 4.28Å; K191-Y234 HydrophobicContact CD-CE2 4.16Å; K191-Y234 WeakPolarHBondContact CE-OH 3.42Å; K191-Y234 HydrophobicContact CG-CD2 4.03Å; K191-Y234 HydrophobicContact CG-CE1 4.25Å; K191-Y234 HydrophobicContact CG-CE2 3.77Å; K191-Y234 HydrophobicContact CG-CG 4.43Å; K191-D324 WeakPolarHBondContact CE-OD1 3.4Å; K191-D324 IonicContact NZ-OD1 2.76Å; K191-D324 PolarHBondContact NZ-OD1 2.86Å; K191-D324 VanDerWaalsContact NZ-OD1 3.09Å; K191-D324 IonicContact NZ-OD2 3.61Å; K191-D324 PolarHBondContact NZ-OD2 3.18Å
192	H	93.7	Very high	94.7	Very high	41 Å²	41	28.9 Å²	28.9	19%	0.19	15%	0.148	C	C	.	.	S	Bend	trans	-70.3	-79.7	-172.2	-178.1	-116.7	0	0	0	113.4	R155 D156 M189 T196	R155-H192 HydrophobicContact CB-CB 4.32Å; D156-H192 VanDerWaalsContact CA-NE2 3.33Å; D156-H192 WeakPolarHBondContact CA-NE2 3.42Å; D156-H192 IonicContact OD1-NE2 2.71Å; M189-H192 WeakPolarHBondContact O-CB 3.49Å; M189-H192 PolarHBondContact O-N 3.1Å; H192-T196 HydrophobicContact CB-CG2 4.32Å; H192-T196 PolarHBondContact ND1-OG1 3.45Å
193	T	93.8	Very high	94.8	Very high	47 Å²	47	33.4 Å²	33.4	29%	0.288	17%	0.172	S	C	.	.			trans	-145.1	168.5	176.5	73.7	0	0	0	0	110.9	E195 T196 S197	T193-E195 VanDerWaalsContact C-N 3.29Å; T193-E195 VanDerWaalsContact CB-OE2 3.3Å; T193-E195 WeakPolarHBondContact CB-OE2 3.38Å; T193-E195 PolarHBondContact O-N 2.89Å; T193-E195 PolarHBondContact OG1-N 3.42Å; T193-E195 PolarHBondContact OG1-OE2 2.94Å; T193-T196 PolarHBondContact O-N 3.42Å; T193-T196 PolarHBondContact OG1-N 2.64Å; T193-T196 PolarHBondContact OG1-OG1 3.4Å; T193-S197 PolarHBondContact O-N 3.48Å; T193-S197 PolarHBondContact O-OG 3.16Å; T193-S197 VanDerWaalsContact O-OG 3.06Å
194	E	94.5	Very high	94.7	Very high	98 Å²	98	34.4 Å²	34.4	46%	0.458	18%	0.183	S	C	.	.	H	α-helix	trans	-58.1	-42.5	173.2	-62.4	-167.4	178.5	0	0	111.2	T196 S197 V198 Y234 G236	E194-T196 PolarHBondContact O-N 3.17Å; E194-S197 PolarHBondContact O-N 2.95Å; E194-V198 WeakPolarHBondContact O-CG2 3.07Å; E194-V198 PolarHBondContact O-N 3.02Å; E194-Y234 WeakPolarHBondContact CG-O 3.25Å; E194-G236 WeakPolarHBondContact OE1-CA 3.35Å
195	E	94.9	Very high	94.9	Very high	124 Å²	124	34.4 Å²	34.4	58%	0.579	18%	0.183	S	C	*	.	H	α-helix	trans	-62.9	-45	-179.6	-62.1	76.2	-165.3	0	0	112	T193 S197 V198 Q199	T193-E195 VanDerWaalsContact C-N 3.29Å; T193-E195 VanDerWaalsContact CB-OE2 3.3Å; T193-E195 WeakPolarHBondContact CB-OE2 3.38Å; T193-E195 PolarHBondContact O-N 2.89Å; T193-E195 PolarHBondContact OG1-N 3.42Å; T193-E195 PolarHBondContact OG1-OE2 2.94Å; E195-S197 VanDerWaalsContact C-N 3.33Å; E195-V198 PolarHBondContact O-N 3.08Å; E195-Q199 WeakPolarHBondContact O-CG 3.16Å; E195-Q199 PolarHBondContact O-N 3.32Å
196	T	95.8	Very high	94.9	Very high	7 Å²	7	34.4 Å²	34.4	4%	0.043	18%	0.183	C	C	.	.	H	α-helix	trans	-64	-41.2	176.8	-57.2	0	0	0	0	111.1	A159 L163 M189 H192 T193 E194 V198 Q199 L200	A159-T196 HydrophobicContact CB-CG2 4.19Å; L163-T196 HydrophobicContact CD1-CG2 4.28Å; M189-T196 HydrophobicContact CE-CG2 3.97Å; H192-T196 HydrophobicContact CB-CG2 4.32Å; H192-T196 PolarHBondContact ND1-OG1 3.45Å; T193-T196 PolarHBondContact O-N 3.42Å; T193-T196 PolarHBondContact OG1-N 2.64Å; T193-T196 PolarHBondContact OG1-OG1 3.4Å; E194-T196 PolarHBondContact O-N 3.17Å; T196-V198 PolarHBondContact O-N 2.95Å; T196-Q199 PolarHBondContact O-N 2.95Å; T196-L200 HydrophobicContact CG2-CD1 4.2Å; T196-L200 HydrophobicContact CG2-CG 4.42Å; T196-L200 VanDerWaalsContact O-CG 3.32Å; T196-L200 WeakPolarHBondContact O-CG 3.43Å; T196-L200 PolarHBondContact O-N 3.44Å
197	S	96.5	Very high	94.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.3	-43.9	176	-63.3	0	0	0	0	111.8	F190 T193 E194 E195 Q199 L200 I201 C239	F190-S197 PolarHBondContact O-OG 3.43Å; T193-S197 PolarHBondContact O-N 3.48Å; T193-S197 PolarHBondContact O-OG 3.16Å; T193-S197 VanDerWaalsContact O-OG 3.06Å; E194-S197 PolarHBondContact O-N 2.95Å; E195-S197 VanDerWaalsContact C-N 3.33Å; S197-Q199 VanDerWaalsContact C-N 3.33Å; S197-Q199 PolarHBondContact O-N 3.44Å; S197-L200 PolarHBondContact O-N 3.02Å; S197-I201 VanDerWaalsContact O-CG1 3.24Å; S197-I201 WeakPolarHBondContact O-CG1 3.5Å; S197-I201 PolarHBondContact O-N 3.4Å; S197-C239 VanDerWaalsContact CB-SG 3.53Å
198	V	95.8	Very high	94.9	Very high	19 Å²	19	35.9 Å²	35.9	12%	0.115	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-43.6	174.6	171.1	0	0	0	0	111	E194 E195 T196 I201 S202 R238 C239	E194-V198 WeakPolarHBondContact O-CG2 3.07Å; E194-V198 PolarHBondContact O-N 3.02Å; E195-V198 PolarHBondContact O-N 3.08Å; T196-V198 PolarHBondContact O-N 2.95Å; V198-I201 PolarHBondContact O-N 2.94Å; V198-S202 VanDerWaalsContact O-CB 3.27Å; V198-S202 WeakPolarHBondContact O-CB 3.29Å; V198-S202 PolarHBondContact O-N 3.42Å; V198-S202 PolarHBondContact O-OG 2.66Å; V198-R238 HydrophobicContact CG2-CG 4.32Å; V198-C239 WeakPolarHBondContact CG2-SG 3.43Å
199	Q	95.2	Very high	95	Very high	90 Å²	90	34.8 Å²	34.8	42%	0.421	19%	0.186	S	C	.	.	H	α-helix	trans	-63.6	-44.3	177.9	-73.2	174.9	-14.9	0	0	111.8	L163 E195 T196 S197 S202 N203	L163-Q199 HydrophobicContact CD2-CB 3.94Å; E195-Q199 WeakPolarHBondContact O-CG 3.16Å; E195-Q199 PolarHBondContact O-N 3.32Å; T196-Q199 PolarHBondContact O-N 2.95Å; S197-Q199 VanDerWaalsContact C-N 3.33Å; S197-Q199 PolarHBondContact O-N 3.44Å; Q199-S202 PolarHBondContact O-N 3.32Å; Q199-N203 WeakPolarHBondContact O-CB 3.42Å; Q199-N203 PolarHBondContact O-N 3.43Å; Q199-N203 VanDerWaalsContact O-N 3.11Å; Q199-N203 PolarHBondContact O-ND2 3.4Å
200	L	96.3	Very high	94.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.3	-48.7	176.5	-73.6	171.4	0	0	0	111.5	L163 L167 L186 M189 F190 T196 S197 N203 G204 A205	L163-L200 HydrophobicContact CD1-CD2 3.66Å; L163-L200 HydrophobicContact CD1-CG 4.23Å; L167-L200 HydrophobicContact CD2-CD2 3.99Å; L186-L200 HydrophobicContact CD2-CD2 3.93Å; M189-L200 HydrophobicContact CB-CD1 3.88Å; F190-L200 HydrophobicContact CD1-CD1 3.9Å; F190-L200 HydrophobicContact CD2-CD1 4.37Å; F190-L200 HydrophobicContact CE1-CB 3.73Å; F190-L200 HydrophobicContact CE1-CD1 3.84Å; F190-L200 HydrophobicContact CE1-CG 4.47Å; F190-L200 HydrophobicContact CE2-CD1 4.28Å; F190-L200 HydrophobicContact CG-CD1 4.16Å; F190-L200 HydrophobicContact CZ-CB 3.79Å; F190-L200 HydrophobicContact CZ-CD1 4.04Å; T196-L200 HydrophobicContact CG2-CD1 4.2Å; T196-L200 HydrophobicContact CG2-CG 4.42Å; T196-L200 VanDerWaalsContact O-CG 3.32Å; T196-L200 WeakPolarHBondContact O-CG 3.43Å; T196-L200 PolarHBondContact O-N 3.44Å; S197-L200 PolarHBondContact O-N 3.02Å; L200-N203 PolarHBondContact O-N 2.97Å; L200-G204 PolarHBondContact O-N 3.26Å; L200-A205 HydrophobicContact CB-CB 3.99Å; L200-A205 HydrophobicContact CD2-CB 4.09Å; L200-A205 VanDerWaalsContact O-CB 3.22Å; L200-A205 WeakPolarHBondContact O-CB 3.49Å; L200-A205 PolarHBondContact O-N 2.99Å
201	I	95.9	Very high	94.7	Very high	5 Å²	5	38 Å²	38	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-63	-46.7	179	-62.5	164.8	0	0	0	110.8	F190 S197 V198 N203 G204 L206 C239 L242	F190-I201 HydrophobicContact CE1-CG1 4.13Å; S197-I201 VanDerWaalsContact O-CG1 3.24Å; S197-I201 WeakPolarHBondContact O-CG1 3.5Å; S197-I201 PolarHBondContact O-N 3.4Å; V198-I201 PolarHBondContact O-N 2.94Å; I201-N203 PolarHBondContact O-N 3.38Å; I201-G204 PolarHBondContact O-N 3.03Å; I201-G204 VanDerWaalsContact O-N 3.15Å; I201-L206 HydrophobicContact CB-CB 4.38Å; I201-L206 HydrophobicContact CG1-CB 4.06Å; I201-L206 HydrophobicContact CG1-CD2 4.15Å; I201-L206 HydrophobicContact CG2-CB 4.21Å; I201-L206 HydrophobicContact CG2-CD2 3.93Å; I201-C239 HydrophobicContact CD1-CB 3.75Å; I201-L242 HydrophobicContact CB-CD1 4.45Å; I201-L242 HydrophobicContact CD1-CB 4.31Å; I201-L242 HydrophobicContact CD1-CD1 4.32Å; I201-L242 HydrophobicContact CG2-CB 3.91Å; I201-L242 HydrophobicContact CG2-CD1 4.1Å
202	S	94.1	Very high	94.8	Very high	81 Å²	81	36.8 Å²	36.8	57%	0.566	20%	0.195	S	C	*	.	H	α-helix	trans	-64.9	-23.4	-176.7	-55.5	0	0	0	0	113	V198 Q199	V198-S202 VanDerWaalsContact O-CB 3.27Å; V198-S202 WeakPolarHBondContact O-CB 3.29Å; V198-S202 PolarHBondContact O-N 3.42Å; V198-S202 PolarHBondContact O-OG 2.66Å; Q199-S202 PolarHBondContact O-N 3.32Å
203	N	93.5	Very high	94.7	Very high	95 Å²	95	35 Å²	35	51%	0.508	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	15.9	179.4	-70.1	-81.7	0	0	0	113.5	L167 Q199 L200 I201	L167-N203 HydrophobicContact CD1-CB 3.6Å; L167-N203 HydrophobicContact CD2-CB 3.67Å; L167-N203 HydrophobicContact CG-CB 4.2Å; Q199-N203 WeakPolarHBondContact O-CB 3.42Å; Q199-N203 PolarHBondContact O-N 3.43Å; Q199-N203 VanDerWaalsContact O-N 3.11Å; Q199-N203 PolarHBondContact O-ND2 3.4Å; L200-N203 PolarHBondContact O-N 2.97Å; I201-N203 PolarHBondContact O-N 3.38Å
204	G	93.2	Very high	94.5	Very high	21 Å²	21	35.8 Å²	35.8	22%	0.216	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	8.8	170.1	0	0	0	0	0	116	L200 I201 L206 D207 A208	L200-G204 PolarHBondContact O-N 3.26Å; I201-G204 PolarHBondContact O-N 3.03Å; I201-G204 VanDerWaalsContact O-N 3.15Å; G204-L206 VanDerWaalsContact C-N 3.33Å; G204-L206 PolarHBondContact O-N 2.83Å; G204-D207 WeakPolarHBondContact CA-OD2 3.41Å; G204-D207 PolarHBondContact O-N 3.18Å; G204-A208 PolarHBondContact O-N 2.71Å; G204-A208 VanDerWaalsContact O-N 3.1Å
205	A	95.6	Very high	94.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-65.9	-37.1	175.5	0	0	0	0	0	111.9	L167 T170 L186 F190 L200 A208 L209	L167-A205 HydrophobicContact CD2-CB 4.05Å; T170-A205 HydrophobicContact CG2-CB 4.38Å; L186-A205 HydrophobicContact CD1-CB 4.18Å; L186-A205 HydrophobicContact CD2-CB 3.87Å; F190-A205 HydrophobicContact CZ-CB 4.44Å; L200-A205 HydrophobicContact CB-CB 3.99Å; L200-A205 HydrophobicContact CD2-CB 4.09Å; L200-A205 VanDerWaalsContact O-CB 3.22Å; L200-A205 WeakPolarHBondContact O-CB 3.49Å; L200-A205 PolarHBondContact O-N 2.99Å; A205-A208 PolarHBondContact O-N 2.65Å; A205-L209 PolarHBondContact O-N 3.44Å; A205-L209 VanDerWaalsContact O-N 3.1Å
206	L	95.9	Very high	93.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.1	-40.8	174.2	179.9	61.9	0	0	0	111.2	I201 G204 A208 L209 L210 L228 M243 K246	I201-L206 HydrophobicContact CB-CB 4.38Å; I201-L206 HydrophobicContact CG1-CB 4.06Å; I201-L206 HydrophobicContact CG1-CD2 4.15Å; I201-L206 HydrophobicContact CG2-CB 4.21Å; I201-L206 HydrophobicContact CG2-CD2 3.93Å; G204-L206 VanDerWaalsContact C-N 3.33Å; G204-L206 PolarHBondContact O-N 2.83Å; L206-A208 VanDerWaalsContact C-N 3.28Å; L206-A208 PolarHBondContact O-N 3.14Å; L206-L209 PolarHBondContact O-N 2.69Å; L206-L210 HydrophobicContact CD1-CD1 4.36Å; L206-L210 HydrophobicContact CD1-CD2 4.47Å; L206-L210 HydrophobicContact CD1-CG 4.16Å; L206-L210 HydrophobicContact CG-CD1 4.08Å; L206-L210 HydrophobicContact CG-CG 4.29Å; L206-L210 VanDerWaalsContact O-CG 3.28Å; L206-L210 WeakPolarHBondContact O-CG 3.44Å; L206-L210 PolarHBondContact O-N 3.2Å; L206-L228 HydrophobicContact CD1-CD2 3.54Å; L206-M243 HydrophobicContact CD2-CB 4.49Å; L206-M243 HydrophobicContact CD2-CG 4.03Å; L206-K246 HydrophobicContact CD2-CB 4.04Å; L206-K246 HydrophobicContact CD2-CG 4.12Å
207	D	94.9	Very high	93.5	Very high	59 Å²	59	31.6 Å²	31.6	32%	0.316	18%	0.18	S	C	.	.	H	α-helix	trans	-60.3	-39.4	176.4	-61.8	-78	0	0	0	111.5	G204 L210 F211 K246	G204-D207 WeakPolarHBondContact CA-OD2 3.41Å; G204-D207 PolarHBondContact O-N 3.18Å; D207-L210 PolarHBondContact O-N 2.66Å; D207-F211 WeakPolarHBondContact O-CB 3.05Å; D207-F211 PolarHBondContact O-N 3.04Å; D207-K246 WeakPolarHBondContact OD1-CD 3.11Å; D207-K246 IonicContact OD1-NZ 3.46Å; D207-K246 PolarHBondContact OD1-NZ 3.4Å; D207-K246 IonicContact OD2-NZ 2.81Å; D207-K246 PolarHBondContact OD2-NZ 2.91Å
208	A	94.9	Very high	93.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.8	-44.7	174.5	0	0	0	0	0	112.5	Q173 G204 A205 L206 L210 F211 W212	Q173-A208 HydrophobicContact CG-CB 4.48Å; G204-A208 PolarHBondContact O-N 2.71Å; G204-A208 VanDerWaalsContact O-N 3.1Å; A205-A208 PolarHBondContact O-N 2.65Å; L206-A208 VanDerWaalsContact C-N 3.28Å; L206-A208 PolarHBondContact O-N 3.14Å; A208-L210 PolarHBondContact O-N 3.16Å; A208-F211 WeakPolarHBondContact O-CB 3.43Å; A208-F211 PolarHBondContact O-N 3.11Å; A208-W212 HydrophobicContact CB-CH2 4.17Å; A208-W212 HydrophobicContact CB-CZ2 4.36Å; A208-W212 HydrophobicContact CB-CZ3 4.32Å; A208-W212 PolarHBondContact O-N 2.91Å
209	L	95.5	Very high	92.8	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-46	175	-70.9	179.1	0	0	0	112	L186 F190 A205 L206 F211 W212 C213 A227	L186-L209 HydrophobicContact CB-CD2 4.35Å; L186-L209 HydrophobicContact CD1-CD1 4.46Å; L186-L209 HydrophobicContact CD1-CD2 3.87Å; L186-L209 HydrophobicContact CD1-CG 3.91Å; F190-L209 HydrophobicContact CD2-CD1 4.04Å; F190-L209 HydrophobicContact CE2-CD1 3.43Å; F190-L209 VanDerWaalsContact CE2-CD1 3.43Å; F190-L209 HydrophobicContact CZ-CD1 4.24Å; A205-L209 PolarHBondContact O-N 3.44Å; A205-L209 VanDerWaalsContact O-N 3.1Å; L206-L209 PolarHBondContact O-N 2.69Å; L209-F211 VanDerWaalsContact C-N 3.28Å; L209-F211 PolarHBondContact O-N 3.37Å; L209-W212 HydrophobicContact CD2-CE3 4.02Å; L209-W212 HydrophobicContact CD2-CZ3 4.14Å; L209-W212 PolarHBondContact O-N 2.78Å; L209-C213 PolarHBondContact O-N 3.22Å; L209-C213 PolarHBondContact O-SG 2.9Å; L209-A227 HydrophobicContact CD1-CB 3.61Å; L209-A227 HydrophobicContact CD2-CB 4.15Å
210	L	94.6	Very high	92.7	Very high	7 Å²	7	32.2 Å²	32.2	4%	0.037	19%	0.191	C	C	.	.	H	α-helix	trans	-66	-31.9	179	-63.9	178.5	0	0	0	112.1	L206 D207 A208 C213 L228 K246 A248 W251	L206-L210 HydrophobicContact CD1-CD1 4.36Å; L206-L210 HydrophobicContact CD1-CD2 4.47Å; L206-L210 HydrophobicContact CD1-CG 4.16Å; L206-L210 HydrophobicContact CG-CD1 4.08Å; L206-L210 HydrophobicContact CG-CG 4.29Å; L206-L210 VanDerWaalsContact O-CG 3.28Å; L206-L210 WeakPolarHBondContact O-CG 3.44Å; L206-L210 PolarHBondContact O-N 3.2Å; D207-L210 PolarHBondContact O-N 2.66Å; A208-L210 PolarHBondContact O-N 3.16Å; L210-C213 WeakPolarHBondContact O-CB 3.46Å; L210-L228 HydrophobicContact CD2-CD1 4.38Å; L210-L228 HydrophobicContact CD2-CD2 4.1Å; L210-K246 HydrophobicContact CD1-CB 4.07Å; L210-K246 WeakPolarHBondContact CD1-O 3.32Å; L210-A248 HydrophobicContact CD1-CB 4.44Å; L210-A248 HydrophobicContact CD2-CB 3.95Å; L210-W251 HydrophobicContact CB-CG 4.4Å; L210-W251 HydrophobicContact CD2-CB 3.72Å; L210-W251 HydrophobicContact CD2-CG 4.04Å
211	F	92.6	Very high	92.6	Very high	62 Å²	62	32.8 Å²	32.8	27%	0.272	19%	0.194	S	C	.	.	H	α-helix	trans	-64.6	-48.6	170.8	175.7	-94.1	0	0	0	111.3	Q173 D207 A208 L209 C213 R214	Q173-F211 HydrophobicContact CB-CD1 3.81Å; Q173-F211 HydrophobicContact CB-CE1 3.74Å; Q173-F211 HydrophobicContact CB-CZ 4.45Å; Q173-F211 HydrophobicContact CG-CD1 4.36Å; D207-F211 WeakPolarHBondContact O-CB 3.05Å; D207-F211 PolarHBondContact O-N 3.04Å; A208-F211 WeakPolarHBondContact O-CB 3.43Å; A208-F211 PolarHBondContact O-N 3.11Å; L209-F211 VanDerWaalsContact C-N 3.28Å; L209-F211 PolarHBondContact O-N 3.37Å; F211-C213 PolarHBondContact O-N 3.2Å; F211-R214 WeakPolarHBondContact O-CB 3.44Å; F211-R214 WeakPolarHBondContact O-CD 3.47Å; F211-R214 VanDerWaalsContact O-CG 3.3Å; F211-R214 WeakPolarHBondContact O-CG 3.49Å; F211-R214 PolarHBondContact O-N 3.4Å
212	W	93.6	Very high	92.4	Very high	15 Å²	15	36.2 Å²	36.2	6%	0.057	21%	0.207	C	C	.	.	H	α-helix	trans	-66.5	-21.6	179.9	-65.2	-36.1	0	0	0	114.1	Q173 A179 V182 L186 A208 L209 R214 G215 V220 L221	Q173-W212 PolarHBondContact O-NE1 2.9Å; Q173-W212 VanDerWaalsContact O-NE1 3.12Å; A179-W212 HydrophobicContact CB-CD2 4.21Å; A179-W212 HydrophobicContact CB-CG 4.49Å; A179-W212 HydrophobicContact CB-CZ2 4Å; V182-W212 HydrophobicContact CB-CH2 4.02Å; V182-W212 HydrophobicContact CG1-CH2 3.73Å; V182-W212 HydrophobicContact CG1-CZ3 4.35Å; L186-W212 HydrophobicContact CD1-CZ3 4.13Å; A208-W212 HydrophobicContact CB-CH2 4.17Å; A208-W212 HydrophobicContact CB-CZ2 4.36Å; A208-W212 HydrophobicContact CB-CZ3 4.32Å; A208-W212 PolarHBondContact O-N 2.91Å; L209-W212 HydrophobicContact CD2-CE3 4.02Å; L209-W212 HydrophobicContact CD2-CZ3 4.14Å; L209-W212 PolarHBondContact O-N 2.78Å; W212-R214 PolarHBondContact O-N 3.44Å; W212-R214 VanDerWaalsContact O-N 3.08Å; W212-G215 PolarHBondContact O-N 3.27Å; W212-V220 HydrophobicContact CB-CG1 3.72Å; W212-V220 HydrophobicContact CG-CG1 4.12Å; W212-L221 WeakPolarHBondContact O-CD2 3.32Å
213	C	92.2	Very high	92.4	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.02	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-14.7	170.6	-66	0	0	0	0	113.7	L209 L210 F211 G215 W251	L209-C213 PolarHBondContact O-N 3.22Å; L209-C213 PolarHBondContact O-SG 2.9Å; L210-C213 WeakPolarHBondContact O-CB 3.46Å; F211-C213 PolarHBondContact O-N 3.2Å; C213-G215 VanDerWaalsContact C-N 3.34Å; C213-W251 HydrophobicContact CB-CE3 4.42Å
214	R	88.8	Confident	92.6	Very high	64 Å²	64	29 Å²	29	24%	0.242	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-14.7	175.2	-62.3	168.8	-168.3	-178.8	2.6	113.9	F211 W212 W251 Q682	F211-R214 WeakPolarHBondContact O-CB 3.44Å; F211-R214 WeakPolarHBondContact O-CD 3.47Å; F211-R214 VanDerWaalsContact O-CG 3.3Å; F211-R214 WeakPolarHBondContact O-CG 3.49Å; F211-R214 PolarHBondContact O-N 3.4Å; W212-R214 PolarHBondContact O-N 3.44Å; W212-R214 VanDerWaalsContact O-N 3.08Å; R214-W251 HydrophobicContact CG-CE3 4.23Å; R214-W251 HydrophobicContact CG-CH2 3.61Å; R214-W251 HydrophobicContact CG-CZ3 3.34Å; R214-Q682 PolarHBondContact O-NE2 2.72Å
215	G	87.1	Confident	92.7	Very high	33 Å²	33	28 Å²	28	34%	0.34	15%	0.151	S	C	.	.	S	Bend	trans	-76.9	-177.1	-176.4	0	0	0	0	0	113	W212 C213	W212-G215 PolarHBondContact O-N 3.27Å; C213-G215 VanDerWaalsContact C-N 3.34Å
216	T	86.8	Confident	92.6	Very high	77 Å²	77	28.6 Å²	28.6	47%	0.472	15%	0.154	S	C	.	.			trans	-120.9	2.1	178.2	64.2	0	0	0	0	112.6	P218	T216-P218 VanDerWaalsContact O-CD 3.23Å; T216-P218 WeakPolarHBondContact O-CD 3.39Å
217	D	89.8	Confident	92.6	Very high	31 Å²	31	28.6 Å²	28.6	17%	0.166	15%	0.154	C	C	.	.			trans	-75.7	113.1	-179.2	-174.8	-34.1	0	0	0	110.6	R180 T219 V220 L221	R180-D217 IonicContact CZ-OD2 3.72Å; R180-D217 IonicContact NE-OD2 2.69Å; R180-D217 PolarHBondContact NE-OD2 3.04Å; R180-D217 IonicContact NH2-OD2 2.97Å; R180-D217 PolarHBondContact NH2-OD2 2.93Å; D217-T219 PolarHBondContact O-N 3.38Å; D217-T219 WeakPolarHBondContact OD1-CB 3.26Å; D217-T219 PolarHBondContact OD1-N 3.46Å; D217-V220 HydrophobicContact CB-CB 4.07Å; D217-V220 HydrophobicContact CB-CG2 3.9Å; D217-V220 PolarHBondContact O-N 3.15Å; D217-V220 PolarHBondContact OD1-N 2.98Å; D217-L221 WeakPolarHBondContact O-CB 3.43Å; D217-L221 VanDerWaalsContact O-CG 3.24Å; D217-L221 WeakPolarHBondContact O-CG 3.49Å; D217-L221 PolarHBondContact O-N 3.01Å
218	P	89.4	Confident	92.8	Very high	58 Å²	58	25.8 Å²	25.8	38%	0.377	14%	0.139	S	C	.	.	H	α-helix	trans	-60.3	-31.6	-176.5	-23.6	35.2	0	0	0	113.4	T216 R222	T216-P218 VanDerWaalsContact O-CD 3.23Å; T216-P218 WeakPolarHBondContact O-CD 3.39Å; P218-R222 VanDerWaalsContact O-CB 3.24Å; P218-R222 WeakPolarHBondContact O-CB 3.24Å; P218-R222 PolarHBondContact O-N 3.34Å
219	T	89.8	Confident	92.9	Very high	56 Å²	56	25.8 Å²	25.8	34%	0.344	14%	0.139	S	C	.	.	H	α-helix	trans	-70.5	-48.1	-179.4	-53.2	0	0	0	0	110.3	D217 R222 H223	D217-T219 PolarHBondContact O-N 3.38Å; D217-T219 WeakPolarHBondContact OD1-CB 3.26Å; D217-T219 PolarHBondContact OD1-N 3.46Å; T219-R222 PolarHBondContact O-N 2.99Å; T219-H223 PolarHBondContact O-N 3.27Å
220	V	92.9	Very high	92.9	Very high	9 Å²	9	26.3 Å²	26.3	6%	0.055	14%	0.142	C	C	.	.	H	α-helix	trans	-63.8	-44.3	177.6	-179	0	0	0	0	110.6	A179 R180 W212 D217 R222 H223 C224	A179-V220 HydrophobicContact CB-CG2 4.41Å; R180-V220 HydrophobicContact CB-CG2 4.35Å; R180-V220 HydrophobicContact CG-CG2 3.57Å; W212-V220 HydrophobicContact CB-CG1 3.72Å; W212-V220 HydrophobicContact CG-CG1 4.12Å; D217-V220 HydrophobicContact CB-CB 4.07Å; D217-V220 HydrophobicContact CB-CG2 3.9Å; D217-V220 PolarHBondContact O-N 3.15Å; D217-V220 PolarHBondContact OD1-N 2.98Å; V220-R222 VanDerWaalsContact C-N 3.3Å; V220-R222 PolarHBondContact O-N 3.38Å; V220-H223 PolarHBondContact O-N 3.36Å; V220-C224 WeakPolarHBondContact O-CB 3.28Å; V220-C224 PolarHBondContact O-N 3.1Å; V220-C224 PolarHBondContact O-SG 3.26Å
221	L	93.7	Very high	93	Very high	12 Å²	12	26 Å²	26	6%	0.063	14%	0.14	C	C	.	.	H	α-helix	trans	-64.4	-35.6	179	-66.4	178.4	0	0	0	112	W212 D217 C224 A225 L255 I264	W212-L221 WeakPolarHBondContact O-CD2 3.32Å; D217-L221 WeakPolarHBondContact O-CB 3.43Å; D217-L221 VanDerWaalsContact O-CG 3.24Å; D217-L221 WeakPolarHBondContact O-CG 3.49Å; D217-L221 PolarHBondContact O-N 3.01Å; L221-C224 PolarHBondContact O-N 3.44Å; L221-A225 WeakPolarHBondContact O-CB 3.24Å; L221-A225 PolarHBondContact O-N 3.05Å; L221-L255 HydrophobicContact CB-CD2 4.15Å; L221-L255 HydrophobicContact CD2-CD2 3.78Å; L221-L255 HydrophobicContact CG-CD2 4.39Å; L221-I264 HydrophobicContact CB-CD1 3.82Å
222	R	92.6	Very high	93.2	Very high	77 Å²	77	23 Å²	23	29%	0.291	13%	0.127	S	C	.	.	H	α-helix	trans	-64.1	-50.9	173.2	-166.9	-177.9	-62.3	142.8	-4.4	111.4	P218 T219 V220 C224 A225 V226 D261 I264	P218-R222 VanDerWaalsContact O-CB 3.24Å; P218-R222 WeakPolarHBondContact O-CB 3.24Å; P218-R222 PolarHBondContact O-N 3.34Å; T219-R222 PolarHBondContact O-N 2.99Å; V220-R222 VanDerWaalsContact C-N 3.3Å; V220-R222 PolarHBondContact O-N 3.38Å; R222-C224 VanDerWaalsContact C-N 3.29Å; R222-C224 PolarHBondContact O-N 2.88Å; R222-A225 PolarHBondContact O-N 3.34Å; R222-V226 WeakPolarHBondContact O-CG2 3.45Å; R222-V226 PolarHBondContact O-N 3.08Å; R222-D261 IonicContact CZ-OD2 2.75Å; R222-D261 VanDerWaalsContact CZ-OD2 3.27Å; R222-D261 IonicContact NE-OD2 2.83Å; R222-D261 PolarHBondContact NE-OD2 3.24Å; R222-D261 VanDerWaalsContact NE-OD2 3.08Å; R222-D261 IonicContact NH2-OD2 4Å; R222-D261 PolarHBondContact NH2-OD2 3.47Å; R222-I264 HydrophobicContact CB-CD1 4.45Å; R222-I264 HydrophobicContact CB-CG1 3.97Å; R222-I264 HydrophobicContact CG-CG1 4.37Å
223	H	93.8	Very high	93.2	Very high	25 Å²	25	23.7 Å²	23.7	12%	0.116	13%	0.131	C	C	.	.	H	α-helix	trans	-58.2	-41.5	175	-67.6	165.3	0	0	0	111.9	E147 R180 S183 G184 E187 T219 V220 V226 A227	E147-H223 IonicContact OE1-CE1 2.8Å; E147-H223 IonicContact OE1-NE2 2.67Å; R180-H223 PolarHBondContact O-CE1 3.48Å; R180-H223 PolarHBondContact O-ND1 3.34Å; S183-H223 WeakPolarHBondContact OG-CB 3.35Å; S183-H223 PolarHBondContact OG-ND1 3.22Å; G184-H223 WeakPolarHBondContact CA-ND1 3.45Å; G184-H223 PolarHBondContact N-ND1 3.19Å; E187-H223 IonicContact OE2-CD2 2.68Å; E187-H223 PolarHBondContact OE2-CD2 3.42Å; E187-H223 IonicContact OE2-CG 3.51Å; T219-H223 PolarHBondContact O-N 3.27Å; V220-H223 PolarHBondContact O-N 3.36Å; H223-V226 PolarHBondContact O-N 3.31Å; H223-A227 WeakPolarHBondContact O-CB 3.36Å; H223-A227 PolarHBondContact O-N 3.09Å
224	C	96.1	Very high	93.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.8	-45.2	176.7	-67.9	0	0	0	0	112.3	V220 L221 R222 V226 A227 L228	V220-C224 WeakPolarHBondContact O-CB 3.28Å; V220-C224 PolarHBondContact O-N 3.1Å; V220-C224 PolarHBondContact O-SG 3.26Å; L221-C224 PolarHBondContact O-N 3.44Å; R222-C224 VanDerWaalsContact C-N 3.29Å; R222-C224 PolarHBondContact O-N 2.88Å; C224-V226 PolarHBondContact O-N 3.09Å; C224-A227 PolarHBondContact O-N 2.93Å; C224-L228 WeakPolarHBondContact O-CB 3.32Å; C224-L228 VanDerWaalsContact O-CG 3.23Å; C224-L228 WeakPolarHBondContact O-CG 3.41Å; C224-L228 PolarHBondContact O-N 3.37Å
225	A	95.7	Very high	93.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.5	-44.8	178.3	0	0	0	0	0	111.6	L221 R222 A229 L255 I264 H267	L221-A225 WeakPolarHBondContact O-CB 3.24Å; L221-A225 PolarHBondContact O-N 3.05Å; R222-A225 PolarHBondContact O-N 3.34Å; A225-A229 WeakPolarHBondContact O-CB 3.27Å; A225-A229 PolarHBondContact O-N 3.09Å; A225-L255 HydrophobicContact CB-CD1 4.14Å; A225-I264 HydrophobicContact CB-CG2 4.28Å; A225-H267 HydrophobicContact CB-CB 3.84Å
226	V	94.3	Very high	93.8	Very high	12 Å²	12	20.8 Å²	20.8	7%	0.073	11%	0.114	C	C	.	.	H	α-helix	trans	-69.3	-40.7	178.4	-173.5	0	0	0	0	111.1	E187 R222 H223 C224 L228 A229 N230 H267	E187-V226 VanDerWaalsContact CD-CG1 3.44Å; E187-V226 HydrophobicContact CG-CB 3.74Å; E187-V226 HydrophobicContact CG-CG1 3.53Å; E187-V226 WeakPolarHBondContact OE1-CG1 3.39Å; R222-V226 WeakPolarHBondContact O-CG2 3.45Å; R222-V226 PolarHBondContact O-N 3.08Å; H223-V226 PolarHBondContact O-N 3.31Å; C224-V226 PolarHBondContact O-N 3.09Å; V226-L228 PolarHBondContact O-N 3.36Å; V226-A229 PolarHBondContact O-N 2.95Å; V226-N230 WeakPolarHBondContact O-CB 3.39Å; V226-N230 VanDerWaalsContact O-CG 3.28Å; V226-N230 PolarHBondContact O-N 3.03Å; V226-H267 HydrophobicContact CG2-CB 4.17Å; V226-H267 VanDerWaalsContact CG2-CD2 3.47Å; V226-H267 WeakPolarHBondContact CG2-CD2 3.2Å
227	A	96.6	Very high	94.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.4	-43	176.9	0	0	0	0	0	112.2	E187 F190 L209 H223 C224 N230 C231	E187-A227 HydrophobicContact CB-CB 4.1Å; F190-A227 HydrophobicContact CD2-CB 4.16Å; L209-A227 HydrophobicContact CD1-CB 3.61Å; L209-A227 HydrophobicContact CD2-CB 4.15Å; H223-A227 WeakPolarHBondContact O-CB 3.36Å; H223-A227 PolarHBondContact O-N 3.09Å; C224-A227 PolarHBondContact O-N 2.93Å; A227-N230 PolarHBondContact O-N 3.37Å; A227-C231 WeakPolarHBondContact O-CB 3.22Å; A227-C231 PolarHBondContact O-N 3.33Å
228	L	97.6	Very high	94.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.3	-39.8	174.9	-69.7	171.4	0	0	0	111.6	L206 L210 C224 V226 C231 A232 M243 L252 L255 A271	L206-L228 HydrophobicContact CD1-CD2 3.54Å; L210-L228 HydrophobicContact CD2-CD1 4.38Å; L210-L228 HydrophobicContact CD2-CD2 4.1Å; C224-L228 WeakPolarHBondContact O-CB 3.32Å; C224-L228 VanDerWaalsContact O-CG 3.23Å; C224-L228 WeakPolarHBondContact O-CG 3.41Å; C224-L228 PolarHBondContact O-N 3.37Å; V226-L228 PolarHBondContact O-N 3.36Å; L228-C231 PolarHBondContact O-N 3.3Å; L228-A232 WeakPolarHBondContact O-CB 3.34Å; L228-A232 PolarHBondContact O-N 3Å; L228-M243 HydrophobicContact CB-CE 4.44Å; L228-M243 HydrophobicContact CD2-CE 4.05Å; L228-L252 HydrophobicContact CB-CD2 4.11Å; L228-L252 HydrophobicContact CD1-CD2 3.67Å; L228-L252 HydrophobicContact CD1-CG 4.2Å; L228-L255 HydrophobicContact CD1-CD1 4.3Å; L228-A271 HydrophobicContact CB-CB 4.4Å
229	A	96.6	Very high	94.6	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63.9	-44.7	174.6	0	0	0	0	0	111.8	A225 V226 A232 M233 L270 A271	A225-A229 WeakPolarHBondContact O-CB 3.27Å; A225-A229 PolarHBondContact O-N 3.09Å; V226-A229 PolarHBondContact O-N 2.95Å; A229-A232 PolarHBondContact O-N 3.23Å; A229-M233 HydrophobicContact CB-CE 4.29Å; A229-M233 WeakPolarHBondContact O-CB 3.44Å; A229-M233 WeakPolarHBondContact O-CG 3.46Å; A229-M233 PolarHBondContact O-N 3.49Å; A229-L270 HydrophobicContact CB-CD2 4.43Å; A229-A271 HydrophobicContact CB-CB 4.06Å
230	N	96	Very high	94.9	Very high	11 Å²	11	23.2 Å²	23.2	6%	0.059	10%	0.104	C	C	.	.	H	α-helix	trans	-62.2	-45.5	176.1	-71.4	-14.6	0	0	0	110.7	E187 F190 V226 A227 A232 M233 Y234	E187-N230 PolarHBondContact O-ND2 2.74Å; F190-N230 HydrophobicContact CB-CB 4.03Å; V226-N230 WeakPolarHBondContact O-CB 3.39Å; V226-N230 VanDerWaalsContact O-CG 3.28Å; V226-N230 PolarHBondContact O-N 3.03Å; A227-N230 PolarHBondContact O-N 3.37Å; N230-A232 VanDerWaalsContact C-N 3.29Å; N230-A232 PolarHBondContact O-N 3.31Å; N230-M233 PolarHBondContact O-N 3.39Å; N230-Y234 HydrophobicContact CB-CD2 3.94Å; N230-Y234 HydrophobicContact CB-CE2 4.21Å; N230-Y234 WeakPolarHBondContact O-CB 3.25Å; N230-Y234 WeakPolarHBondContact O-CD2 3.41Å; N230-Y234 PolarHBondContact O-N 3.33Å
231	C	97	Very high	95.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-58.2	-42.1	176.8	-171	0	0	0	0	112	F190 A227 L228 G235 M243	F190-C231 HydrophobicContact CB-CB 4.27Å; F190-C231 HydrophobicContact CD1-CB 3.65Å; F190-C231 HydrophobicContact CE1-CB 4.13Å; F190-C231 HydrophobicContact CG-CB 3.96Å; A227-C231 WeakPolarHBondContact O-CB 3.22Å; A227-C231 PolarHBondContact O-N 3.33Å; L228-C231 PolarHBondContact O-N 3.3Å; C231-G235 VanDerWaalsContact O-CA 3.28Å; C231-G235 WeakPolarHBondContact O-CA 3.49Å; C231-G235 PolarHBondContact O-N 3.28Å; C231-M243 HydrophobicContact CB-CE 4.26Å; C231-M243 HydrophobicContact CB-SD 4.02Å; C231-M243 VanDerWaalsContact SG-SD 3.61Å
232	A	96.6	Very high	95.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-68.2	-40.4	177.2	0	0	0	0	0	113	L228 A229 N230 Q240 M243 V274 L275	L228-A232 WeakPolarHBondContact O-CB 3.34Å; L228-A232 PolarHBondContact O-N 3Å; A229-A232 PolarHBondContact O-N 3.23Å; N230-A232 VanDerWaalsContact C-N 3.29Å; N230-A232 PolarHBondContact O-N 3.31Å; A232-Q240 PolarHBondContact O-NE2 2.93Å; A232-M243 HydrophobicContact CB-CE 4.28Å; A232-M243 HydrophobicContact CB-SD 4.2Å; A232-V274 HydrophobicContact CB-CB 4.09Å; A232-V274 HydrophobicContact CB-CG1 3.81Å; A232-V274 VanDerWaalsContact O-CG1 3.29Å; A232-V274 WeakPolarHBondContact O-CG1 3.29Å; A232-L275 HydrophobicContact CB-CD2 4.2Å; A232-L275 HydrophobicContact CB-CG 4.15Å
233	M	94.2	Very high	95.4	Very high	29 Å²	29	25 Å²	25	14%	0.143	11%	0.111	C	C	.	.	H	α-helix	trans	-77	-41.6	-176.9	-73.8	-171.1	-65.3	0	0	113.8	A229 N230 L270 V274 H327	A229-M233 HydrophobicContact CB-CE 4.29Å; A229-M233 WeakPolarHBondContact O-CB 3.44Å; A229-M233 WeakPolarHBondContact O-CG 3.46Å; A229-M233 PolarHBondContact O-N 3.49Å; N230-M233 PolarHBondContact O-N 3.39Å; M233-L270 HydrophobicContact CE-CD2 3.96Å; M233-L270 HydrophobicContact SD-CD2 3.94Å; M233-L270 HydrophobicContact SD-CG 4.28Å; M233-V274 HydrophobicContact CG-CB 4.48Å; M233-V274 HydrophobicContact CG-CG1 4.18Å; M233-V274 HydrophobicContact CG-CG2 3.73Å; M233-H327 PolarHBondContact O-ND1 3.13Å
234	Y	94.1	Very high	95.4	Very high	28 Å²	28	25 Å²	25	11%	0.11	11%	0.112	C	C	.	.	H	α-helix	trans	-106.8	-13.2	-171.1	-56.8	-78.1	0	0	0	113.6	K191 E194 N230 D324 H327	K191-Y234 HydrophobicContact CB-CD2 4.2Å; K191-Y234 HydrophobicContact CB-CE2 4.28Å; K191-Y234 HydrophobicContact CD-CE2 4.16Å; K191-Y234 WeakPolarHBondContact CE-OH 3.42Å; K191-Y234 HydrophobicContact CG-CD2 4.03Å; K191-Y234 HydrophobicContact CG-CE1 4.25Å; K191-Y234 HydrophobicContact CG-CE2 3.77Å; K191-Y234 HydrophobicContact CG-CG 4.43Å; E194-Y234 WeakPolarHBondContact CG-O 3.25Å; N230-Y234 HydrophobicContact CB-CD2 3.94Å; N230-Y234 HydrophobicContact CB-CE2 4.21Å; N230-Y234 WeakPolarHBondContact O-CB 3.25Å; N230-Y234 WeakPolarHBondContact O-CD2 3.41Å; N230-Y234 PolarHBondContact O-N 3.33Å; Y234-D324 VanDerWaalsContact OH-CG 3.31Å; Y234-D324 PolarHBondContact OH-OD1 2.89Å; Y234-H327 AromaticContact CD1-CE1 3.81Å; Y234-H327 AromaticContact CD1-NE2 3.53Å; Y234-H327 AromaticContact CE1-CD2 3.54Å; Y234-H327 AromaticContact CE1-NE2 3.44Å; Y234-H327 WeakPolarHBondContact CE1-NE2 3.31Å
235	G	92.8	Very high	95.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	-83.8	-8.5	-176.7	0	0	0	0	0	115.6	C231 C239	C231-G235 VanDerWaalsContact O-CA 3.28Å; C231-G235 WeakPolarHBondContact O-CA 3.49Å; C231-G235 PolarHBondContact O-N 3.28Å; G235-C239 WeakPolarHBondContact O-CB 3.2Å; G235-C239 PolarHBondContact O-SG 3.44Å
236	G	93.4	Very high	95.2	Very high	12 Å²	12	35.4 Å²	35.4	12%	0.124	16%	0.159	C	C	.	.	H	α-helix	trans	68.3	179.8	-179.6	0	0	0	0	0	114.7	E194 R238 C239 Q240	E194-G236 WeakPolarHBondContact OE1-CA 3.35Å; G236-R238 PolarHBondContact O-N 2.91Å; G236-R238 VanDerWaalsContact O-N 3.17Å; G236-C239 PolarHBondContact O-N 2.94Å; G236-Q240 VanDerWaalsContact O-CG 3.31Å; G236-Q240 WeakPolarHBondContact O-CG 3.35Å; G236-Q240 PolarHBondContact O-N 3.26Å; G236-Q240 VanDerWaalsContact O-N 3.1Å
237	H	93.9	Very high	95.1	Very high	114 Å²	114	38.1 Å²	38.1	53%	0.528	17%	0.171	S	C	.	.	H	α-helix	trans	-58.7	-32.7	-174.2	-74.9	-78.1	0	0	0	113.6	R241 N278	H237-R241 WeakPolarHBondContact O-CG 3.42Å; H237-R241 PolarHBondContact O-N 3.33Å; H237-R241 VanDerWaalsContact O-N 3.14Å; H237-N278 VanDerWaalsContact ND1-CG 3.34Å; H237-N278 PolarHBondContact ND1-ND2 3.3Å
238	R	94	Very high	95	Very high	141 Å²	141	38.1 Å²	38.1	53%	0.532	17%	0.171	S	C	.	.	H	α-helix	trans	-67.4	-46.5	178.6	-177.8	177	175.9	-171.2	-1.2	111.8	V198 G236 Q240 R241 L242	V198-R238 HydrophobicContact CG2-CG 4.32Å; G236-R238 PolarHBondContact O-N 2.91Å; G236-R238 VanDerWaalsContact O-N 3.17Å; R238-Q240 VanDerWaalsContact C-N 3.34Å; R238-R241 PolarHBondContact O-N 3.36Å; R238-L242 WeakPolarHBondContact O-CG 3.48Å; R238-L242 PolarHBondContact O-N 2.91Å
239	C	95.6	Very high	94.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.5	-40	177.1	-68	0	0	0	0	111.2	S197 V198 I201 G235 G236 R241 L242 M243	S197-C239 VanDerWaalsContact CB-SG 3.53Å; V198-C239 WeakPolarHBondContact CG2-SG 3.43Å; I201-C239 HydrophobicContact CD1-CB 3.75Å; G235-C239 WeakPolarHBondContact O-CB 3.2Å; G235-C239 PolarHBondContact O-SG 3.44Å; G236-C239 PolarHBondContact O-N 2.94Å; C239-R241 VanDerWaalsContact C-N 3.29Å; C239-R241 PolarHBondContact O-N 2.88Å; C239-L242 WeakPolarHBondContact O-CB 3.43Å; C239-L242 PolarHBondContact O-N 2.86Å; C239-L242 VanDerWaalsContact O-N 3.09Å; C239-M243 WeakPolarHBondContact O-CG 3.28Å; C239-M243 PolarHBondContact O-N 2.97Å
240	Q	96.6	Very high	94.5	Very high	18 Å²	18	38.9 Å²	38.9	8%	0.084	18%	0.175	C	C	.	.	H	α-helix	trans	-57.5	-41.6	176.5	-66.8	172.1	-4.1	0	0	112.1	A232 G236 R238 M243 I244 L275 N278 I281	A232-Q240 PolarHBondContact O-NE2 2.93Å; G236-Q240 VanDerWaalsContact O-CG 3.31Å; G236-Q240 WeakPolarHBondContact O-CG 3.35Å; G236-Q240 PolarHBondContact O-N 3.26Å; G236-Q240 VanDerWaalsContact O-N 3.1Å; R238-Q240 VanDerWaalsContact C-N 3.34Å; Q240-M243 WeakPolarHBondContact O-CB 3.35Å; Q240-M243 PolarHBondContact O-N 2.82Å; Q240-I244 WeakPolarHBondContact O-CG1 3.28Å; Q240-I244 PolarHBondContact O-N 3.28Å; Q240-I244 VanDerWaalsContact O-N 3.16Å; Q240-L275 HydrophobicContact CB-CD2 3.9Å; Q240-L275 HydrophobicContact CG-CD2 3.92Å; Q240-N278 VanDerWaalsContact OE1-CB 3.32Å; Q240-N278 PolarHBondContact OE1-ND2 3.43Å; Q240-I281 HydrophobicContact CB-CD1 3.86Å
241	R	95.2	Very high	94.3	Very high	99 Å²	99	38.9 Å²	38.9	37%	0.374	17%	0.174	S	C	.	.	H	α-helix	trans	-62	-47	173.1	-72.1	-175.4	-64.3	111.2	-6.8	112.2	H237 R238 C239 M243 I244 E245 I281	H237-R241 WeakPolarHBondContact O-CG 3.42Å; H237-R241 PolarHBondContact O-N 3.33Å; H237-R241 VanDerWaalsContact O-N 3.14Å; R238-R241 PolarHBondContact O-N 3.36Å; C239-R241 VanDerWaalsContact C-N 3.29Å; C239-R241 PolarHBondContact O-N 2.88Å; R241-M243 VanDerWaalsContact C-N 3.28Å; R241-M243 PolarHBondContact O-N 3Å; R241-I244 PolarHBondContact O-N 3.28Å; R241-I244 VanDerWaalsContact O-N 3.1Å; R241-E245 WeakPolarHBondContact O-CG 3.38Å; R241-E245 PolarHBondContact O-N 3.4Å; R241-I281 HydrophobicContact CG-CG2 4.15Å
242	L	95.5	Very high	94.2	Very high	36 Å²	36	38.9 Å²	38.9	19%	0.188	17%	0.174	C	C	.	.	H	α-helix	trans	-61	-37.4	177.5	-65.9	170.6	0	0	0	112.2	I201 R238 C239 I244 E245 K246	I201-L242 HydrophobicContact CB-CD1 4.45Å; I201-L242 HydrophobicContact CD1-CB 4.31Å; I201-L242 HydrophobicContact CD1-CD1 4.32Å; I201-L242 HydrophobicContact CG2-CB 3.91Å; I201-L242 HydrophobicContact CG2-CD1 4.1Å; R238-L242 WeakPolarHBondContact O-CG 3.48Å; R238-L242 PolarHBondContact O-N 2.91Å; C239-L242 WeakPolarHBondContact O-CB 3.43Å; C239-L242 PolarHBondContact O-N 2.86Å; C239-L242 VanDerWaalsContact O-N 3.09Å; L242-I244 VanDerWaalsContact C-N 3.31Å; L242-I244 PolarHBondContact O-N 3.49Å; L242-E245 PolarHBondContact O-N 3.29Å; L242-K246 WeakPolarHBondContact O-CB 3.33Å; L242-K246 VanDerWaalsContact O-CG 3.25Å; L242-K246 WeakPolarHBondContact O-CG 3.23Å; L242-K246 PolarHBondContact O-N 2.95Å
243	M	97.1	Very high	94	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61	-41.1	174.6	-71.4	177.4	78.5	0	0	111.7	L206 L228 C231 A232 C239 Q240 R241 K246 Q247 A248 L275	L206-M243 HydrophobicContact CD2-CB 4.49Å; L206-M243 HydrophobicContact CD2-CG 4.03Å; L228-M243 HydrophobicContact CB-CE 4.44Å; L228-M243 HydrophobicContact CD2-CE 4.05Å; C231-M243 HydrophobicContact CB-CE 4.26Å; C231-M243 HydrophobicContact CB-SD 4.02Å; C231-M243 VanDerWaalsContact SG-SD 3.61Å; A232-M243 HydrophobicContact CB-CE 4.28Å; A232-M243 HydrophobicContact CB-SD 4.2Å; C239-M243 WeakPolarHBondContact O-CG 3.28Å; C239-M243 PolarHBondContact O-N 2.97Å; Q240-M243 WeakPolarHBondContact O-CB 3.35Å; Q240-M243 PolarHBondContact O-N 2.82Å; R241-M243 VanDerWaalsContact C-N 3.28Å; R241-M243 PolarHBondContact O-N 3Å; M243-K246 CarbonylContact O-C 3.47Å; M243-K246 PolarHBondContact O-N 2.86Å; M243-Q247 PolarHBondContact O-N 3.21Å; M243-A248 HydrophobicContact CB-CB 3.99Å; M243-A248 HydrophobicContact CE-CB 4.3Å; M243-A248 WeakPolarHBondContact O-CB 3.42Å; M243-A248 PolarHBondContact O-N 3.22Å; M243-L275 HydrophobicContact CB-CD2 4.41Å; M243-L275 HydrophobicContact CE-CD1 4.29Å; M243-L275 HydrophobicContact CE-CD2 4.49Å; M243-L275 HydrophobicContact SD-CD2 4.06Å
244	I	95.3	Very high	93.8	Very high	26 Å²	26	38.1 Å²	38.1	13%	0.133	17%	0.171	C	C	.	.	H	α-helix	trans	-73.1	-39.9	179.1	-63.6	-67.3	0	0	0	111.8	Q240 R241 L242 K246 Q247 A249 L275 I281 E284 V285	Q240-I244 WeakPolarHBondContact O-CG1 3.28Å; Q240-I244 PolarHBondContact O-N 3.28Å; Q240-I244 VanDerWaalsContact O-N 3.16Å; R241-I244 PolarHBondContact O-N 3.28Å; R241-I244 VanDerWaalsContact O-N 3.1Å; L242-I244 VanDerWaalsContact C-N 3.31Å; L242-I244 PolarHBondContact O-N 3.49Å; I244-K246 PolarHBondContact O-N 2.98Å; I244-Q247 WeakPolarHBondContact O-CA 3.31Å; I244-Q247 PolarHBondContact O-N 3.44Å; I244-A249 HydrophobicContact CD1-CB 3.89Å; I244-L275 HydrophobicContact CD1-CD1 4.36Å; I244-I281 HydrophobicContact CB-CG2 4.39Å; I244-I281 HydrophobicContact CD1-CD1 4.28Å; I244-I281 HydrophobicContact CG1-CB 3.91Å; I244-I281 HydrophobicContact CG1-CD1 3.68Å; I244-I281 HydrophobicContact CG1-CG1 4.32Å; I244-I281 HydrophobicContact CG1-CG2 4.09Å; I244-E284 HydrophobicContact CG2-CB 3.76Å; I244-E284 HydrophobicContact CG2-CG 3.99Å; I244-V285 HydrophobicContact CD1-CG2 3.61Å
245	E	93.8	Very high	93.7	Very high	132 Å²	132	36.9 Å²	36.9	62%	0.617	17%	0.167	S	C	*	.	H	α-helix	trans	-57.1	-35.2	171.8	-72.2	170.9	-164	0	0	111.6	R241 L242 Q247	R241-E245 WeakPolarHBondContact O-CG 3.38Å; R241-E245 PolarHBondContact O-N 3.4Å; L242-E245 PolarHBondContact O-N 3.29Å; E245-Q247 VanDerWaalsContact C-N 3.3Å
246	K	93.4	Very high	93.7	Very high	85 Å²	85	37 Å²	37	37%	0.37	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	7.5	174.9	-66	-77.4	-170.7	163.6	0	114.1	L206 D207 L210 L242 M243 I244 A248	L206-K246 HydrophobicContact CD2-CB 4.04Å; L206-K246 HydrophobicContact CD2-CG 4.12Å; D207-K246 WeakPolarHBondContact OD1-CD 3.11Å; D207-K246 IonicContact OD1-NZ 3.46Å; D207-K246 PolarHBondContact OD1-NZ 3.4Å; D207-K246 IonicContact OD2-NZ 2.81Å; D207-K246 PolarHBondContact OD2-NZ 2.91Å; L210-K246 HydrophobicContact CD1-CB 4.07Å; L210-K246 WeakPolarHBondContact CD1-O 3.32Å; L242-K246 WeakPolarHBondContact O-CB 3.33Å; L242-K246 VanDerWaalsContact O-CG 3.25Å; L242-K246 WeakPolarHBondContact O-CG 3.23Å; L242-K246 PolarHBondContact O-N 2.95Å; M243-K246 CarbonylContact O-C 3.47Å; M243-K246 PolarHBondContact O-N 2.86Å; I244-K246 PolarHBondContact O-N 2.98Å; K246-A248 VanDerWaalsContact C-N 3.27Å; K246-A248 PolarHBondContact O-N 3.3Å
247	Q	92.9	Very high	93.5	Very high	69 Å²	69	37.1 Å²	37.1	32%	0.322	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	30.9	179	-58.9	171.4	-35.3	0	0	114.6	M243 I244 E245 A249 E250 W251 V580	M243-Q247 PolarHBondContact O-N 3.21Å; I244-Q247 WeakPolarHBondContact O-CA 3.31Å; I244-Q247 PolarHBondContact O-N 3.44Å; E245-Q247 VanDerWaalsContact C-N 3.3Å; Q247-A249 PolarHBondContact O-N 3.32Å; Q247-E250 HydrophobicContact CB-CG 4.34Å; Q247-E250 PolarHBondContact O-N 2.84Å; Q247-E250 VanDerWaalsContact O-N 3.1Å; Q247-W251 PolarHBondContact O-N 3.36Å; Q247-V580 HydrophobicContact CB-CG2 4.4Å; Q247-V580 PolarHBondContact NE2-O 2.85Å; Q247-V580 VanDerWaalsContact OE1-CG2 3.31Å
248	A	94.6	Very high	92.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.2	-32.3	179.4	0	0	0	0	0	113.1	L210 M243 K246 E250 W251 L252	L210-A248 HydrophobicContact CD1-CB 4.44Å; L210-A248 HydrophobicContact CD2-CB 3.95Å; M243-A248 HydrophobicContact CB-CB 3.99Å; M243-A248 HydrophobicContact CE-CB 4.3Å; M243-A248 WeakPolarHBondContact O-CB 3.42Å; M243-A248 PolarHBondContact O-N 3.22Å; K246-A248 VanDerWaalsContact C-N 3.27Å; K246-A248 PolarHBondContact O-N 3.3Å; A248-E250 VanDerWaalsContact C-N 3.26Å; A248-E250 PolarHBondContact O-N 3.03Å; A248-W251 PolarHBondContact O-N 2.96Å; A248-L252 WeakPolarHBondContact O-CG 3.07Å; A248-L252 PolarHBondContact O-N 3.42Å
249	A	91.8	Very high	92.1	Very high	4 Å²	4	30.3 Å²	30.3	3%	0.033	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-31	177.8	0	0	0	0	0	113.7	I244 Q247 V285 S288 T290	I244-A249 HydrophobicContact CD1-CB 3.89Å; Q247-A249 PolarHBondContact O-N 3.32Å; A249-V285 HydrophobicContact CB-CG2 4.46Å; A249-S288 PolarHBondContact O-OG 2.81Å; A249-T290 PolarHBondContact O-OG1 2.98Å; A249-T290 VanDerWaalsContact O-OG1 3.09Å
250	E	90.1	Very high	91.2	Very high	12 Å²	12	36.6 Å²	36.6	6%	0.056	17%	0.169	C	C	.	.	H	α-helix	trans	-73.8	-46.3	175.2	-56	-62.8	163.1	0	0	109.9	Q247 A248 L252 F253 P254 S288 V576 Q579 V580	Q247-E250 HydrophobicContact CB-CG 4.34Å; Q247-E250 PolarHBondContact O-N 2.84Å; Q247-E250 VanDerWaalsContact O-N 3.1Å; A248-E250 VanDerWaalsContact C-N 3.26Å; A248-E250 PolarHBondContact O-N 3.03Å; E250-L252 PolarHBondContact O-N 3.42Å; E250-F253 WeakPolarHBondContact O-CB 3.5Å; E250-F253 PolarHBondContact O-N 3.22Å; E250-P254 WeakPolarHBondContact O-CD 3.15Å; E250-S288 VanDerWaalsContact CD-CB 3.43Å; E250-S288 WeakPolarHBondContact OE1-CA 3.35Å; E250-S288 WeakPolarHBondContact OE1-CB 3.32Å; E250-S288 WeakPolarHBondContact OE2-CA 3.22Å; E250-S288 WeakPolarHBondContact OE2-CB 3.34Å; E250-V576 HydrophobicContact CB-CG1 4.02Å; E250-V576 WeakPolarHBondContact O-CG2 3.29Å; E250-Q579 PolarHBondContact OE2-NE2 3.1Å; E250-Q579 PolarHBondContact OE2-OE1 3.28Å; E250-V580 HydrophobicContact CB-CG2 4.33Å
251	W	92.8	Very high	90.7	Very high	11 Å²	11	36.7 Å²	36.7	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-68	-15.2	178.6	-69.8	106.5	0	0	0	114.7	L210 C213 R214 Q247 A248 F253 P254 V576 H577	L210-W251 HydrophobicContact CB-CG 4.4Å; L210-W251 HydrophobicContact CD2-CB 3.72Å; L210-W251 HydrophobicContact CD2-CG 4.04Å; C213-W251 HydrophobicContact CB-CE3 4.42Å; R214-W251 HydrophobicContact CG-CE3 4.23Å; R214-W251 HydrophobicContact CG-CH2 3.61Å; R214-W251 HydrophobicContact CG-CZ3 3.34Å; Q247-W251 PolarHBondContact O-N 3.36Å; A248-W251 PolarHBondContact O-N 2.96Å; W251-F253 VanDerWaalsContact C-N 3.29Å; W251-P254 VanDerWaalsContact O-CD 3.32Å; W251-P254 WeakPolarHBondContact O-CD 3.39Å; W251-V576 HydrophobicContact CD2-CG1 3.68Å; W251-V576 HydrophobicContact CE3-CG1 3.72Å; W251-V576 HydrophobicContact CG-CG1 4.21Å; W251-V576 HydrophobicContact CH2-CG1 4.07Å; W251-V576 HydrophobicContact CZ2-CG1 4.07Å; W251-V576 HydrophobicContact CZ3-CG1 3.9Å; W251-H577 AromaticContact CH2-CE1 3.85Å; W251-H577 AromaticContact CH2-NE2 3.61Å
252	L	94.8	Very high	90.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-75.1	-19	169	-74.1	163.7	0	0	0	112.4	L228 A248 E250 L255 A256 A268 A271 V272 L275 T290	L228-L252 HydrophobicContact CB-CD2 4.11Å; L228-L252 HydrophobicContact CD1-CD2 3.67Å; L228-L252 HydrophobicContact CD1-CG 4.2Å; A248-L252 WeakPolarHBondContact O-CG 3.07Å; A248-L252 PolarHBondContact O-N 3.42Å; E250-L252 PolarHBondContact O-N 3.42Å; L252-L255 HydrophobicContact CD2-CD1 4.32Å; L252-L255 PolarHBondContact O-N 3.28Å; L252-A256 WeakPolarHBondContact O-CB 3.39Å; L252-A256 PolarHBondContact O-N 3.23Å; L252-A268 HydrophobicContact CD2-CB 4.12Å; L252-A271 HydrophobicContact CD1-CB 3.78Å; L252-A271 HydrophobicContact CD2-CB 3.77Å; L252-A271 HydrophobicContact CG-CB 4.48Å; L252-V272 HydrophobicContact CB-CG2 3.49Å; L252-V272 VanDerWaalsContact CB-CG2 3.49Å; L252-V272 HydrophobicContact CD1-CG2 3.48Å; L252-V272 VanDerWaalsContact CD1-CG2 3.48Å; L252-V272 HydrophobicContact CG-CG2 4.02Å; L252-L275 HydrophobicContact CD1-CD1 4.07Å; L252-T290 HydrophobicContact CB-CG2 4.48Å
253	F	91.9	Very high	90.1	Very high	1 Å²	1	36 Å²	36	0%	0.004	17%	0.171	C	C	.	.	H	α-helix	trans	-62	-50.2	-179.5	-173.9	-91.2	0	0	0	113.2	E250 W251 L255 A256 F257 T290 L293 K575 V576 I587	E250-F253 WeakPolarHBondContact O-CB 3.5Å; E250-F253 PolarHBondContact O-N 3.22Å; W251-F253 VanDerWaalsContact C-N 3.29Å; F253-L255 VanDerWaalsContact C-N 3.25Å; F253-L255 PolarHBondContact O-N 2.99Å; F253-A256 PolarHBondContact O-N 3.02Å; F253-F257 HydrophobicContact CD1-CB 4.37Å; F253-F257 HydrophobicContact CE1-CB 4.12Å; F253-F257 HydrophobicContact CE1-CD2 4.38Å; F253-F257 HydrophobicContact CE1-CG 4.09Å; F253-F257 HydrophobicContact CZ-CB 4.44Å; F253-F257 HydrophobicContact CZ-CD2 4.12Å; F253-F257 HydrophobicContact CZ-CG 4.28Å; F253-F257 WeakPolarHBondContact O-CB 3.42Å; F253-F257 PolarHBondContact O-N 3.37Å; F253-T290 HydrophobicContact CB-CG2 4.37Å; F253-T290 HydrophobicContact CD2-CG2 4.36Å; F253-L293 HydrophobicContact CD2-CD1 3.92Å; F253-L293 HydrophobicContact CE2-CD1 3.74Å; F253-L293 HydrophobicContact CE2-CD2 4.35Å; F253-L293 HydrophobicContact CE2-CG 4.23Å; F253-L293 HydrophobicContact CZ-CD1 4.36Å; F253-K575 HydrophobicContact CD1-CD 3.62Å; F253-K575 HydrophobicContact CD2-CD 4.35Å; F253-K575 HydrophobicContact CE1-CD 3.44Å; F253-K575 VanDerWaalsContact CE1-CD 3.44Å; F253-K575 HydrophobicContact CE2-CD 4.19Å; F253-K575 HydrophobicContact CG-CD 4.09Å; F253-K575 HydrophobicContact CZ-CD 3.74Å; F253-V576 HydrophobicContact CB-CG2 4.13Å; F253-I587 HydrophobicContact CE1-CG2 4.22Å; F253-I587 HydrophobicContact CZ-CG2 3.74Å
254	P	90.5	Very high	89.9	Confident	12 Å²	12	36.2 Å²	36.2	8%	0.078	17%	0.172	C	C	.	.	H	α-helix	trans	-62	-34.5	179.1	-22.4	36.3	0	0	0	112.4	E250 W251 S258 L573 V576	E250-P254 WeakPolarHBondContact O-CD 3.15Å; W251-P254 VanDerWaalsContact O-CD 3.32Å; W251-P254 WeakPolarHBondContact O-CD 3.39Å; P254-S258 PolarHBondContact O-N 2.91Å; P254-L573 HydrophobicContact CG-CD2 4.45Å; P254-V576 HydrophobicContact CG-CB 4.49Å; P254-V576 HydrophobicContact CG-CG2 3.61Å
255	L	93.1	Very high	89.9	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.016	18%	0.175	C	C	.	.	H	α-helix	trans	-68.9	-47.3	177	-57.1	-179.4	0	0	0	111.6	L221 A225 L228 L252 F253 F257 S258 I264 A268	L221-L255 HydrophobicContact CB-CD2 4.15Å; L221-L255 HydrophobicContact CD2-CD2 3.78Å; L221-L255 HydrophobicContact CG-CD2 4.39Å; A225-L255 HydrophobicContact CB-CD1 4.14Å; L228-L255 HydrophobicContact CD1-CD1 4.3Å; L252-L255 HydrophobicContact CD2-CD1 4.32Å; L252-L255 PolarHBondContact O-N 3.28Å; F253-L255 VanDerWaalsContact C-N 3.25Å; F253-L255 PolarHBondContact O-N 2.99Å; L255-F257 VanDerWaalsContact C-N 3.28Å; L255-F257 PolarHBondContact O-N 3.02Å; L255-S258 PolarHBondContact O-N 3.45Å; L255-I264 HydrophobicContact CB-CG2 3.95Å; L255-I264 HydrophobicContact CD2-CG2 4.02Å; L255-A268 HydrophobicContact CB-CB 3.55Å
256	A	92.1	Very high	89.9	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-67.9	-29.1	177.5	0	0	0	0	0	112.8	L252 F253 R265 A268 T290 L293	L252-A256 WeakPolarHBondContact O-CB 3.39Å; L252-A256 PolarHBondContact O-N 3.23Å; F253-A256 PolarHBondContact O-N 3.02Å; A256-R265 PolarHBondContact O-NE 3.47Å; A256-A268 HydrophobicContact CB-CB 3.98Å; A256-T290 HydrophobicContact CB-CG2 3.71Å; A256-L293 HydrophobicContact CB-CD1 3.79Å
257	F	88.6	Confident	90	Very high	16 Å²	16	28 Å²	28	7%	0.07	13%	0.132	C	C	.	.	H	α-helix	trans	-88.5	-14.6	-178.7	-166.8	-105.1	0	0	0	114.1	F253 L255 L293 Y562 I587	F253-F257 HydrophobicContact CD1-CB 4.37Å; F253-F257 HydrophobicContact CE1-CB 4.12Å; F253-F257 HydrophobicContact CE1-CD2 4.38Å; F253-F257 HydrophobicContact CE1-CG 4.09Å; F253-F257 HydrophobicContact CZ-CB 4.44Å; F253-F257 HydrophobicContact CZ-CD2 4.12Å; F253-F257 HydrophobicContact CZ-CG 4.28Å; F253-F257 WeakPolarHBondContact O-CB 3.42Å; F253-F257 PolarHBondContact O-N 3.37Å; L255-F257 VanDerWaalsContact C-N 3.28Å; L255-F257 PolarHBondContact O-N 3.02Å; F257-L293 HydrophobicContact CB-CD1 3.99Å; F257-L293 HydrophobicContact CD2-CD1 4.15Å; F257-L293 HydrophobicContact CD2-CD2 4.17Å; F257-Y562 HydrophobicContact CE1-CE2 4.3Å; F257-Y562 HydrophobicContact CZ-CE2 4.21Å; F257-Y562 AromaticContact CZ-CZ 3.9Å; F257-Y562 VanDerWaalsContact CZ-OH 3.32Å; F257-Y562 WeakPolarHBondContact CZ-OH 3.34Å; F257-I587 HydrophobicContact CE1-CD1 4.44Å
258	S	82.6	Confident	90.1	Very high	22 Å²	22	24.7 Å²	24.7	15%	0.154	12%	0.117	C	C	.	.			trans	-55.6	146.7	175.7	-179.7	0	0	0	0	110.9	P254 L255 E260 R265	P254-S258 PolarHBondContact O-N 2.91Å; L255-S258 PolarHBondContact O-N 3.45Å; S258-E260 PolarHBondContact OG-N 3.4Å; S258-R265 WeakPolarHBondContact O-CD 3.2Å; S258-R265 WeakPolarHBondContact O-CG 3.43Å; S258-R265 PolarHBondContact O-NE 2.95Å; S258-R265 VanDerWaalsContact O-NE 3.1Å
259	K	77.1	Confident	90.2	Very high	89 Å²	89	24.7 Å²	24.7	39%	0.387	12%	0.117	S	C	.	.	S	Bend	trans	-107.5	-5.2	176.4	-68.3	-171	173.1	-174.8	0	113.5	E590	K259-E590 WeakPolarHBondContact CE-OE2 3.48Å; K259-E590 VanDerWaalsContact NZ-CD 3.27Å; K259-E590 IonicContact NZ-OE1 3.68Å; K259-E590 PolarHBondContact NZ-OE1 3.12Å; K259-E590 IonicContact NZ-OE2 3.56Å; K259-E590 PolarHBondContact NZ-OE2 3.45Å
260	E	75.5	Confident	90.4	Very high	132 Å²	132	24.5 Å²	24.5	62%	0.617	12%	0.116	S	C	*	.	S	Bend	trans	-82.8	-32.3	-168.7	-63.6	176	-178.8	0	0	112.3	S258	S258-E260 PolarHBondContact OG-N 3.4Å
261	D	86.3	Confident	90.8	Very high	20 Å²	20	24 Å²	24	11%	0.107	11%	0.113	C	C	.	.			trans	-143.2	116.9	-173.7	-171.5	-21.2	0	0	0	111.6	R222 L263 I264 R265	R222-D261 IonicContact CZ-OD2 2.75Å; R222-D261 VanDerWaalsContact CZ-OD2 3.27Å; R222-D261 IonicContact NE-OD2 2.83Å; R222-D261 PolarHBondContact NE-OD2 3.24Å; R222-D261 VanDerWaalsContact NE-OD2 3.08Å; R222-D261 IonicContact NH2-OD2 4Å; R222-D261 PolarHBondContact NH2-OD2 3.47Å; D261-L263 VanDerWaalsContact C-N 3.3Å; D261-L263 PolarHBondContact O-N 3.41Å; D261-L263 WeakPolarHBondContact OD1-CA 3.36Å; D261-L263 VanDerWaalsContact OD1-CB 3.27Å; D261-L263 WeakPolarHBondContact OD1-CB 3.31Å; D261-L263 PolarHBondContact OD1-N 2.87Å; D261-I264 HydrophobicContact CB-CB 4.17Å; D261-I264 HydrophobicContact CB-CD1 3.68Å; D261-I264 HydrophobicContact CB-CG1 3.77Å; D261-I264 PolarHBondContact O-N 3.47Å; D261-R265 WeakPolarHBondContact O-CG 3.36Å; D261-R265 PolarHBondContact O-N 3.43Å
262	E	90	Very high	91	Very high	94 Å²	94	23.4 Å²	23.4	44%	0.439	11%	0.111	S	C	.	.	H	α-helix	trans	-65.6	-30.3	178.1	-62.8	-178.1	169.8	0	0	112.9	R265 F266 F297 L301 F306	E262-R265 PolarHBondContact O-N 3.29Å; E262-F266 VanDerWaalsContact O-CB 3.26Å; E262-F266 WeakPolarHBondContact O-CB 3.24Å; E262-F266 PolarHBondContact O-N 3.44Å; E262-F297 HydrophobicContact CB-CZ 4.48Å; E262-L301 HydrophobicContact CB-CD2 4.47Å; E262-L301 HydrophobicContact CG-CD2 4.26Å; E262-F306 HydrophobicContact CB-CE2 4.37Å
263	L	89.4	Confident	91	Very high	28 Å²	28	23.6 Å²	23.6	15%	0.147	11%	0.112	C	C	.	.	H	α-helix	trans	-68.3	-43.2	177.9	-63.4	174	0	0	0	111	D261 R265 F266 H267 F306 L310	D261-L263 VanDerWaalsContact C-N 3.3Å; D261-L263 PolarHBondContact O-N 3.41Å; D261-L263 WeakPolarHBondContact OD1-CA 3.36Å; D261-L263 VanDerWaalsContact OD1-CB 3.27Å; D261-L263 WeakPolarHBondContact OD1-CB 3.31Å; D261-L263 PolarHBondContact OD1-N 2.87Å; L263-R265 VanDerWaalsContact C-N 3.32Å; L263-R265 PolarHBondContact O-N 3.32Å; L263-F266 PolarHBondContact O-N 3.49Å; L263-H267 PolarHBondContact O-CD2 3.33Å; L263-H267 PolarHBondContact O-N 2.92Å; L263-F306 HydrophobicContact CD2-CE1 4.35Å; L263-F306 HydrophobicContact CD2-CE2 3.82Å; L263-F306 HydrophobicContact CD2-CZ 3.61Å; L263-L310 HydrophobicContact CD2-CD2 4.25Å; L263-L310 HydrophobicContact CD2-CG 4.33Å
264	I	92.3	Very high	91.3	Very high	3 Å²	3	24.1 Å²	24.1	2%	0.015	12%	0.115	C	C	.	.	H	α-helix	trans	-58	-49.4	176.1	-63.5	178.6	0	0	0	109.5	L221 R222 A225 L255 D261 F266 H267 A268	L221-I264 HydrophobicContact CB-CD1 3.82Å; R222-I264 HydrophobicContact CB-CD1 4.45Å; R222-I264 HydrophobicContact CB-CG1 3.97Å; R222-I264 HydrophobicContact CG-CG1 4.37Å; A225-I264 HydrophobicContact CB-CG2 4.28Å; L255-I264 HydrophobicContact CB-CG2 3.95Å; L255-I264 HydrophobicContact CD2-CG2 4.02Å; D261-I264 HydrophobicContact CB-CB 4.17Å; D261-I264 HydrophobicContact CB-CD1 3.68Å; D261-I264 HydrophobicContact CB-CG1 3.77Å; D261-I264 PolarHBondContact O-N 3.47Å; I264-F266 VanDerWaalsContact C-N 3.33Å; I264-F266 PolarHBondContact O-N 2.92Å; I264-H267 PolarHBondContact O-N 3.35Å; I264-A268 WeakPolarHBondContact O-CB 3.24Å; I264-A268 PolarHBondContact O-N 2.76Å
265	R	93.8	Very high	91.5	Very high	51 Å²	51	23.5 Å²	23.5	19%	0.192	11%	0.111	C	C	.	.	H	α-helix	trans	-61.4	-43.6	179.7	-61.9	172.3	80.9	178.3	-4.5	111.7	A256 S258 D261 E262 L263 A268 C269 F297	A256-R265 PolarHBondContact O-NE 3.47Å; S258-R265 WeakPolarHBondContact O-CD 3.2Å; S258-R265 WeakPolarHBondContact O-CG 3.43Å; S258-R265 PolarHBondContact O-NE 2.95Å; S258-R265 VanDerWaalsContact O-NE 3.1Å; D261-R265 WeakPolarHBondContact O-CG 3.36Å; D261-R265 PolarHBondContact O-N 3.43Å; E262-R265 PolarHBondContact O-N 3.29Å; L263-R265 VanDerWaalsContact C-N 3.32Å; L263-R265 PolarHBondContact O-N 3.32Å; R265-A268 PolarHBondContact O-N 3.1Å; R265-C269 WeakPolarHBondContact O-CB 3.48Å; R265-C269 PolarHBondContact O-N 2.98Å; R265-C269 PolarHBondContact O-SG 3.2Å; R265-F297 HydrophobicContact CB-CE1 3.9Å; R265-F297 HydrophobicContact CB-CE2 3.95Å; R265-F297 HydrophobicContact CB-CZ 3.56Å
266	F	94.7	Very high	91.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.9	-50.1	179.8	179	-99.4	0	0	0	111.8	E262 L263 I264 A268 C269 L270 F297 I298 F306 I342 F345 Y346	E262-F266 VanDerWaalsContact O-CB 3.26Å; E262-F266 WeakPolarHBondContact O-CB 3.24Å; E262-F266 PolarHBondContact O-N 3.44Å; L263-F266 PolarHBondContact O-N 3.49Å; I264-F266 VanDerWaalsContact C-N 3.33Å; I264-F266 PolarHBondContact O-N 2.92Å; F266-A268 VanDerWaalsContact C-N 3.35Å; F266-A268 PolarHBondContact O-N 3.44Å; F266-C269 PolarHBondContact O-N 3.43Å; F266-L270 WeakPolarHBondContact O-CB 3.42Å; F266-L270 PolarHBondContact O-N 3.48Å; F266-F297 HydrophobicContact CB-CE1 4.07Å; F266-F297 HydrophobicContact CB-CZ 4.38Å; F266-I298 HydrophobicContact CD2-CD1 4.09Å; F266-I298 HydrophobicContact CE2-CD1 4.19Å; F266-F306 HydrophobicContact CB-CE2 4.09Å; F266-F306 HydrophobicContact CB-CZ 3.65Å; F266-F306 HydrophobicContact CD1-CE1 4.03Å; F266-F306 AromaticContact CD1-CZ 3.71Å; F266-F306 HydrophobicContact CD1-CZ 3.71Å; F266-F306 HydrophobicContact CD2-CE1 4.3Å; F266-F306 AromaticContact CD2-CZ 3.98Å; F266-F306 HydrophobicContact CD2-CZ 3.98Å; F266-F306 HydrophobicContact CE1-CE1 4.25Å; F266-F306 HydrophobicContact CE1-CZ 4.38Å; F266-F306 HydrophobicContact CG-CE1 4.06Å; F266-F306 HydrophobicContact CG-CE2 4.3Å; F266-F306 AromaticContact CG-CZ 3.48Å; F266-F306 HydrophobicContact CG-CZ 3.48Å; F266-F306 VanDerWaalsContact CG-CZ 3.48Å; F266-F306 HydrophobicContact CZ-CE1 4.49Å; F266-I342 HydrophobicContact CD2-CD1 4.38Å; F266-I342 HydrophobicContact CD2-CG1 4.42Å; F266-I342 HydrophobicContact CE2-CD1 4.16Å; F266-I342 HydrophobicContact CE2-CG1 3.77Å; F266-I342 HydrophobicContact CZ-CG1 4.29Å; F266-F345 HydrophobicContact CD2-CD1 4.19Å; F266-F345 HydrophobicContact CD2-CE1 4.1Å; F266-F345 AromaticContact CE2-CD1 3.52Å; F266-F345 HydrophobicContact CE2-CD1 3.52Å; F266-F345 AromaticContact CE2-CE1 3.81Å; F266-F345 HydrophobicContact CE2-CE1 3.81Å; F266-F345 HydrophobicContact CZ-CD1 4.27Å; F266-Y346 HydrophobicContact CE1-CD1 4.09Å; F266-Y346 HydrophobicContact CE1-CD2 4.44Å; F266-Y346 HydrophobicContact CE1-CE1 4.13Å; F266-Y346 HydrophobicContact CE1-CE2 4.49Å; F266-Y346 HydrophobicContact CE1-CG 4.25Å; F266-Y346 AromaticContact CZ-CD1 3.82Å; F266-Y346 HydrophobicContact CZ-CD1 3.82Å; F266-Y346 HydrophobicContact CZ-CD2 4.12Å; F266-Y346 HydrophobicContact CZ-CE1 4.33Å; F266-Y346 AromaticContact CZ-CG 3.71Å; F266-Y346 HydrophobicContact CZ-CG 3.71Å
267	H	94.8	Very high	91.6	Very high	19 Å²	19	26.1 Å²	26.1	9%	0.088	13%	0.133	C	C	.	.	H	α-helix	trans	-67.8	-35.2	179.3	-71.7	-63.9	0	0	0	112.6	A225 V226 L263 I264 L270 A271	A225-H267 HydrophobicContact CB-CB 3.84Å; V226-H267 HydrophobicContact CG2-CB 4.17Å; V226-H267 VanDerWaalsContact CG2-CD2 3.47Å; V226-H267 WeakPolarHBondContact CG2-CD2 3.2Å; L263-H267 PolarHBondContact O-CD2 3.33Å; L263-H267 PolarHBondContact O-N 2.92Å; I264-H267 PolarHBondContact O-N 3.35Å; H267-L270 PolarHBondContact O-N 3.2Å; H267-A271 PolarHBondContact O-N 2.91Å
268	A	96.3	Very high	91.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.3	-45.3	172.3	0	0	0	0	0	112	L252 L255 A256 I264 R265 F266 L270 A271 V272	L252-A268 HydrophobicContact CD2-CB 4.12Å; L255-A268 HydrophobicContact CB-CB 3.55Å; A256-A268 HydrophobicContact CB-CB 3.98Å; I264-A268 WeakPolarHBondContact O-CB 3.24Å; I264-A268 PolarHBondContact O-N 2.76Å; R265-A268 PolarHBondContact O-N 3.1Å; F266-A268 VanDerWaalsContact C-N 3.35Å; F266-A268 PolarHBondContact O-N 3.44Å; A268-L270 VanDerWaalsContact C-N 3.3Å; A268-L270 PolarHBondContact O-N 2.65Å; A268-A271 PolarHBondContact O-N 2.69Å; A268-V272 WeakPolarHBondContact O-CG2 2.9Å; A268-V272 PolarHBondContact O-N 2.76Å
269	C	96.6	Very high	92	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.2	-38.4	174.7	-68.8	0	0	0	0	111.8	R265 F266 V272 T273 V294 I342	R265-C269 WeakPolarHBondContact O-CB 3.48Å; R265-C269 PolarHBondContact O-N 2.98Å; R265-C269 PolarHBondContact O-SG 3.2Å; F266-C269 PolarHBondContact O-N 3.43Å; C269-V272 PolarHBondContact O-N 3.1Å; C269-T273 WeakPolarHBondContact O-CB 3.46Å; C269-T273 WeakPolarHBondContact O-CG2 3.37Å; C269-T273 PolarHBondContact O-N 3.36Å; C269-T273 PolarHBondContact O-OG1 2.83Å; C269-V294 HydrophobicContact CB-CG1 4.32Å; C269-V294 HydrophobicContact CB-CG2 3.97Å; C269-I342 VanDerWaalsContact C-CD1 3.47Å; C269-I342 HydrophobicContact CB-CD1 3.54Å
270	L	96.3	Very high	92.6	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-63.8	-45.9	176.5	-177.1	62	0	0	0	110.8	A229 M233 F266 H267 A268 V272 T273 V274 L328 L331 I342 Y346	A229-L270 HydrophobicContact CB-CD2 4.43Å; M233-L270 HydrophobicContact CE-CD2 3.96Å; M233-L270 HydrophobicContact SD-CD2 3.94Å; M233-L270 HydrophobicContact SD-CG 4.28Å; F266-L270 WeakPolarHBondContact O-CB 3.42Å; F266-L270 PolarHBondContact O-N 3.48Å; H267-L270 PolarHBondContact O-N 3.2Å; A268-L270 VanDerWaalsContact C-N 3.3Å; A268-L270 PolarHBondContact O-N 2.65Å; L270-V272 PolarHBondContact O-N 3.16Å; L270-T273 WeakPolarHBondContact CA-OG1 3.39Å; L270-T273 PolarHBondContact O-N 3.37Å; L270-T273 PolarHBondContact O-OG1 3.01Å; L270-V274 HydrophobicContact CD1-CG2 4.24Å; L270-V274 WeakPolarHBondContact O-CB 3.5Å; L270-V274 WeakPolarHBondContact O-CG2 3.38Å; L270-V274 PolarHBondContact O-N 3.09Å; L270-L328 HydrophobicContact CD1-CD2 4.13Å; L270-L331 HydrophobicContact CD1-CD1 4.13Å; L270-I342 HydrophobicContact CB-CD1 3.93Å; L270-I342 HydrophobicContact CD1-CD1 4.5Å; L270-I342 HydrophobicContact CD1-CG1 4.45Å; L270-Y346 HydrophobicContact CD2-CD1 4.29Å; L270-Y346 HydrophobicContact CD2-CE1 4.02Å
271	A	97.1	Very high	93.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.7	-48.2	176.7	0	0	0	0	0	111.9	L228 A229 L252 H267 A268 V274 L275	L228-A271 HydrophobicContact CB-CB 4.4Å; A229-A271 HydrophobicContact CB-CB 4.06Å; L252-A271 HydrophobicContact CD1-CB 3.78Å; L252-A271 HydrophobicContact CD2-CB 3.77Å; L252-A271 HydrophobicContact CG-CB 4.48Å; H267-A271 PolarHBondContact O-N 2.91Å; A268-A271 PolarHBondContact O-N 2.69Å; A271-V274 PolarHBondContact O-N 3.33Å; A271-L275 VanDerWaalsContact O-CG 3.31Å; A271-L275 WeakPolarHBondContact O-CG 3.33Å; A271-L275 PolarHBondContact O-N 3.31Å
272	V	96.6	Very high	93.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65.3	-42	-178.7	177.3	0	0	0	0	111.9	L252 A268 C269 L270 L275 A276 V285 T290 L291	L252-V272 HydrophobicContact CB-CG2 3.49Å; L252-V272 VanDerWaalsContact CB-CG2 3.49Å; L252-V272 HydrophobicContact CD1-CG2 3.48Å; L252-V272 VanDerWaalsContact CD1-CG2 3.48Å; L252-V272 HydrophobicContact CG-CG2 4.02Å; A268-V272 WeakPolarHBondContact O-CG2 2.9Å; A268-V272 PolarHBondContact O-N 2.76Å; C269-V272 PolarHBondContact O-N 3.1Å; L270-V272 PolarHBondContact O-N 3.16Å; V272-L275 PolarHBondContact O-N 2.87Å; V272-A276 WeakPolarHBondContact O-CB 3.24Å; V272-A276 PolarHBondContact O-N 3.29Å; V272-V285 HydrophobicContact CG1-CG1 3.58Å; V272-T290 HydrophobicContact CB-CG2 4.47Å; V272-T290 HydrophobicContact CG1-CG2 4.35Å; V272-T290 HydrophobicContact CG2-CG2 3.67Å; V272-L291 HydrophobicContact CG1-CD2 3.64Å; V272-L291 HydrophobicContact CG1-CG 3.76Å
273	T	96.6	Very high	93.6	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.018	15%	0.148	C	C	.	.	H	α-helix	trans	-67.6	-36	178.9	48.2	0	0	0	0	112.7	C269 L270 A276 A277 L291 V294 E338 I342	C269-T273 WeakPolarHBondContact O-CB 3.46Å; C269-T273 WeakPolarHBondContact O-CG2 3.37Å; C269-T273 PolarHBondContact O-N 3.36Å; C269-T273 PolarHBondContact O-OG1 2.83Å; L270-T273 WeakPolarHBondContact CA-OG1 3.39Å; L270-T273 PolarHBondContact O-N 3.37Å; L270-T273 PolarHBondContact O-OG1 3.01Å; T273-A276 PolarHBondContact O-N 3.49Å; T273-A277 PolarHBondContact O-N 3.44Å; T273-L291 HydrophobicContact CG2-CD2 4.17Å; T273-V294 HydrophobicContact CG2-CB 4.43Å; T273-V294 HydrophobicContact CG2-CG1 3.84Å; T273-V294 HydrophobicContact CG2-CG2 3.96Å; T273-E338 HydrophobicContact CG2-CB 3.9Å; T273-I342 HydrophobicContact CG2-CG2 3.94Å; T273-I342 WeakPolarHBondContact OG1-CG2 3.33Å
274	V	96.3	Very high	93.6	Very high	12 Å²	12	33.8 Å²	33.8	7%	0.073	16%	0.159	C	C	.	.	H	α-helix	trans	-64.8	-43.4	172.9	174.9	0	0	0	0	111.2	A232 M233 L270 A271 A276 A277 L331	A232-V274 HydrophobicContact CB-CB 4.09Å; A232-V274 HydrophobicContact CB-CG1 3.81Å; A232-V274 VanDerWaalsContact O-CG1 3.29Å; A232-V274 WeakPolarHBondContact O-CG1 3.29Å; M233-V274 HydrophobicContact CG-CB 4.48Å; M233-V274 HydrophobicContact CG-CG1 4.18Å; M233-V274 HydrophobicContact CG-CG2 3.73Å; L270-V274 HydrophobicContact CD1-CG2 4.24Å; L270-V274 WeakPolarHBondContact O-CB 3.5Å; L270-V274 WeakPolarHBondContact O-CG2 3.38Å; L270-V274 PolarHBondContact O-N 3.09Å; A271-V274 PolarHBondContact O-N 3.33Å; V274-A276 VanDerWaalsContact C-N 3.34Å; V274-A276 PolarHBondContact O-N 2.82Å; V274-A277 WeakPolarHBondContact O-CB 3.5Å; V274-A277 PolarHBondContact O-N 2.97Å; V274-L331 HydrophobicContact CG2-CD1 3.86Å; V274-L331 HydrophobicContact CG2-CD2 4.23Å; V274-L331 HydrophobicContact CG2-CG 4.5Å
275	L	96.1	Very high	93.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.9	-42.6	173.6	-67.8	170.2	0	0	0	111.5	A232 Q240 M243 I244 L252 A271 V272 A277 N278 I281 V285	A232-L275 HydrophobicContact CB-CD2 4.2Å; A232-L275 HydrophobicContact CB-CG 4.15Å; Q240-L275 HydrophobicContact CB-CD2 3.9Å; Q240-L275 HydrophobicContact CG-CD2 3.92Å; M243-L275 HydrophobicContact CB-CD2 4.41Å; M243-L275 HydrophobicContact CE-CD1 4.29Å; M243-L275 HydrophobicContact CE-CD2 4.49Å; M243-L275 HydrophobicContact SD-CD2 4.06Å; I244-L275 HydrophobicContact CD1-CD1 4.36Å; L252-L275 HydrophobicContact CD1-CD1 4.07Å; A271-L275 VanDerWaalsContact O-CG 3.31Å; A271-L275 WeakPolarHBondContact O-CG 3.33Å; A271-L275 PolarHBondContact O-N 3.31Å; V272-L275 PolarHBondContact O-N 2.87Å; L275-A277 VanDerWaalsContact C-N 3.25Å; L275-A277 PolarHBondContact O-N 3.47Å; L275-N278 PolarHBondContact O-N 2.81Å; L275-N278 VanDerWaalsContact O-N 3.15Å; L275-I281 HydrophobicContact CB-CD1 4.15Å; L275-I281 HydrophobicContact CD2-CD1 3.93Å; L275-I281 WeakPolarHBondContact O-CD1 3.33Å; L275-I281 WeakPolarHBondContact O-CG1 3.41Å; L275-V285 HydrophobicContact CB-CG2 3.78Å
276	A	94.4	Very high	93.4	Very high	4 Å²	4	34.2 Å²	34.2	3%	0.033	17%	0.167	C	C	.	.	H	α-helix	trans	-67.3	-22.3	179.4	0	0	0	0	0	114.1	V272 T273 V274 N278 V285 L291	V272-A276 WeakPolarHBondContact O-CB 3.24Å; V272-A276 PolarHBondContact O-N 3.29Å; T273-A276 PolarHBondContact O-N 3.49Å; V274-A276 VanDerWaalsContact C-N 3.34Å; V274-A276 PolarHBondContact O-N 2.82Å; A276-N278 PolarHBondContact O-N 2.98Å; A276-V285 HydrophobicContact CB-CB 4.43Å; A276-V285 HydrophobicContact CB-CG1 3.95Å; A276-L291 HydrophobicContact CB-CD1 3.76Å; A276-L291 HydrophobicContact CB-CD2 3.79Å; A276-L291 HydrophobicContact CB-CG 4.31Å
277	A	92.4	Very high	93	Very high	55 Å²	55	42.8 Å²	42.8	46%	0.455	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.4	175	0	0	0	0	0	112.5	T273 V274 L275 R279 L331	T273-A277 PolarHBondContact O-N 3.44Å; V274-A277 WeakPolarHBondContact O-CB 3.5Å; V274-A277 PolarHBondContact O-N 2.97Å; L275-A277 VanDerWaalsContact C-N 3.25Å; L275-A277 PolarHBondContact O-N 3.47Å; A277-R279 PolarHBondContact O-N 2.91Å; A277-L331 HydrophobicContact CB-CD2 3.74Å
278	N	92.5	Very high	92.7	Very high	9 Å²	9	41.9 Å²	41.9	5%	0.048	20%	0.195	C	C	.	.	S	Bend	trans	-86.3	108.4	173.8	179.7	-3.2	0	0	0	110.8	H237 Q240 L275 A276 E280 I281 E282	H237-N278 VanDerWaalsContact ND1-CG 3.34Å; H237-N278 PolarHBondContact ND1-ND2 3.3Å; Q240-N278 VanDerWaalsContact OE1-CB 3.32Å; Q240-N278 PolarHBondContact OE1-ND2 3.43Å; L275-N278 PolarHBondContact O-N 2.81Å; L275-N278 VanDerWaalsContact O-N 3.15Å; A276-N278 PolarHBondContact O-N 2.98Å; N278-E280 PolarHBondContact O-N 3.12Å; N278-E280 VanDerWaalsContact O-N 3.12Å; N278-E280 WeakPolarHBondContact OD1-CB 3.32Å; N278-E280 PolarHBondContact OD1-N 3.36Å; N278-E280 VanDerWaalsContact OD1-N 3.09Å; N278-I281 HydrophobicContact CB-CD1 4.03Å; N278-I281 HydrophobicContact CB-CG1 3.8Å; N278-I281 WeakPolarHBondContact O-CG1 3.31Å; N278-I281 PolarHBondContact O-N 3.29Å; N278-I281 VanDerWaalsContact O-N 3.13Å; N278-E282 PolarHBondContact O-N 3.25Å
279	R	87	Confident	92.1	Very high	140 Å²	140	42.6 Å²	42.6	53%	0.528	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-26.5	-177.8	-66.4	-166.9	-169.2	148.7	10.4	115	A277 I281	A277-R279 PolarHBondContact O-N 2.91Å; R279-I281 VanDerWaalsContact C-N 3.26Å; R279-I281 PolarHBondContact O-N 3.18Å
280	E	90.1	Very high	91.8	Very high	133 Å²	133	42.6 Å²	42.6	62%	0.621	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-31.7	-179.5	-64.9	-177	173.3	0	0	112.1	N278	N278-E280 PolarHBondContact O-N 3.12Å; N278-E280 VanDerWaalsContact O-N 3.12Å; N278-E280 WeakPolarHBondContact OD1-CB 3.32Å; N278-E280 PolarHBondContact OD1-N 3.36Å; N278-E280 VanDerWaalsContact OD1-N 3.09Å
281	I	92.8	Very high	91.5	Very high	10 Å²	10	42.9 Å²	42.9	5%	0.051	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-0.8	-174.3	61.5	172.2	0	0	0	113.4	Q240 R241 I244 L275 N278 R279 K283 E284 V285	Q240-I281 HydrophobicContact CB-CD1 3.86Å; R241-I281 HydrophobicContact CG-CG2 4.15Å; I244-I281 HydrophobicContact CB-CG2 4.39Å; I244-I281 HydrophobicContact CD1-CD1 4.28Å; I244-I281 HydrophobicContact CG1-CB 3.91Å; I244-I281 HydrophobicContact CG1-CD1 3.68Å; I244-I281 HydrophobicContact CG1-CG1 4.32Å; I244-I281 HydrophobicContact CG1-CG2 4.09Å; L275-I281 HydrophobicContact CB-CD1 4.15Å; L275-I281 HydrophobicContact CD2-CD1 3.93Å; L275-I281 WeakPolarHBondContact O-CD1 3.33Å; L275-I281 WeakPolarHBondContact O-CG1 3.41Å; N278-I281 HydrophobicContact CB-CD1 4.03Å; N278-I281 HydrophobicContact CB-CG1 3.8Å; N278-I281 WeakPolarHBondContact O-CG1 3.31Å; N278-I281 PolarHBondContact O-N 3.29Å; N278-I281 VanDerWaalsContact O-N 3.13Å; R279-I281 VanDerWaalsContact C-N 3.26Å; R279-I281 PolarHBondContact O-N 3.18Å; I281-K283 PolarHBondContact O-N 3.21Å; I281-E284 WeakPolarHBondContact CA-OE2 3.32Å; I281-E284 PolarHBondContact O-N 3.44Å; I281-V285 WeakPolarHBondContact O-CG2 3.29Å; I281-V285 PolarHBondContact O-N 3.38Å; I281-V285 VanDerWaalsContact O-N 3.12Å
282	E	91.1	Very high	91.1	Very high	32 Å²	32	49 Å²	49	15%	0.15	23%	0.233	C	C	.	.	H	α-helix	trans	-55.3	-38.3	-174.5	178.8	179.4	-171.4	0	0	112.3	N278 V285 V286 R336	N278-E282 PolarHBondContact O-N 3.25Å; E282-V285 PolarHBondContact O-N 3.42Å; E282-V286 VanDerWaalsContact O-CG2 3.26Å; E282-V286 WeakPolarHBondContact O-CG2 3.13Å; E282-V286 PolarHBondContact O-N 3.47Å; E282-R336 IonicContact OE1-CZ 2.71Å; E282-R336 IonicContact OE1-NE 2.61Å; E282-R336 PolarHBondContact OE1-NE 3.18Å; E282-R336 IonicContact OE1-NH2 2.76Å; E282-R336 PolarHBondContact OE1-NH2 3.33Å
283	K	88.7	Confident	90.8	Very high	158 Å²	158	49.6 Å²	49.6	69%	0.687	24%	0.236	S	C	*	.	H	α-helix	trans	-67.7	-40.3	-178.4	-68.3	-178.5	-179.9	177	0	112	I281 V285 V286 R287	I281-K283 PolarHBondContact O-N 3.21Å; K283-V285 VanDerWaalsContact C-N 3.35Å; K283-V286 PolarHBondContact O-N 3.44Å; K283-R287 WeakPolarHBondContact O-CB 3.48Å; K283-R287 PolarHBondContact O-N 3.45Å
284	E	89.6	Confident	90.6	Very high	79 Å²	79	49.4 Å²	49.4	37%	0.369	24%	0.235	S	C	.	.	H	α-helix	trans	-65.4	-40.9	176.7	-69	70.9	-161.9	0	0	110.6	I244 I281 R287 S288	I244-E284 HydrophobicContact CG2-CB 3.76Å; I244-E284 HydrophobicContact CG2-CG 3.99Å; I281-E284 WeakPolarHBondContact CA-OE2 3.32Å; I281-E284 PolarHBondContact O-N 3.44Å; E284-R287 WeakPolarHBondContact O-CB 3.3Å; E284-R287 PolarHBondContact O-N 3.06Å; E284-S288 PolarHBondContact O-N 3.35Å
285	V	92.8	Very high	90.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.5	-40.7	176.3	-177.5	0	0	0	0	111.6	I244 A249 V272 L275 A276 I281 E282 K283 R287 S288 L291	I244-V285 HydrophobicContact CD1-CG2 3.61Å; A249-V285 HydrophobicContact CB-CG2 4.46Å; V272-V285 HydrophobicContact CG1-CG1 3.58Å; L275-V285 HydrophobicContact CB-CG2 3.78Å; A276-V285 HydrophobicContact CB-CB 4.43Å; A276-V285 HydrophobicContact CB-CG1 3.95Å; I281-V285 WeakPolarHBondContact O-CG2 3.29Å; I281-V285 PolarHBondContact O-N 3.38Å; I281-V285 VanDerWaalsContact O-N 3.12Å; E282-V285 PolarHBondContact O-N 3.42Å; K283-V285 VanDerWaalsContact C-N 3.35Å; V285-R287 VanDerWaalsContact C-N 3.28Å; V285-R287 PolarHBondContact O-N 3.21Å; V285-S288 PolarHBondContact O-N 3.46Å; V285-S288 PolarHBondContact O-OG 3.45Å; V285-L291 HydrophobicContact CG1-CD1 3.98Å; V285-L291 HydrophobicContact CG1-CG 4.06Å
286	V	89.3	Confident	90.1	Very high	63 Å²	63	53 Å²	53	38%	0.382	25%	0.254	S	S	.	.	H	α-helix	trans	-61.7	-40	173.8	169.8	0	0	0	0	110.7	E282 K283 S288 G289 L291	E282-V286 VanDerWaalsContact O-CG2 3.26Å; E282-V286 WeakPolarHBondContact O-CG2 3.13Å; E282-V286 PolarHBondContact O-N 3.47Å; K283-V286 PolarHBondContact O-N 3.44Å; V286-S288 VanDerWaalsContact C-N 3.27Å; V286-S288 PolarHBondContact O-N 3.4Å; V286-G289 PolarHBondContact O-N 3.4Å; V286-G289 VanDerWaalsContact O-N 3.09Å; V286-L291 HydrophobicContact CG2-CD1 3.74Å
287	R	86.6	Confident	90	Very high	181 Å²	181	53 Å²	53	68%	0.683	25%	0.253	S	S	*	.	H	α-helix	trans	-64.3	-27.4	-179.8	-169.6	-178.1	66.6	161.4	-0.8	113.5	K283 E284 V285 G289	K283-R287 WeakPolarHBondContact O-CB 3.48Å; K283-R287 PolarHBondContact O-N 3.45Å; E284-R287 WeakPolarHBondContact O-CB 3.3Å; E284-R287 PolarHBondContact O-N 3.06Å; V285-R287 VanDerWaalsContact C-N 3.28Å; V285-R287 PolarHBondContact O-N 3.21Å; R287-G289 PolarHBondContact O-N 3.03Å
288	S	87.3	Confident	90.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.6	-21.2	176.2	79.7	0	0	0	0	112.6	A249 E250 E284 V285 V286 T290 K575 Q579	A249-S288 PolarHBondContact O-OG 2.81Å; E250-S288 VanDerWaalsContact CD-CB 3.43Å; E250-S288 WeakPolarHBondContact OE1-CA 3.35Å; E250-S288 WeakPolarHBondContact OE1-CB 3.32Å; E250-S288 WeakPolarHBondContact OE2-CA 3.22Å; E250-S288 WeakPolarHBondContact OE2-CB 3.34Å; E284-S288 PolarHBondContact O-N 3.35Å; V285-S288 PolarHBondContact O-N 3.46Å; V285-S288 PolarHBondContact O-OG 3.45Å; V286-S288 VanDerWaalsContact C-N 3.27Å; V286-S288 PolarHBondContact O-N 3.4Å; S288-T290 PolarHBondContact O-N 3.11Å; S288-T290 PolarHBondContact OG-N 3.28Å; S288-T290 PolarHBondContact OG-OG1 3.26Å; S288-K575 PolarHBondContact O-NZ 2.81Å; S288-Q579 PolarHBondContact O-NE2 2.95Å
289	G	84.8	Confident	90.1	Very high	15 Å²	15	52.5 Å²	52.5	16%	0.155	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	7.1	-178.4	0	0	0	0	0	113.9	V286 R287 L291	V286-G289 PolarHBondContact O-N 3.4Å; V286-G289 VanDerWaalsContact O-N 3.09Å; R287-G289 PolarHBondContact O-N 3.03Å; G289-L291 VanDerWaalsContact C-N 3.34Å
290	T	89.4	Confident	90.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.248	C	C	.	.			trans	-74.1	-26	-179.6	-43	0	0	0	0	112.5	A249 L252 F253 A256 V272 S288 E292 L293	A249-T290 PolarHBondContact O-OG1 2.98Å; A249-T290 VanDerWaalsContact O-OG1 3.09Å; L252-T290 HydrophobicContact CB-CG2 4.48Å; F253-T290 HydrophobicContact CB-CG2 4.37Å; F253-T290 HydrophobicContact CD2-CG2 4.36Å; A256-T290 HydrophobicContact CB-CG2 3.71Å; V272-T290 HydrophobicContact CB-CG2 4.47Å; V272-T290 HydrophobicContact CG1-CG2 4.35Å; V272-T290 HydrophobicContact CG2-CG2 3.67Å; S288-T290 PolarHBondContact O-N 3.11Å; S288-T290 PolarHBondContact OG-N 3.28Å; S288-T290 PolarHBondContact OG-OG1 3.26Å; T290-E292 VanDerWaalsContact C-N 3.3Å; T290-E292 PolarHBondContact O-N 2.82Å; T290-L293 HydrophobicContact CG2-CD1 4.36Å; T290-L293 WeakPolarHBondContact O-CB 3.41Å; T290-L293 PolarHBondContact O-N 3.33Å
291	L	90.3	Very high	90.4	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.037	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-63.4	-33.4	178.4	-77.2	172.3	0	0	0	113.4	V272 T273 A276 V285 V286 G289 L293 V294 E338	V272-L291 HydrophobicContact CG1-CD2 3.64Å; V272-L291 HydrophobicContact CG1-CG 3.76Å; T273-L291 HydrophobicContact CG2-CD2 4.17Å; A276-L291 HydrophobicContact CB-CD1 3.76Å; A276-L291 HydrophobicContact CB-CD2 3.79Å; A276-L291 HydrophobicContact CB-CG 4.31Å; V285-L291 HydrophobicContact CG1-CD1 3.98Å; V285-L291 HydrophobicContact CG1-CG 4.06Å; V286-L291 HydrophobicContact CG2-CD1 3.74Å; G289-L291 VanDerWaalsContact C-N 3.34Å; L291-L293 PolarHBondContact O-N 3.24Å; L291-L293 VanDerWaalsContact O-N 3.1Å; L291-V294 WeakPolarHBondContact O-CB 3.49Å; L291-V294 WeakPolarHBondContact O-CG2 3.35Å; L291-V294 PolarHBondContact O-N 3.35Å; L291-E338 HydrophobicContact CB-CG 4.45Å; L291-E338 HydrophobicContact CD2-CB 4.23Å; L291-E338 HydrophobicContact CD2-CG 4.37Å
292	E	88.1	Confident	90.3	Very high	129 Å²	129	46 Å²	46	60%	0.603	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-62.9	-19.4	179.9	-60.3	-177.7	174.3	0	0	112.4	T290 P296	T290-E292 VanDerWaalsContact C-N 3.3Å; T290-E292 PolarHBondContact O-N 2.82Å; E292-P296 WeakPolarHBondContact O-CD 3.44Å
293	L	89.9	Confident	90.3	Very high	11 Å²	11	44.6 Å²	44.6	6%	0.058	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-79.2	-21.2	177.8	-53	-174.1	0	0	0	113.2	F253 A256 F257 T290 L291 F297 V589	F253-L293 HydrophobicContact CD2-CD1 3.92Å; F253-L293 HydrophobicContact CE2-CD1 3.74Å; F253-L293 HydrophobicContact CE2-CD2 4.35Å; F253-L293 HydrophobicContact CE2-CG 4.23Å; F253-L293 HydrophobicContact CZ-CD1 4.36Å; A256-L293 HydrophobicContact CB-CD1 3.79Å; F257-L293 HydrophobicContact CB-CD1 3.99Å; F257-L293 HydrophobicContact CD2-CD1 4.15Å; F257-L293 HydrophobicContact CD2-CD2 4.17Å; T290-L293 HydrophobicContact CG2-CD1 4.36Å; T290-L293 WeakPolarHBondContact O-CB 3.41Å; T290-L293 PolarHBondContact O-N 3.33Å; L291-L293 PolarHBondContact O-N 3.24Å; L291-L293 VanDerWaalsContact O-N 3.1Å; L293-F297 WeakPolarHBondContact O-CB 3.13Å; L293-F297 PolarHBondContact O-N 3.41Å; L293-V589 HydrophobicContact CD2-CB 4.18Å; L293-V589 HydrophobicContact CD2-CG1 3.26Å; L293-V589 HydrophobicContact CD2-CG2 3.79Å
294	V	93.3	Very high	90.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-72.1	-57.3	-164.6	179.1	0	0	0	0	111.9	C269 T273 L291 F297 I298 E338 I342	C269-V294 HydrophobicContact CB-CG1 4.32Å; C269-V294 HydrophobicContact CB-CG2 3.97Å; T273-V294 HydrophobicContact CG2-CB 4.43Å; T273-V294 HydrophobicContact CG2-CG1 3.84Å; T273-V294 HydrophobicContact CG2-CG2 3.96Å; L291-V294 WeakPolarHBondContact O-CB 3.49Å; L291-V294 WeakPolarHBondContact O-CG2 3.35Å; L291-V294 PolarHBondContact O-N 3.35Å; V294-F297 PolarHBondContact O-N 3.41Å; V294-I298 HydrophobicContact CG1-CG1 4.27Å; V294-I298 VanDerWaalsContact O-CG1 3.32Å; V294-I298 WeakPolarHBondContact O-CG1 3.35Å; V294-I298 PolarHBondContact O-N 3.1Å; V294-E338 HydrophobicContact CB-CB 4.02Å; V294-E338 HydrophobicContact CB-CG 4.23Å; V294-E338 HydrophobicContact CG1-CB 4.01Å; V294-E338 HydrophobicContact CG2-CB 4.49Å; V294-I342 HydrophobicContact CG1-CB 4.35Å
295	E	92.9	Very high	90.1	Very high	53 Å²	53	39.1 Å²	39.1	25%	0.248	21%	0.21	C	C	.	.	H	α-helix	trans	-62.2	-46.2	-175	-167.9	-82.3	171.5	0	0	112.6	F297 I298 A299 V337 N381 T383	E295-F297 VanDerWaalsContact C-N 3.28Å; E295-F297 PolarHBondContact O-N 3.05Å; E295-I298 PolarHBondContact O-N 3.24Å; E295-A299 VanDerWaalsContact O-CB 3.3Å; E295-A299 WeakPolarHBondContact O-CB 3.35Å; E295-A299 PolarHBondContact O-N 3.31Å; E295-V337 HydrophobicContact CG-CG1 4.46Å; E295-N381 PolarHBondContact OE1-ND2 3.31Å; E295-T383 PolarHBondContact OE1-OG1 3.39Å
296	P	89.9	Confident	89.9	Confident	34 Å²	34	39.2 Å²	39.2	22%	0.221	21%	0.21	C	C	.	.	H	α-helix	trans	-64.1	-33.3	178.3	-23.7	35.1	0	0	0	113.3	E292 S300 K591	E292-P296 WeakPolarHBondContact O-CD 3.44Å; P296-S300 PolarHBondContact O-N 3.47Å; P296-K591 HydrophobicContact CB-CB 4.42Å; P296-K591 HydrophobicContact CB-CD 4.38Å
297	F	92	Very high	89.6	Confident	4 Å²	4	36.2 Å²	36.2	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-68.6	-52.8	175.6	171.3	-118.3	0	0	0	110.9	E262 R265 F266 L293 V294 E295 A299 S300 L301	E262-F297 HydrophobicContact CB-CZ 4.48Å; R265-F297 HydrophobicContact CB-CE1 3.9Å; R265-F297 HydrophobicContact CB-CE2 3.95Å; R265-F297 HydrophobicContact CB-CZ 3.56Å; F266-F297 HydrophobicContact CB-CE1 4.07Å; F266-F297 HydrophobicContact CB-CZ 4.38Å; L293-F297 WeakPolarHBondContact O-CB 3.13Å; L293-F297 PolarHBondContact O-N 3.41Å; V294-F297 PolarHBondContact O-N 3.41Å; E295-F297 VanDerWaalsContact C-N 3.28Å; E295-F297 PolarHBondContact O-N 3.05Å; F297-A299 VanDerWaalsContact C-N 3.25Å; F297-A299 PolarHBondContact O-N 3.43Å; F297-S300 WeakPolarHBondContact O-CA 3.32Å; F297-S300 WeakPolarHBondContact O-CB 3.28Å; F297-S300 PolarHBondContact O-N 3.41Å; F297-S300 PolarHBondContact O-OG 2.92Å; F297-L301 HydrophobicContact CD1-CD1 4.43Å; F297-L301 HydrophobicContact CD2-CG 4.46Å; F297-L301 HydrophobicContact CE1-CD1 3.78Å; F297-L301 HydrophobicContact CE2-CD1 4Å; F297-L301 HydrophobicContact CE2-CD2 3.81Å; F297-L301 HydrophobicContact CE2-CG 4.04Å; F297-L301 HydrophobicContact CZ-CD1 3.57Å; F297-L301 HydrophobicContact CZ-CD2 4.11Å; F297-L301 HydrophobicContact CZ-CG 4.14Å; F297-L301 PolarHBondContact O-N 3.28Å
298	I	94.3	Very high	89.3	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-60.1	-37.8	179	-64.6	-60.1	0	0	0	111.5	F266 V294 E295 S300 L301 C341 I342 F345 T383 L387	F266-I298 HydrophobicContact CD2-CD1 4.09Å; F266-I298 HydrophobicContact CE2-CD1 4.19Å; V294-I298 HydrophobicContact CG1-CG1 4.27Å; V294-I298 VanDerWaalsContact O-CG1 3.32Å; V294-I298 WeakPolarHBondContact O-CG1 3.35Å; V294-I298 PolarHBondContact O-N 3.1Å; E295-I298 PolarHBondContact O-N 3.24Å; I298-S300 PolarHBondContact O-N 2.95Å; I298-L301 HydrophobicContact CD1-CD1 4.42Å; I298-L301 PolarHBondContact O-N 2.87Å; I298-C341 HydrophobicContact CB-CB 4.48Å; I298-C341 HydrophobicContact CG2-CB 4.21Å; I298-I342 HydrophobicContact CD1-CB 4.34Å; I298-I342 HydrophobicContact CD1-CD1 4.31Å; I298-I342 HydrophobicContact CD1-CG1 4.01Å; I298-I342 HydrophobicContact CG1-CB 4.34Å; I298-F345 HydrophobicContact CD1-CB 4.36Å; I298-F345 HydrophobicContact CD1-CD1 4.25Å; I298-F345 HydrophobicContact CD1-CG 4.22Å; I298-F345 HydrophobicContact CG2-CB 3.74Å; I298-F345 HydrophobicContact CG2-CD2 4.04Å; I298-F345 HydrophobicContact CG2-CG 4.06Å; I298-T383 HydrophobicContact CG2-CG2 4.21Å; I298-L387 HydrophobicContact CG2-CD1 3.74Å
299	A	91.8	Very high	88.9	Confident	53 Å²	53	36.2 Å²	36.2	44%	0.438	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-19.4	175.3	0	0	0	0	0	113.8	E295 F297 T383	E295-A299 VanDerWaalsContact O-CB 3.3Å; E295-A299 WeakPolarHBondContact O-CB 3.35Å; E295-A299 PolarHBondContact O-N 3.31Å; F297-A299 VanDerWaalsContact C-N 3.25Å; F297-A299 PolarHBondContact O-N 3.43Å; A299-T383 HydrophobicContact CB-CG2 3.81Å
300	S	91.4	Very high	88.3	Confident	70 Å²	70	35.9 Å²	35.9	49%	0.49	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-14.3	179	71.1	0	0	0	0	114.5	P296 F297 I298	P296-S300 PolarHBondContact O-N 3.47Å; F297-S300 WeakPolarHBondContact O-CA 3.32Å; F297-S300 WeakPolarHBondContact O-CB 3.28Å; F297-S300 PolarHBondContact O-N 3.41Å; F297-S300 PolarHBondContact O-OG 2.92Å; I298-S300 PolarHBondContact O-N 2.95Å
301	L	91.9	Very high	87.1	Confident	19 Å²	19	37.8 Å²	37.8	10%	0.099	21%	0.205	C	C	.	.			trans	-92.1	148.4	-176.7	-62.2	179.1	0	0	0	112.2	E262 F297 I298 F306 F345	E262-L301 HydrophobicContact CB-CD2 4.47Å; E262-L301 HydrophobicContact CG-CD2 4.26Å; F297-L301 HydrophobicContact CD1-CD1 4.43Å; F297-L301 HydrophobicContact CD2-CG 4.46Å; F297-L301 HydrophobicContact CE1-CD1 3.78Å; F297-L301 HydrophobicContact CE2-CD1 4Å; F297-L301 HydrophobicContact CE2-CD2 3.81Å; F297-L301 HydrophobicContact CE2-CG 4.04Å; F297-L301 HydrophobicContact CZ-CD1 3.57Å; F297-L301 HydrophobicContact CZ-CD2 4.11Å; F297-L301 HydrophobicContact CZ-CG 4.14Å; F297-L301 PolarHBondContact O-N 3.28Å; I298-L301 HydrophobicContact CD1-CD1 4.42Å; I298-L301 PolarHBondContact O-N 2.87Å; L301-F306 HydrophobicContact CD1-CD2 4.27Å; L301-F306 HydrophobicContact CD1-CE2 4.45Å; L301-F345 HydrophobicContact CB-CE2 3.55Å; L301-F345 HydrophobicContact CB-CZ 3.7Å; L301-F345 HydrophobicContact CD1-CE1 4.02Å; L301-F345 HydrophobicContact CD1-CE2 4.1Å; L301-F345 HydrophobicContact CD1-CZ 3.59Å; L301-F345 HydrophobicContact CG-CZ 4.33Å
302	D	91.3	Very high	85.5	Confident	56 Å²	56	43.9 Å²	43.9	30%	0.299	24%	0.238	S	C	.	.			trans	-98.3	125	162.8	-178	-96.4	0	0	0	111.1	D304 D305 F306 R390	D302-D304 VanDerWaalsContact C-N 3.31Å; D302-D304 PolarHBondContact O-N 3.28Å; D302-D304 WeakPolarHBondContact OD1-CA 3.32Å; D302-D304 WeakPolarHBondContact OD1-CB 3.5Å; D302-D304 PolarHBondContact OD1-N 3.4Å; D302-D305 HydrophobicContact CB-CB 4.19Å; D302-D305 PolarHBondContact O-N 2.95Å; D302-D305 PolarHBondContact OD1-N 3.39Å; D302-D305 VanDerWaalsContact OD1-N 3.07Å; D302-F306 WeakPolarHBondContact O-CB 3.44Å; D302-F306 PolarHBondContact O-N 3.12Å; D302-R390 IonicContact OD1-NH2 2.74Å; D302-R390 PolarHBondContact OD1-NH2 3.31Å; D302-R390 IonicContact OD2-CZ 3.69Å; D302-R390 IonicContact OD2-NH1 2.9Å; D302-R390 PolarHBondContact OD2-NH1 3Å; D302-R390 IonicContact OD2-NH2 2.64Å; D302-R390 PolarHBondContact OD2-NH2 3.43Å; D302-R390 VanDerWaalsContact OD2-NH2 3.08Å
303	P	91.3	Very high	84	Confident	3 Å²	3	40 Å²	40	2%	0.019	23%	0.226	C	C	.	.	H	α-helix	trans	-55.2	-34.5	177	-30.1	33	0	0	0	116.1	A307 F345 C348 V349 L387	P303-A307 VanDerWaalsContact O-CB 3.23Å; P303-A307 WeakPolarHBondContact O-CB 3.45Å; P303-A307 PolarHBondContact O-N 3.2Å; P303-F345 HydrophobicContact CB-CE2 4.33Å; P303-F345 HydrophobicContact CG-CD2 3.92Å; P303-F345 HydrophobicContact CG-CE2 3.78Å; P303-C348 HydrophobicContact CB-CB 4.27Å; P303-C348 HydrophobicContact CG-CB 4.33Å; P303-V349 HydrophobicContact CB-CG2 4.04Å; P303-L387 HydrophobicContact CG-CD2 3.65Å
304	D	86.8	Confident	82	Confident	44 Å²	44	41 Å²	41	24%	0.235	24%	0.235	C	C	.	.	H	α-helix	trans	-81.5	-32.4	-177.3	-75	-40.3	0	0	0	112.2	D302 R308 S352 R390	D302-D304 VanDerWaalsContact C-N 3.31Å; D302-D304 PolarHBondContact O-N 3.28Å; D302-D304 WeakPolarHBondContact OD1-CA 3.32Å; D302-D304 WeakPolarHBondContact OD1-CB 3.5Å; D302-D304 PolarHBondContact OD1-N 3.4Å; D304-R308 PolarHBondContact O-N 3.12Å; D304-R308 PolarHBondContact O-NE 3.4Å; D304-R308 VanDerWaalsContact O-NE 3.12Å; D304-S352 WeakPolarHBondContact OD1-CB 3.41Å; D304-S352 PolarHBondContact OD1-OG 3.34Å; D304-R390 IonicContact OD2-CZ 3.82Å; D304-R390 IonicContact OD2-NH2 4Å; D304-R390 PolarHBondContact OD2-NH2 3.05Å
305	D	87.4	Confident	79.9	Confident	78 Å²	78	44 Å²	44	42%	0.417	25%	0.251	S	S	.	.	H	α-helix	trans	-65.1	-47.8	168.8	-69.3	-28.3	0	0	0	110.1	D302 A307 R308 C309	D302-D305 HydrophobicContact CB-CB 4.19Å; D302-D305 PolarHBondContact O-N 2.95Å; D302-D305 PolarHBondContact OD1-N 3.39Å; D302-D305 VanDerWaalsContact OD1-N 3.07Å; D305-A307 VanDerWaalsContact C-N 3.34Å; D305-A307 PolarHBondContact O-N 3.33Å; D305-R308 WeakPolarHBondContact O-CB 3.42Å; D305-R308 PolarHBondContact O-N 3.47Å; D305-R308 IonicContact OD1-CZ 3.46Å; D305-R308 IonicContact OD1-NH1 3.19Å; D305-R308 PolarHBondContact OD1-NH1 2.87Å; D305-R308 IonicContact OD1-NH2 3.09Å; D305-R308 PolarHBondContact OD1-NH2 3.08Å; D305-C309 PolarHBondContact O-N 3.44Å; D305-C309 VanDerWaalsContact O-N 3.08Å; D305-C309 PolarHBondContact O-SG 2.98Å
306	F	87.3	Confident	78.2	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.009	25%	0.245	C	C	.	.	H	α-helix	trans	-64	-37.5	178.2	-164.9	-97.1	0	0	0	112.7	E262 L263 F266 L301 D302 R308 C309 L310 F345 V349	E262-F306 HydrophobicContact CB-CE2 4.37Å; L263-F306 HydrophobicContact CD2-CE1 4.35Å; L263-F306 HydrophobicContact CD2-CE2 3.82Å; L263-F306 HydrophobicContact CD2-CZ 3.61Å; F266-F306 HydrophobicContact CB-CE2 4.09Å; F266-F306 HydrophobicContact CB-CZ 3.65Å; F266-F306 HydrophobicContact CD1-CE1 4.03Å; F266-F306 AromaticContact CD1-CZ 3.71Å; F266-F306 HydrophobicContact CD1-CZ 3.71Å; F266-F306 HydrophobicContact CD2-CE1 4.3Å; F266-F306 AromaticContact CD2-CZ 3.98Å; F266-F306 HydrophobicContact CD2-CZ 3.98Å; F266-F306 HydrophobicContact CE1-CE1 4.25Å; F266-F306 HydrophobicContact CE1-CZ 4.38Å; F266-F306 HydrophobicContact CG-CE1 4.06Å; F266-F306 HydrophobicContact CG-CE2 4.3Å; F266-F306 AromaticContact CG-CZ 3.48Å; F266-F306 HydrophobicContact CG-CZ 3.48Å; F266-F306 VanDerWaalsContact CG-CZ 3.48Å; F266-F306 HydrophobicContact CZ-CE1 4.49Å; L301-F306 HydrophobicContact CD1-CD2 4.27Å; L301-F306 HydrophobicContact CD1-CE2 4.45Å; D302-F306 WeakPolarHBondContact O-CB 3.44Å; D302-F306 PolarHBondContact O-N 3.12Å; F306-R308 VanDerWaalsContact C-N 3.28Å; F306-R308 PolarHBondContact O-N 2.93Å; F306-C309 PolarHBondContact O-N 3.32Å; F306-L310 HydrophobicContact CD1-CD1 3.55Å; F306-L310 HydrophobicContact CD1-CG 4.22Å; F306-L310 HydrophobicContact CE1-CD1 3.5Å; F306-L310 HydrophobicContact CE1-CG 4.03Å; F306-L310 PolarHBondContact O-N 3.3Å; F306-F345 HydrophobicContact CB-CE1 4.31Å; F306-F345 HydrophobicContact CB-CZ 3.76Å; F306-F345 AromaticContact CD1-CE1 3.63Å; F306-F345 HydrophobicContact CD1-CE1 3.63Å; F306-F345 AromaticContact CD1-CZ 3.98Å; F306-F345 HydrophobicContact CD1-CZ 3.98Å; F306-F345 HydrophobicContact CD2-CE1 4.48Å; F306-F345 HydrophobicContact CD2-CZ 4.34Å; F306-F345 AromaticContact CE1-CE1 3.98Å; F306-F345 HydrophobicContact CE1-CE1 3.98Å; F306-F345 AromaticContact CG-CE1 3.89Å; F306-F345 HydrophobicContact CG-CE1 3.89Å; F306-F345 AromaticContact CG-CZ 3.78Å; F306-F345 HydrophobicContact CG-CZ 3.78Å; F306-V349 HydrophobicContact CB-CG2 4.43Å; F306-V349 HydrophobicContact CD1-CG1 4.27Å; F306-V349 HydrophobicContact CD1-CG2 3.92Å
307	A	83.7	Confident	76.7	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.008	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-37.5	172.4	0	0	0	0	0	111.9	P303 D305 L310 L311 V349 I353	P303-A307 VanDerWaalsContact O-CB 3.23Å; P303-A307 WeakPolarHBondContact O-CB 3.45Å; P303-A307 PolarHBondContact O-N 3.2Å; D305-A307 VanDerWaalsContact C-N 3.34Å; D305-A307 PolarHBondContact O-N 3.33Å; A307-L310 PolarHBondContact O-N 3.44Å; A307-L311 WeakPolarHBondContact O-CG 3.4Å; A307-L311 PolarHBondContact O-N 3.33Å; A307-V349 HydrophobicContact CB-CG1 3.98Å; A307-I353 HydrophobicContact CB-CG1 4.41Å
308	R	80.8	Confident	75.4	Confident	121 Å²	121	45.3 Å²	45.3	46%	0.457	26%	0.257	S	S	.	.	H	α-helix	trans	-65.9	-45.1	174.7	-77.5	174.1	-103.5	137.7	-2.4	111.3	D304 D305 F306 L310 L311 D312	D304-R308 PolarHBondContact O-N 3.12Å; D304-R308 PolarHBondContact O-NE 3.4Å; D304-R308 VanDerWaalsContact O-NE 3.12Å; D305-R308 WeakPolarHBondContact O-CB 3.42Å; D305-R308 PolarHBondContact O-N 3.47Å; D305-R308 IonicContact OD1-CZ 3.46Å; D305-R308 IonicContact OD1-NH1 3.19Å; D305-R308 PolarHBondContact OD1-NH1 2.87Å; D305-R308 IonicContact OD1-NH2 3.09Å; D305-R308 PolarHBondContact OD1-NH2 3.08Å; F306-R308 VanDerWaalsContact C-N 3.28Å; F306-R308 PolarHBondContact O-N 2.93Å; R308-L310 VanDerWaalsContact C-N 3.28Å; R308-L310 PolarHBondContact O-N 2.89Å; R308-L311 PolarHBondContact O-N 3.45Å; R308-L311 VanDerWaalsContact O-N 3.09Å; R308-D312 PolarHBondContact O-N 3.13Å
309	C	78.4	Confident	74.5	Confident	60 Å²	60	45.4 Å²	45.4	41%	0.405	26%	0.258	S	S	.	.	H	α-helix	trans	-59.9	-36.3	175.6	-63.2	0	0	0	0	113.1	D305 F306	D305-C309 PolarHBondContact O-N 3.44Å; D305-C309 VanDerWaalsContact O-N 3.08Å; D305-C309 PolarHBondContact O-SG 2.98Å; F306-C309 PolarHBondContact O-N 3.32Å
310	L	72.8	Confident	74	Confident	8 Å²	8	45 Å²	45	4%	0.042	25%	0.246	C	C	.	.	H	α-helix	trans	-68.8	-37.2	174.1	-82.6	161	0	0	0	112.8	L263 F306 A307 R308 D312 S313 C316 V349	L263-L310 HydrophobicContact CD2-CD2 4.25Å; L263-L310 HydrophobicContact CD2-CG 4.33Å; F306-L310 HydrophobicContact CD1-CD1 3.55Å; F306-L310 HydrophobicContact CD1-CG 4.22Å; F306-L310 HydrophobicContact CE1-CD1 3.5Å; F306-L310 HydrophobicContact CE1-CG 4.03Å; F306-L310 PolarHBondContact O-N 3.3Å; A307-L310 PolarHBondContact O-N 3.44Å; R308-L310 VanDerWaalsContact C-N 3.28Å; R308-L310 PolarHBondContact O-N 2.89Å; L310-D312 PolarHBondContact O-N 3.29Å; L310-S313 WeakPolarHBondContact O-CB 3.32Å; L310-S313 PolarHBondContact O-N 3.47Å; L310-S313 VanDerWaalsContact O-N 3.13Å; L310-C316 HydrophobicContact CB-CB 4.38Å; L310-C316 HydrophobicContact CD2-CB 4.29Å; L310-C316 WeakPolarHBondContact O-CB 3.47Å; L310-V349 HydrophobicContact CD1-CG1 3.41Å; L310-V349 VanDerWaalsContact CD1-CG1 3.41Å
311	L	63.9	Low	73.6	Confident	39 Å²	39	43.4 Å²	43.4	20%	0.204	23%	0.234	C	C	.	.	H	α-helix	trans	-69.2	-21	179.7	-70.7	168.6	0	0	0	113.1	A307 R308 S313 M317 I353	A307-L311 WeakPolarHBondContact O-CG 3.4Å; A307-L311 PolarHBondContact O-N 3.33Å; R308-L311 PolarHBondContact O-N 3.45Å; R308-L311 VanDerWaalsContact O-N 3.09Å; L311-S313 PolarHBondContact O-N 3.43Å; L311-M317 VanDerWaalsContact CD2-O 3.26Å; L311-M317 WeakPolarHBondContact CD2-O 3.33Å; L311-M317 WeakPolarHBondContact O-CG 3.2Å; L311-I353 HydrophobicContact CD2-CG1 4.36Å; L311-I353 HydrophobicContact CD2-CG2 4.36Å
312	D	55.7	Low	73.4	Confident	135 Å²	135	44.2 Å²	44.2	72%	0.722	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-7.2	173.5	-65.7	-27	0	0	0	112.6	R308 L310	R308-D312 PolarHBondContact O-N 3.13Å; L310-D312 PolarHBondContact O-N 3.29Å
313	S	57.8	Low	73.1	Confident	49 Å²	49	44.6 Å²	44.6	34%	0.343	25%	0.25	S	S	.	.	S	Bend	trans	-95.4	125.5	170.4	-172.2	0	0	0	0	110.7	L310 L311 D315 C316 M317	L310-S313 WeakPolarHBondContact O-CB 3.32Å; L310-S313 PolarHBondContact O-N 3.47Å; L310-S313 VanDerWaalsContact O-N 3.13Å; L311-S313 PolarHBondContact O-N 3.43Å; S313-D315 PolarHBondContact O-N 2.88Å; S313-D315 VanDerWaalsContact O-N 3.15Å; S313-C316 PolarHBondContact O-N 3.21Å; S313-M317 PolarHBondContact O-N 3.08Å
314	A	47.4	Very low	72.9	Confident	32 Å²	32	45.1 Å²	45.1	26%	0.264	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-53	-37.9	-176.1	0	0	0	0	0	113.1	W101 C316	W101-A314 HydrophobicContact CB-CB 4.22Å; A314-C316 VanDerWaalsContact C-N 3.29Å; A314-C316 PolarHBondContact O-N 3.43Å
315	D	50.3	Low	73.1	Confident	63 Å²	63	43 Å²	43	34%	0.337	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-71.7	-18.2	179.5	-68.7	-41.5	0	0	0	114.7	S313	S313-D315 PolarHBondContact O-N 2.88Å; S313-D315 VanDerWaalsContact O-N 3.15Å
316	C	55.7	Low	73.3	Confident	16 Å²	16	44.1 Å²	44.1	11%	0.108	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-113.7	-0.9	-171.1	-70.8	0	0	0	0	113.8	L310 S313 A314 Q318 G319	L310-C316 HydrophobicContact CB-CB 4.38Å; L310-C316 HydrophobicContact CD2-CB 4.29Å; L310-C316 WeakPolarHBondContact O-CB 3.47Å; S313-C316 PolarHBondContact O-N 3.21Å; A314-C316 VanDerWaalsContact C-N 3.29Å; A314-C316 PolarHBondContact O-N 3.43Å; C316-Q318 PolarHBondContact O-N 3.27Å; C316-G319 PolarHBondContact O-N 3.44Å
317	M	59.9	Low	73.6	Confident	61 Å²	61	47.4 Å²	47.4	30%	0.3	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-25.2	177.7	-71.8	-169	76.5	0	0	113.7	L311 S313	L311-M317 VanDerWaalsContact CD2-O 3.26Å; L311-M317 WeakPolarHBondContact CD2-O 3.33Å; L311-M317 WeakPolarHBondContact O-CG 3.2Å; S313-M317 PolarHBondContact O-N 3.08Å
318	Q	64	Low	74.1	Confident	40 Å²	40	47.6 Å²	47.6	19%	0.187	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	1.2	-178	-54.8	-167.7	2.6	0	0	114.7	R108 C316 K354 Q357	R108-Q318 HydrophobicContact CB-CG 4.45Å; R108-Q318 VanDerWaalsContact N-NE2 3.1Å; C316-Q318 PolarHBondContact O-N 3.27Å; Q318-K354 PolarHBondContact O-NZ 3.4Å; Q318-Q357 VanDerWaalsContact CA-NE2 3.32Å; Q318-Q357 PolarHBondContact O-NE2 3.17Å
319	G	74.4	Confident	74.7	Confident	3 Å²	3	43.1 Å²	43.1	3%	0.031	25%	0.246	C	C	.	.			trans	68.4	-178.1	-174.4	0	0	0	0	0	113.8	C316 E350	C316-G319 PolarHBondContact O-N 3.44Å; G319-E350 WeakPolarHBondContact CA-OE2 3.16Å
320	K	82.6	Confident	75.3	Confident	44 Å²	44	44.2 Å²	44.2	19%	0.191	25%	0.252	C	S	.	.			trans	-76.9	163	-176.8	-65.3	-63.5	179.6	-172.7	0	113.1	D324 L325 Y346 E350 K354	K320-D324 HydrophobicContact CB-CB 3.83Å; K320-D324 HydrophobicContact CD-CB 4.32Å; K320-D324 HydrophobicContact CG-CB 4.39Å; K320-L325 HydrophobicContact CB-CD2 3.97Å; K320-L325 HydrophobicContact CB-CG 4.14Å; K320-Y346 WeakPolarHBondContact CE-OH 3.39Å; K320-E350 WeakPolarHBondContact CG-OE1 3.45Å; K320-E350 PolarHBondContact N-OE1 2.86Å; K320-E350 PolarHBondContact N-OE2 2.83Å; K320-K354 VanDerWaalsContact O-CE 3.27Å; K320-K354 WeakPolarHBondContact O-CE 3.48Å; K320-K354 PolarHBondContact O-NZ 3.02Å
321	T	83.4	Confident	76.4	Confident	37 Å²	37	44.1 Å²	44.1	23%	0.227	25%	0.251	C	S	.	.			trans	-81.5	168.1	175.3	64.2	0	0	0	0	111.6	S323 D324 L325	T321-S323 VanDerWaalsContact C-N 3.29Å; T321-S323 PolarHBondContact O-N 3.07Å; T321-S323 PolarHBondContact OG1-OG 3.32Å; T321-D324 PolarHBondContact O-N 2.63Å; T321-D324 PolarHBondContact OG1-N 2.79Å; T321-D324 PolarHBondContact OG1-OD2 2.99Å; T321-L325 VanDerWaalsContact O-CG 3.31Å; T321-L325 WeakPolarHBondContact O-CG 3.38Å; T321-L325 PolarHBondContact O-N 2.97Å
322	A	85.8	Confident	77.8	Confident	37 Å²	37	42.3 Å²	42.3	31%	0.306	24%	0.242	S	C	.	.	H	α-helix	trans	-57.2	-43.2	174.4	0	0	0	0	0	112.1	L325 Q326 I362 I366	A322-L325 PolarHBondContact O-N 3.42Å; A322-Q326 WeakPolarHBondContact O-CG 3.47Å; A322-Q326 PolarHBondContact O-N 3.37Å; A322-Q326 VanDerWaalsContact O-N 3.1Å; A322-I362 HydrophobicContact CB-CD1 3.81Å; A322-I362 HydrophobicContact CB-CG1 3.9Å; A322-I366 HydrophobicContact CB-CG2 4.11Å
323	S	85.7	Confident	79.4	Confident	63 Å²	63	39 Å²	39	44%	0.441	22%	0.224	S	C	.	.	H	α-helix	trans	-62.1	-43.6	178	60.6	0	0	0	0	111.7	T321 L325 Q326 H327	T321-S323 VanDerWaalsContact C-N 3.29Å; T321-S323 PolarHBondContact O-N 3.07Å; T321-S323 PolarHBondContact OG1-OG 3.32Å; S323-L325 PolarHBondContact O-N 3.14Å; S323-Q326 PolarHBondContact O-N 3.18Å; S323-H327 PolarHBondContact O-CD2 3.45Å
324	D	87	Confident	80.8	Confident	14 Å²	14	37.8 Å²	37.8	8%	0.075	22%	0.219	C	C	.	.	H	α-helix	trans	-62.7	-42.9	178.1	-70.7	-21.9	0	0	0	111.5	K191 Y234 K320 T321 Q326 H327	K191-D324 WeakPolarHBondContact CE-OD1 3.4Å; K191-D324 IonicContact NZ-OD1 2.76Å; K191-D324 PolarHBondContact NZ-OD1 2.86Å; K191-D324 VanDerWaalsContact NZ-OD1 3.09Å; K191-D324 IonicContact NZ-OD2 3.61Å; K191-D324 PolarHBondContact NZ-OD2 3.18Å; Y234-D324 VanDerWaalsContact OH-CG 3.31Å; Y234-D324 PolarHBondContact OH-OD1 2.89Å; K320-D324 HydrophobicContact CB-CB 3.83Å; K320-D324 HydrophobicContact CD-CB 4.32Å; K320-D324 HydrophobicContact CG-CB 4.39Å; T321-D324 PolarHBondContact O-N 2.63Å; T321-D324 PolarHBondContact OG1-N 2.79Å; T321-D324 PolarHBondContact OG1-OD2 2.99Å; D324-Q326 VanDerWaalsContact C-N 3.31Å; D324-Q326 PolarHBondContact O-N 3.17Å; D324-H327 PolarHBondContact O-N 3.33Å
325	L	90.4	Very high	82.6	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-68.4	-29	-179.8	-66	174.5	0	0	0	113	K320 T321 A322 S323 H327 L328 L347 E350 I362 F363 I366	K320-L325 HydrophobicContact CB-CD2 3.97Å; K320-L325 HydrophobicContact CB-CG 4.14Å; T321-L325 VanDerWaalsContact O-CG 3.31Å; T321-L325 WeakPolarHBondContact O-CG 3.38Å; T321-L325 PolarHBondContact O-N 2.97Å; A322-L325 PolarHBondContact O-N 3.42Å; S323-L325 PolarHBondContact O-N 3.14Å; L325-H327 PolarHBondContact O-N 3.1Å; L325-L328 HydrophobicContact CD2-CD1 4.25Å; L325-L328 WeakPolarHBondContact O-CB 3.45Å; L325-L328 PolarHBondContact O-N 3.13Å; L325-L328 VanDerWaalsContact O-N 3.12Å; L325-L347 HydrophobicContact CD2-CD2 4.22Å; L325-E350 HydrophobicContact CD2-CB 4.09Å; L325-E350 HydrophobicContact CD2-CG 3.75Å; L325-I362 HydrophobicContact CD1-CD1 4.38Å; L325-F363 HydrophobicContact CD1-CD1 4.43Å; L325-F363 HydrophobicContact CD1-CE1 3.79Å; L325-F363 HydrophobicContact CD1-CZ 4.36Å; L325-I366 HydrophobicContact CB-CD1 3.67Å; L325-I366 HydrophobicContact CD1-CD1 4.36Å
326	Q	92.9	Very high	84.4	Confident	100 Å²	100	41.6 Å²	41.6	47%	0.467	23%	0.232	S	C	.	.	H	α-helix	trans	-61.9	-29.4	176.6	-78.1	172.9	-11.2	0	0	112.5	A322 S323 D324 L328 L329 I366	A322-Q326 WeakPolarHBondContact O-CG 3.47Å; A322-Q326 PolarHBondContact O-N 3.37Å; A322-Q326 VanDerWaalsContact O-N 3.1Å; S323-Q326 PolarHBondContact O-N 3.18Å; D324-Q326 VanDerWaalsContact C-N 3.31Å; D324-Q326 PolarHBondContact O-N 3.17Å; Q326-L328 PolarHBondContact O-N 3.12Å; Q326-L329 HydrophobicContact CB-CD1 4.5Å; Q326-L329 HydrophobicContact CG-CD1 4.38Å; Q326-L329 WeakPolarHBondContact O-CG 3.15Å; Q326-L329 PolarHBondContact O-N 3.09Å; Q326-I366 HydrophobicContact CG-CB 3.83Å; Q326-I366 HydrophobicContact CG-CG2 3.76Å
327	H	92.2	Very high	86.1	Confident	72 Å²	72	43.4 Å²	43.4	33%	0.333	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-15.7	176.7	-69	-83.1	0	0	0	113.6	M233 Y234 S323 D324 L325 P330	M233-H327 PolarHBondContact O-ND1 3.13Å; Y234-H327 AromaticContact CD1-CE1 3.81Å; Y234-H327 AromaticContact CD1-NE2 3.53Å; Y234-H327 AromaticContact CE1-CD2 3.54Å; Y234-H327 AromaticContact CE1-NE2 3.44Å; Y234-H327 WeakPolarHBondContact CE1-NE2 3.31Å; S323-H327 PolarHBondContact O-CD2 3.45Å; D324-H327 PolarHBondContact O-N 3.33Å; L325-H327 PolarHBondContact O-N 3.1Å; H327-P330 WeakPolarHBondContact O-CD 3.37Å
328	L	94.2	Very high	87.8	Confident	4 Å²	4	42.4 Å²	42.4	2%	0.021	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-19.8	176.8	-59	176.9	0	0	0	113.1	L270 L325 Q326 L331 L332 A343 Y346 L347	L270-L328 HydrophobicContact CD1-CD2 4.13Å; L325-L328 HydrophobicContact CD2-CD1 4.25Å; L325-L328 WeakPolarHBondContact O-CB 3.45Å; L325-L328 PolarHBondContact O-N 3.13Å; L325-L328 VanDerWaalsContact O-N 3.12Å; Q326-L328 PolarHBondContact O-N 3.12Å; L328-L331 HydrophobicContact CD2-CD1 4.37Å; L328-L331 WeakPolarHBondContact O-CB 3.44Å; L328-L331 PolarHBondContact O-N 2.91Å; L328-L331 VanDerWaalsContact O-N 3.11Å; L328-L332 PolarHBondContact O-N 3.1Å; L328-A343 HydrophobicContact CB-CB 4.42Å; L328-Y346 HydrophobicContact CD1-CD1 3.73Å; L328-Y346 HydrophobicContact CD1-CE1 4.45Å; L328-Y346 HydrophobicContact CD1-CG 3.98Å; L328-Y346 HydrophobicContact CD2-CD1 3.87Å; L328-Y346 HydrophobicContact CG-CD1 4.44Å; L328-L347 HydrophobicContact CD1-CD2 4.22Å; L328-L347 HydrophobicContact CD1-CG 4.34Å
329	L	93.6	Very high	89.2	Confident	28 Å²	28	40.8 Å²	40.8	15%	0.147	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-41.9	-175.6	-57.4	174.8	0	0	0	113.4	Q326 L331 L332 D333 I366 A368	Q326-L329 HydrophobicContact CB-CD1 4.5Å; Q326-L329 HydrophobicContact CG-CD1 4.38Å; Q326-L329 WeakPolarHBondContact O-CG 3.15Å; Q326-L329 PolarHBondContact O-N 3.09Å; L329-L331 PolarHBondContact O-N 3.14Å; L329-L331 VanDerWaalsContact O-N 3.17Å; L329-L332 HydrophobicContact CD2-CD1 3.98Å; L329-L332 PolarHBondContact O-N 2.99Å; L329-L332 VanDerWaalsContact O-N 3.1Å; L329-D333 PolarHBondContact O-N 3.21Å; L329-I366 WeakPolarHBondContact CD1-O 3.42Å; L329-A368 HydrophobicContact CD2-CB 3.82Å
330	P	92.8	Very high	90.2	Very high	82 Å²	82	41.3 Å²	41.3	53%	0.532	23%	0.233	S	C	.	.	H	α-helix	trans	-58	-28.9	175.1	-25.5	36.1	0	0	0	113.6	H327 G334	H327-P330 WeakPolarHBondContact O-CD 3.37Å; P330-G334 WeakPolarHBondContact O-CA 3.27Å; P330-G334 PolarHBondContact O-N 3.03Å
331	L	94.8	Very high	90.8	Very high	6 Å²	6	39.2 Å²	39.2	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-74.6	-39.1	176.8	-57.7	-179.5	0	0	0	112	L270 V274 A277 L328 L329 G334 G339 I342 A343	L270-L331 HydrophobicContact CD1-CD1 4.13Å; V274-L331 HydrophobicContact CG2-CD1 3.86Å; V274-L331 HydrophobicContact CG2-CD2 4.23Å; V274-L331 HydrophobicContact CG2-CG 4.5Å; A277-L331 HydrophobicContact CB-CD2 3.74Å; L328-L331 HydrophobicContact CD2-CD1 4.37Å; L328-L331 WeakPolarHBondContact O-CB 3.44Å; L328-L331 PolarHBondContact O-N 2.91Å; L328-L331 VanDerWaalsContact O-N 3.11Å; L329-L331 PolarHBondContact O-N 3.14Å; L329-L331 VanDerWaalsContact O-N 3.17Å; L331-G334 PolarHBondContact O-N 3.48Å; L331-G339 CarbonylContact O-C 3.55Å; L331-I342 HydrophobicContact CD1-CG2 4.45Å; L331-A343 HydrophobicContact CB-CB 3.66Å; L331-A343 HydrophobicContact CD1-CB 4.25Å
332	L	93.1	Very high	91.5	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-66.5	-44.2	176.5	-63.8	167.4	0	0	0	111.9	L328 L329 G334 K340 A343 A344 L347 L372 I375	L328-L332 PolarHBondContact O-N 3.1Å; L329-L332 HydrophobicContact CD2-CD1 3.98Å; L329-L332 PolarHBondContact O-N 2.99Å; L329-L332 VanDerWaalsContact O-N 3.1Å; L332-G334 VanDerWaalsContact C-N 3.26Å; L332-K340 WeakPolarHBondContact O-CE 3.48Å; L332-A343 HydrophobicContact CD2-CB 3.57Å; L332-A343 HydrophobicContact CG-CB 3.77Å; L332-A344 HydrophobicContact CD2-CB 4.21Å; L332-L347 HydrophobicContact CD1-CD1 3.32Å; L332-L347 HydrophobicContact CD2-CD1 4.33Å; L332-L347 HydrophobicContact CG-CD1 4.35Å; L332-L372 HydrophobicContact CD2-CD2 4.18Å; L332-I375 HydrophobicContact CB-CD1 4.15Å; L332-I375 HydrophobicContact CD2-CD1 3.61Å; L332-I375 HydrophobicContact CG-CD1 4.49Å
333	D	89.9	Confident	92	Very high	66 Å²	66	35.7 Å²	35.7	35%	0.353	20%	0.198	S	C	.	.	S	Bend	trans	-83.9	-4	-179.1	-72.6	-51.1	0	0	0	112.7	L329 S371 R374	L329-D333 PolarHBondContact O-N 3.21Å; D333-S371 VanDerWaalsContact CG-OG 3.31Å; D333-S371 PolarHBondContact OD1-OG 3.06Å; D333-S371 PolarHBondContact OD2-OG 3.26Å; D333-R374 IonicContact OD1-CZ 3.62Å; D333-R374 IonicContact OD1-NH1 3.97Å; D333-R374 PolarHBondContact OD1-NH1 2.9Å; D333-R374 IonicContact OD2-NH1 2.79Å
334	G	87.2	Confident	92.5	Very high	23 Å²	23	32.7 Å²	32.7	24%	0.237	18%	0.177	C	C	.	.	S	Bend	trans	-66.2	173.7	176.2	0	0	0	0	0	113.8	P330 L331 L332 K340	P330-G334 WeakPolarHBondContact O-CA 3.27Å; P330-G334 PolarHBondContact O-N 3.03Å; L331-G334 PolarHBondContact O-N 3.48Å; L332-G334 VanDerWaalsContact C-N 3.26Å; G334-K340 WeakPolarHBondContact O-CE 3.41Å; G334-K340 PolarHBondContact O-NZ 3.41Å; G334-K340 VanDerWaalsContact O-NZ 3.17Å
335	T	84.3	Confident	92.9	Very high	92 Å²	92	32 Å²	32	56%	0.564	17%	0.174	S	C	*	.	S	Bend	trans	-87.3	-28.3	177.8	49.7	0	0	0	0	112.7	P494	T335-P494 HydrophobicContact CG2-CB 4.28Å
336	R	88.7	Confident	93.1	Very high	84 Å²	84	32.4 Å²	32.4	32%	0.317	18%	0.175	S	C	.	.			trans	-74.3	139.7	-174.4	-69.5	-71	-179.9	171.1	-2.7	112.6	E282 K340	E282-R336 IonicContact OE1-CZ 2.71Å; E282-R336 IonicContact OE1-NE 2.61Å; E282-R336 PolarHBondContact OE1-NE 3.18Å; E282-R336 IonicContact OE1-NH2 2.76Å; E282-R336 PolarHBondContact OE1-NH2 3.33Å; R336-K340 WeakPolarHBondContact O-CG 3.28Å; R336-K340 PolarHBondContact O-N 3.16Å
337	V	91.5	Very high	93.2	Very high	54 Å²	54	27.7 Å²	27.7	33%	0.327	15%	0.153	S	C	.	.	H	α-helix	trans	-73.3	-39.9	179.9	175.6	0	0	0	0	110.2	E295 G339 K340 C341 N381	E295-V337 HydrophobicContact CG-CG1 4.46Å; V337-G339 VanDerWaalsContact C-N 3.33Å; V337-G339 PolarHBondContact O-N 3.44Å; V337-K340 WeakPolarHBondContact O-CB 3.37Å; V337-K340 PolarHBondContact O-N 3.26Å; V337-K340 VanDerWaalsContact O-N 3.12Å; V337-C341 WeakPolarHBondContact O-CB 3.46Å; V337-C341 PolarHBondContact O-N 3.44Å; V337-C341 PolarHBondContact O-SG 3.39Å; V337-N381 HydrophobicContact CG1-CB 3.76Å; V337-N381 WeakPolarHBondContact CG1-ND2 3.3Å
338	E	94.4	Very high	93.3	Very high	40 Å²	40	24.2 Å²	24.2	19%	0.187	14%	0.137	C	C	.	.	H	α-helix	trans	-57.3	-46.4	179.3	-57.7	84	170.4	0	0	110.9	T273 L291 V294 C341 I342	T273-E338 HydrophobicContact CG2-CB 3.9Å; L291-E338 HydrophobicContact CB-CG 4.45Å; L291-E338 HydrophobicContact CD2-CB 4.23Å; L291-E338 HydrophobicContact CD2-CG 4.37Å; V294-E338 HydrophobicContact CB-CB 4.02Å; V294-E338 HydrophobicContact CB-CG 4.23Å; V294-E338 HydrophobicContact CG1-CB 4.01Å; V294-E338 HydrophobicContact CG2-CB 4.49Å; E338-C341 PolarHBondContact O-N 3.06Å; E338-I342 WeakPolarHBondContact O-CG2 3.49Å; E338-I342 PolarHBondContact O-N 2.83Å; E338-I342 VanDerWaalsContact O-N 3.09Å
339	G	94.7	Very high	93.2	Very high	6 Å²	6	24 Å²	24	6%	0.062	14%	0.136	C	C	.	.	H	α-helix	trans	-62.4	-43.3	175.2	0	0	0	0	0	112.8	L331 V337 I342 A343	L331-G339 CarbonylContact O-C 3.55Å; V337-G339 VanDerWaalsContact C-N 3.33Å; V337-G339 PolarHBondContact O-N 3.44Å; G339-I342 WeakPolarHBondContact O-CG2 3.48Å; G339-A343 WeakPolarHBondContact O-CB 3.36Å; G339-A343 PolarHBondContact O-N 2.97Å
340	K	95.3	Very high	93.1	Very high	13 Å²	13	22.9 Å²	22.9	6%	0.057	13%	0.13	C	C	.	.	H	α-helix	trans	-63.4	-44.4	176	-72.2	176.6	-176.2	176	0	112.2	L332 G334 R336 V337 A344 I375 A384 Y474	L332-K340 WeakPolarHBondContact O-CE 3.48Å; G334-K340 WeakPolarHBondContact O-CE 3.41Å; G334-K340 PolarHBondContact O-NZ 3.41Å; G334-K340 VanDerWaalsContact O-NZ 3.17Å; R336-K340 WeakPolarHBondContact O-CG 3.28Å; R336-K340 PolarHBondContact O-N 3.16Å; V337-K340 WeakPolarHBondContact O-CB 3.37Å; V337-K340 PolarHBondContact O-N 3.26Å; V337-K340 VanDerWaalsContact O-N 3.12Å; K340-A344 WeakPolarHBondContact O-CB 3.37Å; K340-A344 PolarHBondContact O-N 2.64Å; K340-I375 HydrophobicContact CB-CD1 4.35Å; K340-I375 HydrophobicContact CD-CG1 4.43Å; K340-I375 HydrophobicContact CG-CD1 4.3Å; K340-A384 HydrophobicContact CB-CB 4.25Å; K340-Y474 PolarHBondContact NZ-OH 3.1Å
341	C	95.8	Very high	93	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60.7	-53.4	-179.8	-73.2	0	0	0	0	111.2	I298 V337 E338 A344 F345	I298-C341 HydrophobicContact CB-CB 4.48Å; I298-C341 HydrophobicContact CG2-CB 4.21Å; V337-C341 WeakPolarHBondContact O-CB 3.46Å; V337-C341 PolarHBondContact O-N 3.44Å; V337-C341 PolarHBondContact O-SG 3.39Å; E338-C341 PolarHBondContact O-N 3.06Å; C341-A344 PolarHBondContact O-N 3.41Å; C341-F345 VanDerWaalsContact O-CB 3.3Å; C341-F345 WeakPolarHBondContact O-CB 3.36Å; C341-F345 PolarHBondContact O-N 2.81Å
342	I	96.3	Very high	92.7	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-68.1	-39	-176.6	-164.8	155.5	0	0	0	112.4	F266 C269 L270 T273 V294 I298 L331 E338 G339 F345 Y346	F266-I342 HydrophobicContact CD2-CD1 4.38Å; F266-I342 HydrophobicContact CD2-CG1 4.42Å; F266-I342 HydrophobicContact CE2-CD1 4.16Å; F266-I342 HydrophobicContact CE2-CG1 3.77Å; F266-I342 HydrophobicContact CZ-CG1 4.29Å; C269-I342 VanDerWaalsContact C-CD1 3.47Å; C269-I342 HydrophobicContact CB-CD1 3.54Å; L270-I342 HydrophobicContact CB-CD1 3.93Å; L270-I342 HydrophobicContact CD1-CD1 4.5Å; L270-I342 HydrophobicContact CD1-CG1 4.45Å; T273-I342 HydrophobicContact CG2-CG2 3.94Å; T273-I342 WeakPolarHBondContact OG1-CG2 3.33Å; V294-I342 HydrophobicContact CG1-CB 4.35Å; I298-I342 HydrophobicContact CD1-CB 4.34Å; I298-I342 HydrophobicContact CD1-CD1 4.31Å; I298-I342 HydrophobicContact CD1-CG1 4.01Å; I298-I342 HydrophobicContact CG1-CB 4.34Å; L331-I342 HydrophobicContact CD1-CG2 4.45Å; E338-I342 WeakPolarHBondContact O-CG2 3.49Å; E338-I342 PolarHBondContact O-N 2.83Å; E338-I342 VanDerWaalsContact O-N 3.09Å; G339-I342 WeakPolarHBondContact O-CG2 3.48Å; I342-F345 PolarHBondContact O-N 3.5Å; I342-Y346 WeakPolarHBondContact O-CB 3.28Å; I342-Y346 PolarHBondContact O-N 3.34Å
343	A	96.3	Very high	92.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-71.3	-39.1	179.2	0	0	0	0	0	112	L328 L331 L332 G339 Y346 L347	L328-A343 HydrophobicContact CB-CB 4.42Å; L331-A343 HydrophobicContact CB-CB 3.66Å; L331-A343 HydrophobicContact CD1-CB 4.25Å; L332-A343 HydrophobicContact CD2-CB 3.57Å; L332-A343 HydrophobicContact CG-CB 3.77Å; G339-A343 WeakPolarHBondContact O-CB 3.36Å; G339-A343 PolarHBondContact O-N 2.97Å; A343-Y346 PolarHBondContact O-N 2.88Å; A343-L347 WeakPolarHBondContact O-CB 3.47Å; A343-L347 WeakPolarHBondContact O-CG 3.47Å; A343-L347 PolarHBondContact O-N 3.01Å
344	A	96.6	Very high	92.2	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.9	-39.9	173.9	0	0	0	0	0	111.4	L332 K340 C341 C348 L372 L387	L332-A344 HydrophobicContact CD2-CB 4.21Å; K340-A344 WeakPolarHBondContact O-CB 3.37Å; K340-A344 PolarHBondContact O-N 2.64Å; C341-A344 PolarHBondContact O-N 3.41Å; A344-C348 VanDerWaalsContact O-CB 3.28Å; A344-C348 WeakPolarHBondContact O-CB 3.39Å; A344-C348 PolarHBondContact O-N 3.04Å; A344-L372 HydrophobicContact CB-CD2 4.38Å; A344-L387 HydrophobicContact CB-CB 4.03Å
345	F	96.2	Very high	92.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.1	-50.3	173.1	180	-91.9	0	0	0	111.1	F266 I298 L301 P303 F306 C341 I342 L347 C348 V349 L387	F266-F345 HydrophobicContact CD2-CD1 4.19Å; F266-F345 HydrophobicContact CD2-CE1 4.1Å; F266-F345 AromaticContact CE2-CD1 3.52Å; F266-F345 HydrophobicContact CE2-CD1 3.52Å; F266-F345 AromaticContact CE2-CE1 3.81Å; F266-F345 HydrophobicContact CE2-CE1 3.81Å; F266-F345 HydrophobicContact CZ-CD1 4.27Å; I298-F345 HydrophobicContact CD1-CB 4.36Å; I298-F345 HydrophobicContact CD1-CD1 4.25Å; I298-F345 HydrophobicContact CD1-CG 4.22Å; I298-F345 HydrophobicContact CG2-CB 3.74Å; I298-F345 HydrophobicContact CG2-CD2 4.04Å; I298-F345 HydrophobicContact CG2-CG 4.06Å; L301-F345 HydrophobicContact CB-CE2 3.55Å; L301-F345 HydrophobicContact CB-CZ 3.7Å; L301-F345 HydrophobicContact CD1-CE1 4.02Å; L301-F345 HydrophobicContact CD1-CE2 4.1Å; L301-F345 HydrophobicContact CD1-CZ 3.59Å; L301-F345 HydrophobicContact CG-CZ 4.33Å; P303-F345 HydrophobicContact CB-CE2 4.33Å; P303-F345 HydrophobicContact CG-CD2 3.92Å; P303-F345 HydrophobicContact CG-CE2 3.78Å; F306-F345 HydrophobicContact CB-CE1 4.31Å; F306-F345 HydrophobicContact CB-CZ 3.76Å; F306-F345 AromaticContact CD1-CE1 3.63Å; F306-F345 HydrophobicContact CD1-CE1 3.63Å; F306-F345 AromaticContact CD1-CZ 3.98Å; F306-F345 HydrophobicContact CD1-CZ 3.98Å; F306-F345 HydrophobicContact CD2-CE1 4.48Å; F306-F345 HydrophobicContact CD2-CZ 4.34Å; F306-F345 AromaticContact CE1-CE1 3.98Å; F306-F345 HydrophobicContact CE1-CE1 3.98Å; F306-F345 AromaticContact CG-CE1 3.89Å; F306-F345 HydrophobicContact CG-CE1 3.89Å; F306-F345 AromaticContact CG-CZ 3.78Å; F306-F345 HydrophobicContact CG-CZ 3.78Å; C341-F345 VanDerWaalsContact O-CB 3.3Å; C341-F345 WeakPolarHBondContact O-CB 3.36Å; C341-F345 PolarHBondContact O-N 2.81Å; I342-F345 PolarHBondContact O-N 3.5Å; F345-L347 PolarHBondContact O-N 2.99Å; F345-C348 WeakPolarHBondContact O-CA 3.31Å; F345-C348 VanDerWaalsContact O-CB 3.27Å; F345-C348 WeakPolarHBondContact O-CB 3.2Å; F345-C348 PolarHBondContact O-N 3.35Å; F345-V349 HydrophobicContact CD1-CG2 4.05Å; F345-V349 HydrophobicContact CE1-CG2 3.69Å; F345-V349 HydrophobicContact CZ-CG2 3.97Å; F345-V349 WeakPolarHBondContact O-CG2 3.37Å; F345-V349 PolarHBondContact O-N 3.49Å; F345-L387 HydrophobicContact CB-CD1 3.85Å; F345-L387 HydrophobicContact CB-CD2 4.5Å; F345-L387 HydrophobicContact CD2-CD1 4.37Å; F345-L387 HydrophobicContact CD2-CD2 3.95Å
346	Y	94.6	Very high	91.9	Very high	10 Å²	10	20.9 Å²	20.9	4%	0.039	10%	0.099	C	C	.	.	H	α-helix	trans	-64.4	-42.2	-177	-158.5	176.8	0	0	0	111.7	F266 L270 K320 L328 I342 A343 C348 V349 E350	F266-Y346 HydrophobicContact CE1-CD1 4.09Å; F266-Y346 HydrophobicContact CE1-CD2 4.44Å; F266-Y346 HydrophobicContact CE1-CE1 4.13Å; F266-Y346 HydrophobicContact CE1-CE2 4.49Å; F266-Y346 HydrophobicContact CE1-CG 4.25Å; F266-Y346 AromaticContact CZ-CD1 3.82Å; F266-Y346 HydrophobicContact CZ-CD1 3.82Å; F266-Y346 HydrophobicContact CZ-CD2 4.12Å; F266-Y346 HydrophobicContact CZ-CE1 4.33Å; F266-Y346 AromaticContact CZ-CG 3.71Å; F266-Y346 HydrophobicContact CZ-CG 3.71Å; L270-Y346 HydrophobicContact CD2-CD1 4.29Å; L270-Y346 HydrophobicContact CD2-CE1 4.02Å; K320-Y346 WeakPolarHBondContact CE-OH 3.39Å; L328-Y346 HydrophobicContact CD1-CD1 3.73Å; L328-Y346 HydrophobicContact CD1-CE1 4.45Å; L328-Y346 HydrophobicContact CD1-CG 3.98Å; L328-Y346 HydrophobicContact CD2-CD1 3.87Å; L328-Y346 HydrophobicContact CG-CD1 4.44Å; I342-Y346 WeakPolarHBondContact O-CB 3.28Å; I342-Y346 PolarHBondContact O-N 3.34Å; A343-Y346 PolarHBondContact O-N 2.88Å; Y346-C348 VanDerWaalsContact C-N 3.3Å; Y346-C348 PolarHBondContact O-N 3.15Å; Y346-V349 WeakPolarHBondContact O-CB 3.32Å; Y346-V349 PolarHBondContact O-N 3.31Å; Y346-E350 HydrophobicContact CD2-CG 3.92Å; Y346-E350 HydrophobicContact CE2-CG 3.91Å; Y346-E350 WeakPolarHBondContact O-CB 3.29Å; Y346-E350 WeakPolarHBondContact O-CG 3.26Å; Y346-E350 PolarHBondContact O-N 3.3Å
347	L	94.4	Very high	91.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.1	-36	172.6	-75.6	-178.9	0	0	0	112.6	L325 L328 L332 A343 F345 E350 T351 F363 A368 L372	L325-L347 HydrophobicContact CD2-CD2 4.22Å; L328-L347 HydrophobicContact CD1-CD2 4.22Å; L328-L347 HydrophobicContact CD1-CG 4.34Å; L332-L347 HydrophobicContact CD1-CD1 3.32Å; L332-L347 HydrophobicContact CD2-CD1 4.33Å; L332-L347 HydrophobicContact CG-CD1 4.35Å; A343-L347 WeakPolarHBondContact O-CB 3.47Å; A343-L347 WeakPolarHBondContact O-CG 3.47Å; A343-L347 PolarHBondContact O-N 3.01Å; F345-L347 PolarHBondContact O-N 2.99Å; L347-E350 PolarHBondContact O-N 3.22Å; L347-T351 VanDerWaalsContact O-CB 3.26Å; L347-T351 WeakPolarHBondContact O-CB 3.29Å; L347-T351 PolarHBondContact O-N 2.92Å; L347-T351 PolarHBondContact O-OG1 3.33Å; L347-F363 HydrophobicContact CD2-CD1 4.05Å; L347-F363 HydrophobicContact CD2-CE1 3.87Å; L347-A368 HydrophobicContact CD1-CB 3.9Å; L347-L372 HydrophobicContact CD1-CD1 4.35Å; L347-L372 HydrophobicContact CD1-CD2 4.24Å; L347-L372 HydrophobicContact CD1-CG 4.38Å
348	C	94.4	Very high	91	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.5	-47	175.2	-170.5	0	0	0	0	111	P303 A344 F345 Y346 T351 S352 A391 M394	P303-C348 HydrophobicContact CB-CB 4.27Å; P303-C348 HydrophobicContact CG-CB 4.33Å; A344-C348 VanDerWaalsContact O-CB 3.28Å; A344-C348 WeakPolarHBondContact O-CB 3.39Å; A344-C348 PolarHBondContact O-N 3.04Å; F345-C348 WeakPolarHBondContact O-CA 3.31Å; F345-C348 VanDerWaalsContact O-CB 3.27Å; F345-C348 WeakPolarHBondContact O-CB 3.2Å; F345-C348 PolarHBondContact O-N 3.35Å; Y346-C348 VanDerWaalsContact C-N 3.3Å; Y346-C348 PolarHBondContact O-N 3.15Å; C348-T351 PolarHBondContact O-N 3.29Å; C348-S352 PolarHBondContact O-N 3.01Å; C348-A391 HydrophobicContact CB-CB 4.19Å; C348-M394 HydrophobicContact CB-CE 4.46Å; C348-M394 VanDerWaalsContact O-CE 3.26Å; C348-M394 WeakPolarHBondContact O-CE 3.46Å; C348-M394 WeakPolarHBondContact SG-CE 3.22Å
349	V	92.3	Very high	90.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.4	-51.7	175.1	169.6	0	0	0	0	111.1	P303 F306 A307 L310 F345 Y346 T351 S352 I353	P303-V349 HydrophobicContact CB-CG2 4.04Å; F306-V349 HydrophobicContact CB-CG2 4.43Å; F306-V349 HydrophobicContact CD1-CG1 4.27Å; F306-V349 HydrophobicContact CD1-CG2 3.92Å; A307-V349 HydrophobicContact CB-CG1 3.98Å; L310-V349 HydrophobicContact CD1-CG1 3.41Å; L310-V349 VanDerWaalsContact CD1-CG1 3.41Å; F345-V349 HydrophobicContact CD1-CG2 4.05Å; F345-V349 HydrophobicContact CE1-CG2 3.69Å; F345-V349 HydrophobicContact CZ-CG2 3.97Å; F345-V349 WeakPolarHBondContact O-CG2 3.37Å; F345-V349 PolarHBondContact O-N 3.49Å; Y346-V349 WeakPolarHBondContact O-CB 3.32Å; Y346-V349 PolarHBondContact O-N 3.31Å; V349-T351 VanDerWaalsContact C-N 3.27Å; V349-T351 PolarHBondContact O-N 3.46Å; V349-S352 WeakPolarHBondContact O-CB 3.42Å; V349-S352 PolarHBondContact O-N 2.92Å; V349-S352 VanDerWaalsContact O-N 3.08Å; V349-I353 HydrophobicContact CG1-CD1 4.38Å; V349-I353 PolarHBondContact O-N 3.39Å; V349-I353 VanDerWaalsContact O-N 3.14Å
350	E	91.1	Very high	90.2	Very high	3 Å²	3	32.3 Å²	32.3	1%	0.014	15%	0.146	C	C	.	.	H	α-helix	trans	-63.6	-34.9	179.9	-73.3	-72.9	160.1	0	0	111.8	G319 K320 L325 Y346 L347 S352 I353 K354 F363	G319-E350 WeakPolarHBondContact CA-OE2 3.16Å; K320-E350 WeakPolarHBondContact CG-OE1 3.45Å; K320-E350 PolarHBondContact N-OE1 2.86Å; K320-E350 PolarHBondContact N-OE2 2.83Å; L325-E350 HydrophobicContact CD2-CB 4.09Å; L325-E350 HydrophobicContact CD2-CG 3.75Å; Y346-E350 HydrophobicContact CD2-CG 3.92Å; Y346-E350 HydrophobicContact CE2-CG 3.91Å; Y346-E350 WeakPolarHBondContact O-CB 3.29Å; Y346-E350 WeakPolarHBondContact O-CG 3.26Å; Y346-E350 PolarHBondContact O-N 3.3Å; L347-E350 PolarHBondContact O-N 3.22Å; E350-S352 VanDerWaalsContact C-N 3.34Å; E350-S352 PolarHBondContact O-N 3.46Å; E350-I353 PolarHBondContact O-N 2.86Å; E350-K354 WeakPolarHBondContact O-CB 3.46Å; E350-K354 VanDerWaalsContact O-CG 3.29Å; E350-K354 WeakPolarHBondContact O-CG 3.07Å; E350-K354 PolarHBondContact O-N 3.45Å; E350-F363 HydrophobicContact CB-CE1 4.29Å; E350-F363 HydrophobicContact CB-CZ 4.07Å
351	T	91.3	Very high	89.8	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-40.2	174.2	-56.3	0	0	0	0	111.1	L347 C348 V349 I353 K354 S355 F363 M394 M395	L347-T351 VanDerWaalsContact O-CB 3.26Å; L347-T351 WeakPolarHBondContact O-CB 3.29Å; L347-T351 PolarHBondContact O-N 2.92Å; L347-T351 PolarHBondContact O-OG1 3.33Å; C348-T351 PolarHBondContact O-N 3.29Å; V349-T351 VanDerWaalsContact C-N 3.27Å; V349-T351 PolarHBondContact O-N 3.46Å; T351-I353 VanDerWaalsContact C-N 3.32Å; T351-I353 PolarHBondContact O-N 2.93Å; T351-K354 PolarHBondContact O-N 3.11Å; T351-S355 WeakPolarHBondContact O-CB 3.33Å; T351-S355 PolarHBondContact O-N 3.24Å; T351-F363 HydrophobicContact CG2-CE2 4.3Å; T351-M394 HydrophobicContact CG2-CB 3.57Å; T351-M394 HydrophobicContact CG2-CE 4.19Å; T351-M395 HydrophobicContact CG2-CE 4.13Å; T351-M395 HydrophobicContact CG2-CG 3.63Å; T351-M395 WeakPolarHBondContact OG1-CE 3.33Å
352	S	88.7	Confident	89.6	Confident	10 Å²	10	39.4 Å²	39.4	7%	0.07	18%	0.177	C	C	.	.	H	α-helix	trans	-59.8	-43.1	174.6	-169.9	0	0	0	0	111.2	D304 C348 V349 E350 R356	D304-S352 WeakPolarHBondContact OD1-CB 3.41Å; D304-S352 PolarHBondContact OD1-OG 3.34Å; C348-S352 PolarHBondContact O-N 3.01Å; V349-S352 WeakPolarHBondContact O-CB 3.42Å; V349-S352 PolarHBondContact O-N 2.92Å; V349-S352 VanDerWaalsContact O-N 3.08Å; E350-S352 VanDerWaalsContact C-N 3.34Å; E350-S352 PolarHBondContact O-N 3.46Å; S352-R356 WeakPolarHBondContact O-CG 3.45Å; S352-R356 PolarHBondContact O-N 3.18Å
353	I	85.2	Confident	89.4	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-65.8	-51.9	176.7	-60.8	170.3	0	0	0	111.3	A307 L311 V349 E350 T351 S355 R356 Q357	A307-I353 HydrophobicContact CB-CG1 4.41Å; L311-I353 HydrophobicContact CD2-CG1 4.36Å; L311-I353 HydrophobicContact CD2-CG2 4.36Å; V349-I353 HydrophobicContact CG1-CD1 4.38Å; V349-I353 PolarHBondContact O-N 3.39Å; V349-I353 VanDerWaalsContact O-N 3.14Å; E350-I353 PolarHBondContact O-N 2.86Å; T351-I353 VanDerWaalsContact C-N 3.32Å; T351-I353 PolarHBondContact O-N 2.93Å; I353-S355 VanDerWaalsContact C-N 3.34Å; I353-S355 PolarHBondContact O-N 3.34Å; I353-R356 WeakPolarHBondContact O-CB 3.35Å; I353-R356 PolarHBondContact O-N 3.2Å; I353-Q357 PolarHBondContact O-N 3.38Å
354	K	86.2	Confident	89.1	Confident	14 Å²	14	45.4 Å²	45.4	6%	0.061	21%	0.205	C	C	.	.	H	α-helix	trans	-71	-26.5	-176.6	-62.6	-56.3	-177.6	-174	0	113.4	Q318 K320 E350 T351 Q357 R358 N359 F363	Q318-K354 PolarHBondContact O-NZ 3.4Å; K320-K354 VanDerWaalsContact O-CE 3.27Å; K320-K354 WeakPolarHBondContact O-CE 3.48Å; K320-K354 PolarHBondContact O-NZ 3.02Å; E350-K354 WeakPolarHBondContact O-CB 3.46Å; E350-K354 VanDerWaalsContact O-CG 3.29Å; E350-K354 WeakPolarHBondContact O-CG 3.07Å; E350-K354 PolarHBondContact O-N 3.45Å; T351-K354 PolarHBondContact O-N 3.11Å; K354-Q357 VanDerWaalsContact CD-OE1 3.29Å; K354-Q357 CarbonylContact O-C 3.51Å; K354-Q357 PolarHBondContact O-N 3.13Å; K354-R358 PolarHBondContact O-N 3.34Å; K354-N359 PolarHBondContact O-N 3.02Å; K354-F363 HydrophobicContact CB-CE2 3.86Å; K354-F363 HydrophobicContact CB-CZ 4.26Å; K354-F363 HydrophobicContact CG-CE2 4.01Å; K354-F363 HydrophobicContact CG-CZ 3.95Å
355	S	85.4	Confident	88.9	Confident	54 Å²	54	52.6 Å²	52.6	38%	0.378	24%	0.239	S	C	.	.	H	α-helix	trans	-63.3	-42.5	172.6	-177.6	0	0	0	0	111.1	T351 I353 Q357 R358	T351-S355 WeakPolarHBondContact O-CB 3.33Å; T351-S355 PolarHBondContact O-N 3.24Å; I353-S355 VanDerWaalsContact C-N 3.34Å; I353-S355 PolarHBondContact O-N 3.34Å; S355-Q357 PolarHBondContact O-N 3.43Å; S355-R358 PolarHBondContact O-N 2.97Å
356	R	81.6	Confident	88.7	Confident	147 Å²	147	53.3 Å²	53.3	56%	0.555	24%	0.243	S	C	*	.	H	α-helix	trans	-61.4	-31.9	172.7	-63.6	173.5	-171.1	-171.4	3.3	112.5	S352 I353 R358	S352-R356 WeakPolarHBondContact O-CG 3.45Å; S352-R356 PolarHBondContact O-N 3.18Å; I353-R356 WeakPolarHBondContact O-CB 3.35Å; I353-R356 PolarHBondContact O-N 3.2Å; R356-R358 VanDerWaalsContact C-N 3.34Å
357	Q	79.4	Confident	88.5	Confident	77 Å²	77	54.4 Å²	54.4	36%	0.36	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-3.2	176.8	-61.5	172.6	4.3	0	0	113.9	Q318 I353 K354 S355 N359	Q318-Q357 VanDerWaalsContact CA-NE2 3.32Å; Q318-Q357 PolarHBondContact O-NE2 3.17Å; I353-Q357 PolarHBondContact O-N 3.38Å; K354-Q357 VanDerWaalsContact CD-OE1 3.29Å; K354-Q357 CarbonylContact O-C 3.51Å; K354-Q357 PolarHBondContact O-N 3.13Å; S355-Q357 PolarHBondContact O-N 3.43Å; Q357-N359 PolarHBondContact O-N 2.94Å
358	R	81.8	Confident	88.6	Confident	234 Å²	234	54.4 Å²	54.4	88%	0.883	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	31.5	-172.9	-55.9	-177	176.8	-171.9	-1.5	114.1	K354 S355 R356	K354-R358 PolarHBondContact O-N 3.34Å; S355-R358 PolarHBondContact O-N 2.97Å; R356-R358 VanDerWaalsContact C-N 3.34Å
359	N	84	Confident	88.6	Confident	73 Å²	73	55 Å²	55	39%	0.39	26%	0.26	S	S	.	.			trans	-119.6	50.9	-180	-168.7	14.5	0	0	0	112.3	K354 Q357 K361 I362	K354-N359 PolarHBondContact O-N 3.02Å; Q357-N359 PolarHBondContact O-N 2.94Å; N359-K361 VanDerWaalsContact C-N 3.33Å; N359-I362 VanDerWaalsContact O-CG2 3.22Å; N359-I362 WeakPolarHBondContact O-CG2 3.32Å
360	T	86.9	Confident	88.5	Confident	40 Å²	40	59.2 Å²	59.2	25%	0.245	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-14.7	179.7	53.3	0	0	0	0	113.5	I362 F363	T360-I362 PolarHBondContact O-N 2.88Å; T360-F363 WeakPolarHBondContact O-CD2 3.3Å; T360-F363 PolarHBondContact O-N 2.69Å
361	K	88.4	Confident	88.6	Confident	148 Å²	148	59.3 Å²	59.3	64%	0.643	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-27.5	179	-66.1	-174.8	179.4	-178.8	0	113.1	N359 F363 Q364 E365	N359-K361 VanDerWaalsContact C-N 3.33Å; K361-F363 PolarHBondContact O-N 2.81Å; K361-F363 VanDerWaalsContact O-N 3.15Å; K361-Q364 WeakPolarHBondContact O-CB 3.38Å; K361-Q364 PolarHBondContact O-N 3.02Å; K361-E365 PolarHBondContact O-N 3.27Å; K361-E365 VanDerWaalsContact O-N 3.09Å
362	I	90.3	Very high	88.8	Confident	13 Å²	13	59.3 Å²	59.3	7%	0.067	28%	0.281	C	S	.	.	H	α-helix	trans	-51.8	-36.7	175.7	-164.6	172.4	0	0	0	112.8	A322 L325 N359 T360 Q364 E365 I366	A322-I362 HydrophobicContact CB-CD1 3.81Å; A322-I362 HydrophobicContact CB-CG1 3.9Å; L325-I362 HydrophobicContact CD1-CD1 4.38Å; N359-I362 VanDerWaalsContact O-CG2 3.22Å; N359-I362 WeakPolarHBondContact O-CG2 3.32Å; T360-I362 PolarHBondContact O-N 2.88Å; I362-Q364 VanDerWaalsContact C-N 3.31Å; I362-Q364 PolarHBondContact O-N 2.88Å; I362-E365 PolarHBondContact O-N 3.28Å; I362-I366 WeakPolarHBondContact O-CG1 3.44Å; I362-I366 WeakPolarHBondContact O-CG2 3.45Å; I362-I366 PolarHBondContact O-N 2.84Å
363	F	92.6	Very high	89.1	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-72	-26.9	-178.9	-61.9	-71.1	0	0	0	112.9	L325 L347 E350 T351 K354 T360 K361 I366 G367 A368 V369 M395	L325-F363 HydrophobicContact CD1-CD1 4.43Å; L325-F363 HydrophobicContact CD1-CE1 3.79Å; L325-F363 HydrophobicContact CD1-CZ 4.36Å; L347-F363 HydrophobicContact CD2-CD1 4.05Å; L347-F363 HydrophobicContact CD2-CE1 3.87Å; E350-F363 HydrophobicContact CB-CE1 4.29Å; E350-F363 HydrophobicContact CB-CZ 4.07Å; T351-F363 HydrophobicContact CG2-CE2 4.3Å; K354-F363 HydrophobicContact CB-CE2 3.86Å; K354-F363 HydrophobicContact CB-CZ 4.26Å; K354-F363 HydrophobicContact CG-CE2 4.01Å; K354-F363 HydrophobicContact CG-CZ 3.95Å; T360-F363 WeakPolarHBondContact O-CD2 3.3Å; T360-F363 PolarHBondContact O-N 2.69Å; K361-F363 PolarHBondContact O-N 2.81Å; K361-F363 VanDerWaalsContact O-N 3.15Å; F363-I366 HydrophobicContact CD1-CD1 4.19Å; F363-G367 PolarHBondContact O-N 2.89Å; F363-A368 HydrophobicContact CB-CB 4.47Å; F363-A368 PolarHBondContact O-N 2.9Å; F363-V369 HydrophobicContact CB-CG2 4.41Å; F363-V369 PolarHBondContact O-N 3.05Å; F363-M395 HydrophobicContact CB-CE 3.72Å; F363-M395 HydrophobicContact CB-SD 3.81Å; F363-M395 HydrophobicContact CD1-CE 3.83Å; F363-M395 HydrophobicContact CD2-CE 3.87Å; F363-M395 HydrophobicContact CD2-CG 4.28Å; F363-M395 HydrophobicContact CD2-SD 4.42Å; F363-M395 HydrophobicContact CE1-CE 4.42Å; F363-M395 HydrophobicContact CE2-CE 4.46Å; F363-M395 HydrophobicContact CG-CE 3.53Å; F363-M395 HydrophobicContact CG-SD 4.19Å
364	Q	90.9	Very high	89.4	Confident	126 Å²	126	63.7 Å²	63.7	59%	0.589	30%	0.297	S	S	*	.	H	α-helix	trans	-76.6	-42	173.2	-167.5	175	20.4	0	0	110.6	K361 I362 I366 G367 V369	K361-Q364 WeakPolarHBondContact O-CB 3.38Å; K361-Q364 PolarHBondContact O-N 3.02Å; I362-Q364 VanDerWaalsContact C-N 3.31Å; I362-Q364 PolarHBondContact O-N 2.88Å; Q364-I366 PolarHBondContact O-N 3.45Å; Q364-G367 PolarHBondContact O-N 3.45Å; Q364-G367 VanDerWaalsContact O-N 3.12Å; Q364-V369 HydrophobicContact CB-CG2 4.41Å
365	E	91.1	Very high	89.7	Confident	152 Å²	152	63.3 Å²	63.3	71%	0.71	30%	0.296	S	S	*	.	H	α-helix	trans	-62.5	-41.3	178.5	-69.1	172.6	-173.2	0	0	112.6	K361 I362 G367	K361-E365 PolarHBondContact O-N 3.27Å; K361-E365 VanDerWaalsContact O-N 3.09Å; I362-E365 PolarHBondContact O-N 3.28Å; E365-G367 VanDerWaalsContact C-N 3.27Å; E365-G367 PolarHBondContact O-N 3.31Å
366	I	92.8	Very high	90.2	Very high	15 Å²	15	60.8 Å²	60.8	8%	0.077	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-12.4	176	70.5	-178.3	0	0	0	113.1	A322 L325 Q326 L329 I362 F363 Q364 A368	A322-I366 HydrophobicContact CB-CG2 4.11Å; L325-I366 HydrophobicContact CB-CD1 3.67Å; L325-I366 HydrophobicContact CD1-CD1 4.36Å; Q326-I366 HydrophobicContact CG-CB 3.83Å; Q326-I366 HydrophobicContact CG-CG2 3.76Å; L329-I366 WeakPolarHBondContact CD1-O 3.42Å; I362-I366 WeakPolarHBondContact O-CG1 3.44Å; I362-I366 WeakPolarHBondContact O-CG2 3.45Å; I362-I366 PolarHBondContact O-N 2.84Å; F363-I366 HydrophobicContact CD1-CD1 4.19Å; Q364-I366 PolarHBondContact O-N 3.45Å; I366-A368 HydrophobicContact CD1-CB 3.92Å; I366-A368 HydrophobicContact CG1-CB 3.86Å
367	G	90.9	Very high	90.7	Very high	32 Å²	32	54.1 Å²	54.1	33%	0.33	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	10.1	-179.3	0	0	0	0	0	115.8	F363 Q364 E365 V369 Q370	F363-G367 PolarHBondContact O-N 2.89Å; Q364-G367 PolarHBondContact O-N 3.45Å; Q364-G367 VanDerWaalsContact O-N 3.12Å; E365-G367 VanDerWaalsContact C-N 3.27Å; E365-G367 PolarHBondContact O-N 3.31Å; G367-V369 VanDerWaalsContact C-N 3.3Å; G367-V369 PolarHBondContact O-N 3.11Å; G367-Q370 PolarHBondContact O-N 3.07Å
368	A	94.8	Very high	91.1	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-35.1	-179.4	0	0	0	0	0	112.9	L329 L347 F363 I366 Q370 S371 L372	L329-A368 HydrophobicContact CD2-CB 3.82Å; L347-A368 HydrophobicContact CD1-CB 3.9Å; F363-A368 HydrophobicContact CB-CB 4.47Å; F363-A368 PolarHBondContact O-N 2.9Å; I366-A368 HydrophobicContact CD1-CB 3.92Å; I366-A368 HydrophobicContact CG1-CB 3.86Å; A368-Q370 VanDerWaalsContact C-N 3.26Å; A368-Q370 PolarHBondContact O-N 2.81Å; A368-S371 PolarHBondContact O-N 2.86Å; A368-L372 WeakPolarHBondContact O-CG 3.45Å; A368-L372 PolarHBondContact O-N 3.42Å
369	V	94.5	Very high	91.4	Very high	12 Å²	12	41.4 Å²	41.4	7%	0.073	20%	0.204	C	C	.	.	H	α-helix	trans	-54.1	-43.7	179.6	174.6	0	0	0	0	111.3	F363 Q364 G367 L372 K373 L392 M395 E397	F363-V369 HydrophobicContact CB-CG2 4.41Å; F363-V369 PolarHBondContact O-N 3.05Å; Q364-V369 HydrophobicContact CB-CG2 4.41Å; G367-V369 VanDerWaalsContact C-N 3.3Å; G367-V369 PolarHBondContact O-N 3.11Å; V369-L372 PolarHBondContact O-N 3.24Å; V369-K373 HydrophobicContact CG1-CD 4.2Å; V369-K373 WeakPolarHBondContact O-CG 3.36Å; V369-K373 PolarHBondContact O-N 3.04Å; V369-L392 HydrophobicContact CG1-CD2 3.96Å; V369-M395 HydrophobicContact CG2-SD 3.87Å; V369-E397 HydrophobicContact CG1-CB 4.5Å; V369-E397 HydrophobicContact CG1-CG 3.78Å; V369-E397 HydrophobicContact CG2-CG 4.24Å
370	Q	91.1	Very high	91.3	Very high	89 Å²	89	42.5 Å²	42.5	42%	0.416	22%	0.217	S	C	.	.	H	α-helix	trans	-70.5	-39.6	-177.4	-168.5	61.8	23.5	0	0	111.9	G367 A368 K373 R374	G367-Q370 PolarHBondContact O-N 3.07Å; A368-Q370 VanDerWaalsContact C-N 3.26Å; A368-Q370 PolarHBondContact O-N 2.81Å; Q370-K373 PolarHBondContact O-N 3.45Å; Q370-R374 WeakPolarHBondContact O-CG 3.32Å; Q370-R374 PolarHBondContact O-N 2.93Å
371	S	93.8	Very high	91.5	Very high	6 Å²	6	41.9 Å²	41.9	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-65.9	-39.6	176.8	-52.1	0	0	0	0	111.1	D333 A368 R374 I375	D333-S371 VanDerWaalsContact CG-OG 3.31Å; D333-S371 PolarHBondContact OD1-OG 3.06Å; D333-S371 PolarHBondContact OD2-OG 3.26Å; A368-S371 PolarHBondContact O-N 2.86Å; S371-R374 WeakPolarHBondContact O-CB 3.33Å; S371-R374 PolarHBondContact O-N 3.24Å; S371-I375 WeakPolarHBondContact O-CG1 3.37Å; S371-I375 PolarHBondContact O-N 3.4Å
372	L	95.7	Very high	91.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.6	-44	173.4	-67.4	173.8	0	0	0	112.2	L332 A344 L347 A368 V369 R374 I375 V376 A388 A391 L392 M395	L332-L372 HydrophobicContact CD2-CD2 4.18Å; A344-L372 HydrophobicContact CB-CD2 4.38Å; L347-L372 HydrophobicContact CD1-CD1 4.35Å; L347-L372 HydrophobicContact CD1-CD2 4.24Å; L347-L372 HydrophobicContact CD1-CG 4.38Å; A368-L372 WeakPolarHBondContact O-CG 3.45Å; A368-L372 PolarHBondContact O-N 3.42Å; V369-L372 PolarHBondContact O-N 3.24Å; L372-R374 VanDerWaalsContact C-N 3.29Å; L372-R374 PolarHBondContact O-N 3.15Å; L372-I375 PolarHBondContact O-N 3.22Å; L372-I375 VanDerWaalsContact O-N 3.13Å; L372-V376 WeakPolarHBondContact O-CG2 3.45Å; L372-V376 PolarHBondContact O-N 3.38Å; L372-A388 HydrophobicContact CB-CB 4.41Å; L372-A388 HydrophobicContact CD2-CB 3.94Å; L372-A391 HydrophobicContact CD1-CB 3.92Å; L372-L392 HydrophobicContact CB-CD1 4.22Å; L372-L392 HydrophobicContact CB-CD2 3.97Å; L372-L392 HydrophobicContact CB-CG 3.97Å; L372-L392 HydrophobicContact CD1-CD2 4.39Å; L372-L392 HydrophobicContact CD1-CG 4.5Å; L372-M395 HydrophobicContact CD1-CE 3.74Å; L372-M395 HydrophobicContact CD1-SD 4.25Å
373	K	94.1	Very high	91.7	Very high	43 Å²	43	37.9 Å²	37.9	19%	0.187	21%	0.212	C	C	.	.	H	α-helix	trans	-57.5	-42.4	174.5	-75.4	179.9	-179.2	175	0	111.2	V369 Q370 I375 V376 M377 L392 E397 E398 P400	V369-K373 HydrophobicContact CG1-CD 4.2Å; V369-K373 WeakPolarHBondContact O-CG 3.36Å; V369-K373 PolarHBondContact O-N 3.04Å; Q370-K373 PolarHBondContact O-N 3.45Å; K373-I375 PolarHBondContact O-N 2.96Å; K373-V376 PolarHBondContact O-N 3.36Å; K373-M377 VanDerWaalsContact O-CG 3.26Å; K373-M377 WeakPolarHBondContact O-CG 3.32Å; K373-M377 PolarHBondContact O-N 3.25Å; K373-L392 HydrophobicContact CG-CD1 3.85Å; K373-L392 HydrophobicContact CG-CD2 4.03Å; K373-E397 IonicContact NZ-OE2 2.65Å; K373-E397 PolarHBondContact NZ-OE2 3.3Å; K373-E398 WeakPolarHBondContact CE-O 3.44Å; K373-P400 HydrophobicContact CB-CG 4.07Å; K373-P400 HydrophobicContact CG-CG 4.1Å
374	R	91.8	Very high	91.7	Very high	63 Å²	63	37.9 Å²	37.9	24%	0.238	21%	0.212	C	C	.	.	H	α-helix	trans	-60.8	-43.9	174.2	-69.1	176.4	-166.7	145.5	4.5	112.3	D333 Q370 S371 L372 V376 M377 Y378	D333-R374 IonicContact OD1-CZ 3.62Å; D333-R374 IonicContact OD1-NH1 3.97Å; D333-R374 PolarHBondContact OD1-NH1 2.9Å; D333-R374 IonicContact OD2-NH1 2.79Å; Q370-R374 WeakPolarHBondContact O-CG 3.32Å; Q370-R374 PolarHBondContact O-N 2.93Å; S371-R374 WeakPolarHBondContact O-CB 3.33Å; S371-R374 PolarHBondContact O-N 3.24Å; L372-R374 VanDerWaalsContact C-N 3.29Å; L372-R374 PolarHBondContact O-N 3.15Å; R374-V376 VanDerWaalsContact C-N 3.31Å; R374-V376 PolarHBondContact O-N 3.35Å; R374-M377 PolarHBondContact O-N 3.08Å; R374-Y378 HydrophobicContact CB-CD2 4.07Å; R374-Y378 HydrophobicContact CB-CE2 4.39Å; R374-Y378 HydrophobicContact CG-CD2 4.47Å; R374-Y378 HydrophobicContact CG-CE2 4.32Å; R374-Y378 WeakPolarHBondContact O-CB 3.26Å; R374-Y378 WeakPolarHBondContact O-CD2 3.37Å; R374-Y378 PolarHBondContact O-N 3.19Å
375	I	93.2	Very high	91.9	Very high	6 Å²	6	32.3 Å²	32.3	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-59.2	-44.9	177.7	-68.7	171.7	0	0	0	110.6	L332 K340 S371 L372 K373 M377 S379 A384 A388	L332-I375 HydrophobicContact CB-CD1 4.15Å; L332-I375 HydrophobicContact CD2-CD1 3.61Å; L332-I375 HydrophobicContact CG-CD1 4.49Å; K340-I375 HydrophobicContact CB-CD1 4.35Å; K340-I375 HydrophobicContact CD-CG1 4.43Å; K340-I375 HydrophobicContact CG-CD1 4.3Å; S371-I375 WeakPolarHBondContact O-CG1 3.37Å; S371-I375 PolarHBondContact O-N 3.4Å; L372-I375 PolarHBondContact O-N 3.22Å; L372-I375 VanDerWaalsContact O-N 3.13Å; K373-I375 PolarHBondContact O-N 2.96Å; I375-M377 VanDerWaalsContact C-N 3.34Å; I375-M377 PolarHBondContact O-N 3.45Å; I375-S379 WeakPolarHBondContact O-CB 3.44Å; I375-S379 PolarHBondContact O-N 2.91Å; I375-A384 HydrophobicContact CG2-CB 4.03Å; I375-A388 HydrophobicContact CB-CB 4.17Å; I375-A388 HydrophobicContact CG2-CB 3.9Å
376	V	94.9	Very high	92.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.8	-39.9	179.2	176.1	0	0	0	0	112.1	L372 K373 R374 A388 K389 L392 V399 P400	L372-V376 WeakPolarHBondContact O-CG2 3.45Å; L372-V376 PolarHBondContact O-N 3.38Å; K373-V376 PolarHBondContact O-N 3.36Å; R374-V376 VanDerWaalsContact C-N 3.31Å; R374-V376 PolarHBondContact O-N 3.35Å; V376-A388 HydrophobicContact CG2-CB 3.63Å; V376-K389 HydrophobicContact CB-CG 4.49Å; V376-K389 HydrophobicContact CG1-CD 4.46Å; V376-K389 HydrophobicContact CG1-CG 3.88Å; V376-K389 HydrophobicContact CG2-CG 3.73Å; V376-L392 HydrophobicContact CG2-CD1 4.05Å; V376-V399 HydrophobicContact CG1-CG1 4.28Å; V376-P400 HydrophobicContact CB-CG 3.92Å; V376-P400 HydrophobicContact CG1-CG 3.87Å; V376-P400 WeakPolarHBondContact CG1-O 3.15Å
377	M	91	Very high	92.3	Very high	7 Å²	7	28 Å²	28	3%	0.034	18%	0.175	C	C	.	.	H	α-helix	trans	-70.2	-50.4	-179.8	-69.4	175.4	74.6	0	0	112.3	K373 R374 I375 P400 I403 Q421 V422	K373-M377 VanDerWaalsContact O-CG 3.26Å; K373-M377 WeakPolarHBondContact O-CG 3.32Å; K373-M377 PolarHBondContact O-N 3.25Å; R374-M377 PolarHBondContact O-N 3.08Å; I375-M377 VanDerWaalsContact C-N 3.34Å; I375-M377 PolarHBondContact O-N 3.45Å; M377-P400 HydrophobicContact CG-CB 3.71Å; M377-P400 HydrophobicContact CG-CG 3.89Å; M377-P400 HydrophobicContact SD-CB 4.26Å; M377-I403 HydrophobicContact CE-CG2 4.32Å; M377-I403 WeakPolarHBondContact O-CG1 3.36Å; M377-I403 PolarHBondContact O-N 2.85Å; M377-I403 VanDerWaalsContact O-N 3.16Å; M377-Q421 HydrophobicContact CE-CB 3.78Å; M377-Q421 HydrophobicContact SD-CB 4.4Å; M377-V422 HydrophobicContact CE-CG1 3.96Å
378	Y	89.5	Confident	92.5	Very high	33 Å²	33	26.5 Å²	26.5	13%	0.129	16%	0.159	C	C	.	.	H	α-helix	trans	-107.4	-17.5	-162.6	-58	-73.9	0	0	0	114.9	R374 I403 W418 V470 L471 Y474	R374-Y378 HydrophobicContact CB-CD2 4.07Å; R374-Y378 HydrophobicContact CB-CE2 4.39Å; R374-Y378 HydrophobicContact CG-CD2 4.47Å; R374-Y378 HydrophobicContact CG-CE2 4.32Å; R374-Y378 WeakPolarHBondContact O-CB 3.26Å; R374-Y378 WeakPolarHBondContact O-CD2 3.37Å; R374-Y378 PolarHBondContact O-N 3.19Å; Y378-I403 HydrophobicContact CD1-CD1 3.47Å; Y378-I403 VanDerWaalsContact CD1-CD1 3.47Å; Y378-I403 HydrophobicContact CD1-CG1 4.11Å; Y378-I403 HydrophobicContact CE1-CD1 3.17Å; Y378-I403 HydrophobicContact CE1-CG1 4.23Å; Y378-W418 PolarHBondContact OH-NE1 3.09Å; Y378-V470 HydrophobicContact CD2-CG1 4.48Å; Y378-V470 HydrophobicContact CE2-CG1 3.95Å; Y378-L471 HydrophobicContact CE1-CD1 3.86Å; Y378-Y474 HydrophobicContact CD1-CD2 4.28Å; Y378-Y474 HydrophobicContact CD1-CG 4.02Å; Y378-Y474 HydrophobicContact CD2-CD2 4.18Å; Y378-Y474 HydrophobicContact CD2-CG 4.47Å; Y378-Y474 HydrophobicContact CG-CD1 4.34Å; Y378-Y474 AromaticContact CG-CD2 3.95Å; Y378-Y474 HydrophobicContact CG-CD2 3.95Å; Y378-Y474 AromaticContact CG-CG 3.8Å; Y378-Y474 HydrophobicContact CG-CG 3.8Å
379	S	86.4	Confident	92.6	Very high	12 Å²	12	30.5 Å²	30.5	8%	0.084	18%	0.176	C	C	.	.			trans	-78.3	136.3	-177.7	-169.5	0	0	0	0	112.2	I375 N381	I375-S379 WeakPolarHBondContact O-CB 3.44Å; I375-S379 PolarHBondContact O-N 2.91Å; S379-N381 PolarHBondContact OG-N 3.29Å
380	S	83.7	Confident	92.6	Very high	95 Å²	95	33.5 Å²	33.5	66%	0.664	19%	0.186	S	C	*	.			trans	-86.4	-18.3	169.7	56.6	0	0	0	0	113.3	G382	S380-G382 PolarHBondContact O-N 2.9Å
381	N	89.3	Confident	92.8	Very high	27 Å²	27	29.3 Å²	29.3	14%	0.144	17%	0.166	C	C	.	.			trans	-73.5	123.6	-179	178.5	-80.8	0	0	0	110.8	E295 V337 S379 T383 A384 S385	E295-N381 PolarHBondContact OE1-ND2 3.31Å; V337-N381 HydrophobicContact CG1-CB 3.76Å; V337-N381 WeakPolarHBondContact CG1-ND2 3.3Å; S379-N381 PolarHBondContact OG-N 3.29Å; N381-T383 WeakPolarHBondContact OD1-CA 3.43Å; N381-T383 VanDerWaalsContact OD1-CB 3.26Å; N381-T383 WeakPolarHBondContact OD1-CB 3.49Å; N381-T383 PolarHBondContact OD1-N 3.44Å; N381-A384 HydrophobicContact CB-CB 4.48Å; N381-A384 PolarHBondContact OD1-N 3.4Å; N381-S385 VanDerWaalsContact O-CB 3.3Å; N381-S385 WeakPolarHBondContact O-CB 3.46Å; N381-S385 PolarHBondContact O-N 3.33Å; N381-S385 VanDerWaalsContact O-N 3.16Å
382	G	90.6	Very high	92.9	Very high	55 Å²	55	29 Å²	29	57%	0.567	16%	0.164	S	C	*	.	H	α-helix	trans	-64.5	-39.8	-177.7	0	0	0	0	0	113.3	S380 S386	S380-G382 PolarHBondContact O-N 2.9Å; G382-S386 WeakPolarHBondContact O-CB 3.41Å; G382-S386 PolarHBondContact O-N 3.25Å; G382-S386 PolarHBondContact O-OG 2.96Å
383	T	92.5	Very high	92.8	Very high	22 Å²	22	32.6 Å²	32.6	14%	0.135	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-56.4	-179.3	-49.1	0	0	0	0	111.5	E295 I298 A299 N381 S385 S386 L387	E295-T383 PolarHBondContact OE1-OG1 3.39Å; I298-T383 HydrophobicContact CG2-CG2 4.21Å; A299-T383 HydrophobicContact CB-CG2 3.81Å; N381-T383 WeakPolarHBondContact OD1-CA 3.43Å; N381-T383 VanDerWaalsContact OD1-CB 3.26Å; N381-T383 WeakPolarHBondContact OD1-CB 3.49Å; N381-T383 PolarHBondContact OD1-N 3.44Å; T383-S385 VanDerWaalsContact C-N 3.31Å; T383-S385 PolarHBondContact O-N 3.09Å; T383-S386 PolarHBondContact O-N 3.13Å; T383-S386 PolarHBondContact O-OG 3.31Å; T383-S386 VanDerWaalsContact O-OG 3.06Å; T383-L387 HydrophobicContact CG2-CD1 4.02Å; T383-L387 WeakPolarHBondContact O-CD1 3.37Å; T383-L387 VanDerWaalsContact O-CG 3.29Å; T383-L387 WeakPolarHBondContact O-CG 3.46Å; T383-L387 PolarHBondContact O-N 3.39Å; T383-L387 VanDerWaalsContact O-N 3.09Å
384	A	93.9	Very high	92.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.5	-40.3	178.2	0	0	0	0	0	112	K340 I375 N381 A388	K340-A384 HydrophobicContact CB-CB 4.25Å; I375-A384 HydrophobicContact CG2-CB 4.03Å; N381-A384 HydrophobicContact CB-CB 4.48Å; N381-A384 PolarHBondContact OD1-N 3.4Å; A384-A388 VanDerWaalsContact O-CB 3.27Å; A384-A388 WeakPolarHBondContact O-CB 3.37Å; A384-A388 PolarHBondContact O-N 3.07Å
385	S	94.6	Very high	92.7	Very high	10 Å²	10	30.9 Å²	30.9	7%	0.07	19%	0.186	C	C	.	.	H	α-helix	trans	-66.4	-43.2	178.6	-169.7	0	0	0	0	112.1	N381 T383 A388 K389	N381-S385 VanDerWaalsContact O-CB 3.3Å; N381-S385 WeakPolarHBondContact O-CB 3.46Å; N381-S385 PolarHBondContact O-N 3.33Å; N381-S385 VanDerWaalsContact O-N 3.16Å; T383-S385 VanDerWaalsContact C-N 3.31Å; T383-S385 PolarHBondContact O-N 3.09Å; S385-A388 PolarHBondContact O-N 3.25Å; S385-K389 VanDerWaalsContact O-CG 3.22Å; S385-K389 WeakPolarHBondContact O-CG 3.44Å; S385-K389 PolarHBondContact O-N 3.37Å
386	S	95	Very high	92.6	Very high	67 Å²	67	33.9 Å²	33.9	47%	0.469	22%	0.218	S	C	.	.	H	α-helix	trans	-65.7	-43.2	179.8	77.3	0	0	0	0	111.7	G382 T383 K389 R390	G382-S386 WeakPolarHBondContact O-CB 3.41Å; G382-S386 PolarHBondContact O-N 3.25Å; G382-S386 PolarHBondContact O-OG 2.96Å; T383-S386 PolarHBondContact O-N 3.13Å; T383-S386 PolarHBondContact O-OG 3.31Å; T383-S386 VanDerWaalsContact O-OG 3.06Å; S386-K389 PolarHBondContact O-N 3.44Å; S386-R390 PolarHBondContact O-N 3.32Å
387	L	96.1	Very high	92.5	Very high	10 Å²	10	36.3 Å²	36.3	5%	0.052	23%	0.23	C	C	.	.	H	α-helix	trans	-63.7	-44.7	177.2	-68.7	167.7	0	0	0	111.5	I298 P303 A344 F345 T383 K389 R390 A391	I298-L387 HydrophobicContact CG2-CD1 3.74Å; P303-L387 HydrophobicContact CG-CD2 3.65Å; A344-L387 HydrophobicContact CB-CB 4.03Å; F345-L387 HydrophobicContact CB-CD1 3.85Å; F345-L387 HydrophobicContact CB-CD2 4.5Å; F345-L387 HydrophobicContact CD2-CD1 4.37Å; F345-L387 HydrophobicContact CD2-CD2 3.95Å; T383-L387 HydrophobicContact CG2-CD1 4.02Å; T383-L387 WeakPolarHBondContact O-CD1 3.37Å; T383-L387 VanDerWaalsContact O-CG 3.29Å; T383-L387 WeakPolarHBondContact O-CG 3.46Å; T383-L387 PolarHBondContact O-N 3.39Å; T383-L387 VanDerWaalsContact O-N 3.09Å; L387-K389 PolarHBondContact O-N 3.47Å; L387-R390 PolarHBondContact O-N 3.23Å; L387-A391 WeakPolarHBondContact O-CB 3.41Å; L387-A391 PolarHBondContact O-N 3.32Å
388	A	96.3	Very high	92.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.3	-39.8	177.7	0	0	0	0	0	112.4	L372 I375 V376 A384 S385 A391 L392	L372-A388 HydrophobicContact CB-CB 4.41Å; L372-A388 HydrophobicContact CD2-CB 3.94Å; I375-A388 HydrophobicContact CB-CB 4.17Å; I375-A388 HydrophobicContact CG2-CB 3.9Å; V376-A388 HydrophobicContact CG2-CB 3.63Å; A384-A388 VanDerWaalsContact O-CB 3.27Å; A384-A388 WeakPolarHBondContact O-CB 3.37Å; A384-A388 PolarHBondContact O-N 3.07Å; S385-A388 PolarHBondContact O-N 3.25Å; A388-A391 PolarHBondContact O-N 3.4Å; A388-L392 WeakPolarHBondContact O-CB 3.3Å; A388-L392 VanDerWaalsContact O-CG 3.32Å; A388-L392 WeakPolarHBondContact O-CG 3.47Å; A388-L392 PolarHBondContact O-N 3.24Å
389	K	95.7	Very high	92.8	Very high	83 Å²	83	45.2 Å²	45.2	36%	0.361	28%	0.276	S	S	.	.	H	α-helix	trans	-61.1	-46.8	172.9	-70.8	172.8	-175.1	174.5	0	111.4	V376 S385 S386 L387 L392 S393 V399	V376-K389 HydrophobicContact CB-CG 4.49Å; V376-K389 HydrophobicContact CG1-CD 4.46Å; V376-K389 HydrophobicContact CG1-CG 3.88Å; V376-K389 HydrophobicContact CG2-CG 3.73Å; S385-K389 VanDerWaalsContact O-CG 3.22Å; S385-K389 WeakPolarHBondContact O-CG 3.44Å; S385-K389 PolarHBondContact O-N 3.37Å; S386-K389 PolarHBondContact O-N 3.44Å; L387-K389 PolarHBondContact O-N 3.47Å; K389-L392 PolarHBondContact O-N 2.83Å; K389-S393 PolarHBondContact O-N 2.97Å; K389-S393 PolarHBondContact O-OG 3.49Å; K389-S393 VanDerWaalsContact O-OG 3.09Å; K389-V399 HydrophobicContact CB-CG1 4.14Å; K389-V399 HydrophobicContact CD-CG1 4.47Å; K389-V399 HydrophobicContact CG-CG1 3.7Å
390	R	95.1	Very high	93.1	Very high	76 Å²	76	45.5 Å²	45.5	29%	0.287	28%	0.278	S	S	.	.	H	α-helix	trans	-60.6	-46.1	178.8	-173.4	175.9	177.4	170.9	-3.8	111.2	D302 D304 S386 L387 S393 M394	D302-R390 IonicContact OD1-NH2 2.74Å; D302-R390 PolarHBondContact OD1-NH2 3.31Å; D302-R390 IonicContact OD2-CZ 3.69Å; D302-R390 IonicContact OD2-NH1 2.9Å; D302-R390 PolarHBondContact OD2-NH1 3Å; D302-R390 IonicContact OD2-NH2 2.64Å; D302-R390 PolarHBondContact OD2-NH2 3.43Å; D302-R390 VanDerWaalsContact OD2-NH2 3.08Å; D304-R390 IonicContact OD2-CZ 3.82Å; D304-R390 IonicContact OD2-NH2 4Å; D304-R390 PolarHBondContact OD2-NH2 3.05Å; S386-R390 PolarHBondContact O-N 3.32Å; L387-R390 PolarHBondContact O-N 3.23Å; R390-S393 PolarHBondContact O-N 3.36Å; R390-M394 HydrophobicContact CG-CE 4.16Å; R390-M394 WeakPolarHBondContact O-CG 3.38Å; R390-M394 PolarHBondContact O-N 3.08Å
391	A	95	Very high	93.4	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-49.5	176.9	0	0	0	0	0	112	C348 L372 L387 A388 S393 M394 M395	C348-A391 HydrophobicContact CB-CB 4.19Å; L372-A391 HydrophobicContact CD1-CB 3.92Å; L387-A391 WeakPolarHBondContact O-CB 3.41Å; L387-A391 PolarHBondContact O-N 3.32Å; A388-A391 PolarHBondContact O-N 3.4Å; A391-S393 PolarHBondContact O-N 3.26Å; A391-M394 PolarHBondContact O-N 2.65Å; A391-M395 HydrophobicContact CB-CE 4.32Å; A391-M395 VanDerWaalsContact O-CG 3.29Å; A391-M395 WeakPolarHBondContact O-CG 3.44Å; A391-M395 PolarHBondContact O-N 2.68Å
392	L	95.7	Very high	93.4	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.9	-44.1	178	-72.5	170.9	0	0	0	112.5	V369 L372 K373 V376 A388 K389 M394 M395 G396 E397 V399	V369-L392 HydrophobicContact CG1-CD2 3.96Å; L372-L392 HydrophobicContact CB-CD1 4.22Å; L372-L392 HydrophobicContact CB-CD2 3.97Å; L372-L392 HydrophobicContact CB-CG 3.97Å; L372-L392 HydrophobicContact CD1-CD2 4.39Å; L372-L392 HydrophobicContact CD1-CG 4.5Å; K373-L392 HydrophobicContact CG-CD1 3.85Å; K373-L392 HydrophobicContact CG-CD2 4.03Å; V376-L392 HydrophobicContact CG2-CD1 4.05Å; A388-L392 WeakPolarHBondContact O-CB 3.3Å; A388-L392 VanDerWaalsContact O-CG 3.32Å; A388-L392 WeakPolarHBondContact O-CG 3.47Å; A388-L392 PolarHBondContact O-N 3.24Å; K389-L392 PolarHBondContact O-N 2.83Å; L392-M394 VanDerWaalsContact C-N 3.32Å; L392-M394 PolarHBondContact O-N 2.73Å; L392-M395 WeakPolarHBondContact O-CB 3.42Å; L392-M395 PolarHBondContact O-N 2.88Å; L392-M395 VanDerWaalsContact O-N 3.14Å; L392-G396 PolarHBondContact O-N 3.36Å; L392-E397 HydrophobicContact CB-CB 4.37Å; L392-E397 HydrophobicContact CD2-CB 4.01Å; L392-E397 HydrophobicContact CD2-CG 4.45Å; L392-E397 PolarHBondContact O-N 3.29Å; L392-V399 HydrophobicContact CB-CG2 4.06Å
393	S	94.4	Very high	93.4	Very high	75 Å²	75	52.4 Å²	52.4	52%	0.524	28%	0.276	S	S	.	.	H	α-helix	trans	-59.7	-41.8	176.1	-64.8	0	0	0	0	112.2	K389 R390 A391 M395 G396 V399	K389-S393 PolarHBondContact O-N 2.97Å; K389-S393 PolarHBondContact O-OG 3.49Å; K389-S393 VanDerWaalsContact O-OG 3.09Å; R390-S393 PolarHBondContact O-N 3.36Å; A391-S393 PolarHBondContact O-N 3.26Å; S393-M395 VanDerWaalsContact C-N 3.3Å; S393-M395 PolarHBondContact O-N 3.41Å; S393-G396 PolarHBondContact O-N 3.28Å; S393-G396 VanDerWaalsContact O-N 3.15Å; S393-V399 WeakPolarHBondContact OG-CG2 3.49Å
394	M	91.1	Very high	93.3	Very high	49 Å²	49	56.5 Å²	56.5	24%	0.241	30%	0.296	C	S	.	.	H	α-helix	trans	-70	-26.4	177.5	-70.2	-171.7	-60.9	0	0	113.2	C348 T351 R390 A391 L392	C348-M394 HydrophobicContact CB-CE 4.46Å; C348-M394 VanDerWaalsContact O-CE 3.26Å; C348-M394 WeakPolarHBondContact O-CE 3.46Å; C348-M394 WeakPolarHBondContact SG-CE 3.22Å; T351-M394 HydrophobicContact CG2-CB 3.57Å; T351-M394 HydrophobicContact CG2-CE 4.19Å; R390-M394 HydrophobicContact CG-CE 4.16Å; R390-M394 WeakPolarHBondContact O-CG 3.38Å; R390-M394 PolarHBondContact O-N 3.08Å; A391-M394 PolarHBondContact O-N 2.65Å; L392-M394 VanDerWaalsContact C-N 3.32Å; L392-M394 PolarHBondContact O-N 2.73Å
395	M	92.3	Very high	93	Very high	21 Å²	21	59.2 Å²	59.2	10%	0.103	32%	0.315	C	S	.	.	H	α-helix	trans	-75.3	-13.3	172.4	-65.5	171.9	-169.7	0	0	112.8	T351 F363 V369 L372 A391 L392 S393 E397	T351-M395 HydrophobicContact CG2-CE 4.13Å; T351-M395 HydrophobicContact CG2-CG 3.63Å; T351-M395 WeakPolarHBondContact OG1-CE 3.33Å; F363-M395 HydrophobicContact CB-CE 3.72Å; F363-M395 HydrophobicContact CB-SD 3.81Å; F363-M395 HydrophobicContact CD1-CE 3.83Å; F363-M395 HydrophobicContact CD2-CE 3.87Å; F363-M395 HydrophobicContact CD2-CG 4.28Å; F363-M395 HydrophobicContact CD2-SD 4.42Å; F363-M395 HydrophobicContact CE1-CE 4.42Å; F363-M395 HydrophobicContact CE2-CE 4.46Å; F363-M395 HydrophobicContact CG-CE 3.53Å; F363-M395 HydrophobicContact CG-SD 4.19Å; V369-M395 HydrophobicContact CG2-SD 3.87Å; L372-M395 HydrophobicContact CD1-CE 3.74Å; L372-M395 HydrophobicContact CD1-SD 4.25Å; A391-M395 HydrophobicContact CB-CE 4.32Å; A391-M395 VanDerWaalsContact O-CG 3.29Å; A391-M395 WeakPolarHBondContact O-CG 3.44Å; A391-M395 PolarHBondContact O-N 2.68Å; L392-M395 WeakPolarHBondContact O-CB 3.42Å; L392-M395 PolarHBondContact O-N 2.88Å; L392-M395 VanDerWaalsContact O-N 3.14Å; S393-M395 VanDerWaalsContact C-N 3.3Å; S393-M395 PolarHBondContact O-N 3.41Å; M395-E397 HydrophobicContact CB-CG 4.08Å
396	G	90.9	Very high	92.9	Very high	70 Å²	70	60 Å²	60	72%	0.722	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	19.7	-173	0	0	0	0	0	113.6	L392 S393	L392-G396 PolarHBondContact O-N 3.36Å; S393-G396 PolarHBondContact O-N 3.28Å; S393-G396 VanDerWaalsContact O-N 3.15Å
397	E	93.5	Very high	92.9	Very high	51 Å²	51	56.8 Å²	56.8	24%	0.238	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-90.2	148.2	-180	-73.7	-74.3	160.1	0	0	111.6	V369 K373 L392 M395 V399	V369-E397 HydrophobicContact CG1-CB 4.5Å; V369-E397 HydrophobicContact CG1-CG 3.78Å; V369-E397 HydrophobicContact CG2-CG 4.24Å; K373-E397 IonicContact NZ-OE2 2.65Å; K373-E397 PolarHBondContact NZ-OE2 3.3Å; L392-E397 HydrophobicContact CB-CB 4.37Å; L392-E397 HydrophobicContact CD2-CB 4.01Å; L392-E397 HydrophobicContact CD2-CG 4.45Å; L392-E397 PolarHBondContact O-N 3.29Å; M395-E397 HydrophobicContact CB-CG 4.08Å; E397-V399 PolarHBondContact O-N 3.48Å
398	E	91.6	Very high	92.8	Very high	170 Å²	170	57.1 Å²	57.1	79%	0.794	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-66.2	125	172.3	-69.1	-173.1	172.5	0	0	110.8	K373 P400	K373-E398 WeakPolarHBondContact CE-O 3.44Å; E398-P400 WeakPolarHBondContact O-CD 3.35Å
399	V	94.3	Very high	92.7	Very high	56 Å²	56	61.7 Å²	61.7	34%	0.339	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-83.2	117.9	-179.4	-179.3	0	0	0	0	109.6	V376 K389 L392 S393 E397	V376-V399 HydrophobicContact CG1-CG1 4.28Å; K389-V399 HydrophobicContact CB-CG1 4.14Å; K389-V399 HydrophobicContact CD-CG1 4.47Å; K389-V399 HydrophobicContact CG-CG1 3.7Å; L392-V399 HydrophobicContact CB-CG2 4.06Å; S393-V399 WeakPolarHBondContact OG-CG2 3.49Å; E397-V399 PolarHBondContact O-N 3.48Å
400	P	92.9	Very high	92.8	Very high	19 Å²	19	58 Å²	58	12%	0.123	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-69	159.1	179.9	27	-32.2	0	0	0	111.8	K373 V376 M377 E398	K373-P400 HydrophobicContact CB-CG 4.07Å; K373-P400 HydrophobicContact CG-CG 4.1Å; V376-P400 HydrophobicContact CB-CG 3.92Å; V376-P400 HydrophobicContact CG1-CG 3.87Å; V376-P400 WeakPolarHBondContact CG1-O 3.15Å; M377-P400 HydrophobicContact CG-CB 3.71Å; M377-P400 HydrophobicContact CG-CG 3.89Å; M377-P400 HydrophobicContact SD-CB 4.26Å; E398-P400 WeakPolarHBondContact O-CD 3.35Å
401	K	90.3	Very high	92.8	Very high	157 Å²	157	60.7 Å²	60.7	68%	0.683	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-86.6	141.4	173.7	-61	177.8	-178.6	174	0	109.3	I403 Q421	K401-I403 PolarHBondContact O-N 3.15Å; K401-Q421 PolarHBondContact O-NE2 3.1Å; K401-Q421 PolarHBondContact O-OE1 3.21Å
402	R	90.3	Very high	92.8	Very high	144 Å²	144	62.9 Å²	62.9	54%	0.543	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-58.4	132.8	172	-176.2	177.9	176.7	-170.8	-2.8	109.3
403	I	90.9	Very high	92.8	Very high	20 Å²	20	66.4 Å²	66.4	10%	0.103	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-94	155.2	176	63.4	167.4	0	0	0	110.4	M377 Y378 K401 W410 L471	M377-I403 HydrophobicContact CE-CG2 4.32Å; M377-I403 WeakPolarHBondContact O-CG1 3.36Å; M377-I403 PolarHBondContact O-N 2.85Å; M377-I403 VanDerWaalsContact O-N 3.16Å; Y378-I403 HydrophobicContact CD1-CD1 3.47Å; Y378-I403 VanDerWaalsContact CD1-CD1 3.47Å; Y378-I403 HydrophobicContact CD1-CG1 4.11Å; Y378-I403 HydrophobicContact CE1-CD1 3.17Å; Y378-I403 HydrophobicContact CE1-CG1 4.23Å; K401-I403 PolarHBondContact O-N 3.15Å; I403-W410 HydrophobicContact CB-CH2 4.46Å; I403-W410 HydrophobicContact CB-CZ2 4.12Å; I403-W410 HydrophobicContact CD1-CH2 3.91Å; I403-W410 HydrophobicContact CD1-CZ2 3.93Å; I403-W410 HydrophobicContact CG1-CZ2 4.41Å; I403-L471 HydrophobicContact CD1-CD1 3.68Å
404	L	89.4	Confident	92.8	Very high	108 Å²	108	65.7 Å²	65.7	57%	0.565	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-70.6	130.5	175.2	-65.3	177.3	0	0	0	109.6	C406 W410 E414	L404-C406 PolarHBondContact O-N 2.75Å; L404-W410 VanDerWaalsContact O-CZ2 3.23Å; L404-W410 WeakPolarHBondContact O-CZ2 3.4Å; L404-W410 PolarHBondContact O-NE1 2.89Å; L404-E414 HydrophobicContact CD1-CG 4.06Å
405	S	88.4	Confident	93.1	Very high	57 Å²	57	63.4 Å²	63.4	40%	0.399	34%	0.337	S	S	.	.	S	Bend	trans	-70	-31.2	-176	52	0	0	0	0	113.4	V407 A475 D476	S405-V407 VanDerWaalsContact C-N 3.27Å; S405-V407 PolarHBondContact O-N 3.04Å; S405-A475 WeakPolarHBondContact O-CA 3.45Å; S405-D476 PolarHBondContact O-N 3.03Å
406	C	92.2	Very high	93.2	Very high	26 Å²	26	63.8 Å²	63.8	18%	0.176	34%	0.339	C	S	.	.			trans	-78.9	71.8	-178.1	-171.7	0	0	0	0	111.6	L404 P408 N409 W410	L404-C406 PolarHBondContact O-N 2.75Å; C406-P408 VanDerWaalsContact C-CD 3.43Å; C406-N409 PolarHBondContact O-N 2.69Å; C406-N409 VanDerWaalsContact O-N 3.12Å; C406-N409 VanDerWaalsContact SG-CG 3.53Å; C406-N409 PolarHBondContact SG-ND2 3.2Å; C406-N409 VanDerWaalsContact SG-ND2 3.35Å; C406-W410 VanDerWaalsContact O-CD1 3.24Å
407	V	94.8	Very high	93.3	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.006	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-54.9	-40.9	-178.7	-172.6	0	0	0	0	113.6	S405 N409 W410 G438 L442 L471 A475	S405-V407 VanDerWaalsContact C-N 3.27Å; S405-V407 PolarHBondContact O-N 3.04Å; V407-N409 PolarHBondContact O-N 3.34Å; V407-W410 HydrophobicContact CB-CD2 4.42Å; V407-W410 HydrophobicContact CG1-CD2 4.03Å; V407-W410 HydrophobicContact CG1-CE3 4.04Å; V407-W410 HydrophobicContact CG1-CG 4.5Å; V407-W410 HydrophobicContact CG1-CZ3 4.33Å; V407-W410 HydrophobicContact CG2-CH2 4.35Å; V407-W410 HydrophobicContact CG2-CZ2 3.87Å; V407-W410 WeakPolarHBondContact O-CB 3.07Å; V407-W410 PolarHBondContact O-N 3.31Å; V407-G438 VanDerWaalsContact O-CA 3.32Å; V407-G438 WeakPolarHBondContact O-CA 3.26Å; V407-L442 HydrophobicContact CB-CD1 4.23Å; V407-L442 HydrophobicContact CB-CD2 4.48Å; V407-L442 HydrophobicContact CG1-CD1 3.94Å; V407-L442 HydrophobicContact CG1-CD2 3.88Å; V407-L442 HydrophobicContact CG1-CG 3.86Å; V407-L471 HydrophobicContact CG1-CD2 4.07Å; V407-L471 HydrophobicContact CG1-CG 4.36Å; V407-L471 HydrophobicContact CG2-CD1 3.67Å; V407-L471 HydrophobicContact CG2-CG 4.04Å; V407-A475 HydrophobicContact CB-CB 4.05Å; V407-A475 HydrophobicContact CG2-CB 3.57Å
408	P	94.3	Very high	93.4	Very high	17 Å²	17	60.3 Å²	60.3	11%	0.11	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-56.9	-22.9	178	-27.5	36.3	0	0	0	114.7	C406 L442 Y477 Y501	C406-P408 VanDerWaalsContact C-CD 3.43Å; P408-L442 HydrophobicContact CB-CD1 4.41Å; P408-L442 HydrophobicContact CG-CD1 3.87Å; P408-Y477 HydrophobicContact CG-CD1 3.91Å; P408-Y477 HydrophobicContact CG-CE1 4.16Å; P408-Y501 HydrophobicContact CB-CE2 3.81Å; P408-Y501 HydrophobicContact CG-CD2 4.04Å; P408-Y501 HydrophobicContact CG-CE2 3.74Å
409	N	94.2	Very high	93.5	Very high	96 Å²	96	52.2 Å²	52.2	51%	0.513	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-98.4	2.8	-178.5	-69.2	-3	0	0	0	113.4	C406 V407	C406-N409 PolarHBondContact O-N 2.69Å; C406-N409 VanDerWaalsContact O-N 3.12Å; C406-N409 VanDerWaalsContact SG-CG 3.53Å; C406-N409 PolarHBondContact SG-ND2 3.2Å; C406-N409 VanDerWaalsContact SG-ND2 3.35Å; V407-N409 PolarHBondContact O-N 3.34Å
410	W	96.5	Very high	93.4	Very high	6 Å²	6	55 Å²	55	2%	0.023	28%	0.278	C	S	.	.			trans	-63.5	145.1	-179.7	-76.2	11	0	0	0	111.9	I403 L404 C406 V407 E414 V415 W418 G438 L441 L471	I403-W410 HydrophobicContact CB-CH2 4.46Å; I403-W410 HydrophobicContact CB-CZ2 4.12Å; I403-W410 HydrophobicContact CD1-CH2 3.91Å; I403-W410 HydrophobicContact CD1-CZ2 3.93Å; I403-W410 HydrophobicContact CG1-CZ2 4.41Å; L404-W410 VanDerWaalsContact O-CZ2 3.23Å; L404-W410 WeakPolarHBondContact O-CZ2 3.4Å; L404-W410 PolarHBondContact O-NE1 2.89Å; C406-W410 VanDerWaalsContact O-CD1 3.24Å; V407-W410 HydrophobicContact CB-CD2 4.42Å; V407-W410 HydrophobicContact CG1-CD2 4.03Å; V407-W410 HydrophobicContact CG1-CE3 4.04Å; V407-W410 HydrophobicContact CG1-CG 4.5Å; V407-W410 HydrophobicContact CG1-CZ3 4.33Å; V407-W410 HydrophobicContact CG2-CH2 4.35Å; V407-W410 HydrophobicContact CG2-CZ2 3.87Å; V407-W410 WeakPolarHBondContact O-CB 3.07Å; V407-W410 PolarHBondContact O-N 3.31Å; W410-E414 HydrophobicContact CB-CB 3.88Å; W410-E414 HydrophobicContact CB-CG 4.49Å; W410-E414 HydrophobicContact CD2-CB 3.73Å; W410-E414 HydrophobicContact CE3-CB 4.07Å; W410-E414 HydrophobicContact CG-CB 3.65Å; W410-E414 HydrophobicContact CG-CG 4.22Å; W410-V415 HydrophobicContact CE3-CG2 4.05Å; W410-W418 HydrophobicContact CH2-CB 3.86Å; W410-W418 AromaticContact CH2-CG 3.97Å; W410-W418 HydrophobicContact CH2-CG 3.97Å; W410-W418 HydrophobicContact CZ3-CB 3.7Å; W410-W418 AromaticContact CZ3-CG 3.95Å; W410-W418 HydrophobicContact CZ3-CG 3.95Å; W410-G438 PolarHBondContact O-N 3.5Å; W410-L441 HydrophobicContact CE3-CD2 4.31Å; W410-L441 HydrophobicContact CZ3-CD2 4.14Å; W410-L471 HydrophobicContact CH2-CD1 3.55Å; W410-L471 HydrophobicContact CH2-CD2 3.96Å; W410-L471 HydrophobicContact CH2-CG 4.41Å; W410-L471 HydrophobicContact CZ2-CD1 4.07Å; W410-L471 HydrophobicContact CZ3-CD1 4.3Å; W410-L471 HydrophobicContact CZ3-CD2 3.86Å
411	K	96.1	Very high	93.4	Very high	131 Å²	131	56.6 Å²	56.6	57%	0.57	28%	0.284	S	S	*	.			trans	-98.9	178.1	166.8	-54.3	-56.4	-179.7	-171.3	0	109.3	C413 E414 V415	K411-C413 PolarHBondContact O-N 2.96Å; K411-C413 VanDerWaalsContact O-N 3.17Å; K411-E414 VanDerWaalsContact CA-OE2 3.26Å; K411-E414 WeakPolarHBondContact CA-OE2 3.41Å; K411-E414 VanDerWaalsContact CB-OE2 3.25Å; K411-E414 WeakPolarHBondContact CB-OE2 3.34Å; K411-E414 PolarHBondContact N-OE2 3.13Å; K411-E414 PolarHBondContact O-N 3.09Å; K411-E414 VanDerWaalsContact O-OE2 3.12Å; K411-V415 PolarHBondContact O-N 2.93Å
412	T	95.8	Very high	93.4	Very high	47 Å²	47	50.3 Å²	50.3	29%	0.288	26%	0.259	S	S	.	.	H	α-helix	trans	-55.6	-33.6	-179.3	53.7	0	0	0	0	112.6	V415 Q416 Q435	T412-V415 PolarHBondContact O-N 3.46Å; T412-Q416 WeakPolarHBondContact O-CG 3.44Å; T412-Q416 PolarHBondContact O-N 2.92Å; T412-Q435 HydrophobicContact CG2-CB 4.22Å
413	C	94.1	Very high	93.4	Very high	74 Å²	74	45.6 Å²	45.6	50%	0.5	26%	0.256	S	S	.	.	H	α-helix	trans	-66.9	-42.4	179.5	-171.8	0	0	0	0	112.9	K411 Q416 T417	K411-C413 PolarHBondContact O-N 2.96Å; K411-C413 VanDerWaalsContact O-N 3.17Å; C413-Q416 PolarHBondContact O-N 2.97Å; C413-T417 PolarHBondContact O-N 3.46Å; C413-T417 PolarHBondContact O-OG1 2.69Å
414	E	95.4	Very high	93.6	Very high	60 Å²	60	44.8 Å²	44.8	28%	0.28	25%	0.251	S	S	.	.	H	α-helix	trans	-65.6	-40.5	176	-68.2	75.8	-166.4	0	0	111.1	L404 W410 K411 Q416 T417 W418	L404-E414 HydrophobicContact CD1-CG 4.06Å; W410-E414 HydrophobicContact CB-CB 3.88Å; W410-E414 HydrophobicContact CB-CG 4.49Å; W410-E414 HydrophobicContact CD2-CB 3.73Å; W410-E414 HydrophobicContact CE3-CB 4.07Å; W410-E414 HydrophobicContact CG-CB 3.65Å; W410-E414 HydrophobicContact CG-CG 4.22Å; K411-E414 VanDerWaalsContact CA-OE2 3.26Å; K411-E414 WeakPolarHBondContact CA-OE2 3.41Å; K411-E414 VanDerWaalsContact CB-OE2 3.25Å; K411-E414 WeakPolarHBondContact CB-OE2 3.34Å; K411-E414 PolarHBondContact N-OE2 3.13Å; K411-E414 PolarHBondContact O-N 3.09Å; K411-E414 VanDerWaalsContact O-OE2 3.12Å; E414-Q416 PolarHBondContact O-N 3.18Å; E414-T417 PolarHBondContact O-N 3.19Å; E414-W418 PolarHBondContact O-N 3.12Å
415	V	96.3	Very high	93.8	Very high	1 Å²	1	43 Å²	43	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-59.5	-46.9	174.9	174.8	0	0	0	0	110.8	W410 K411 T412 T417 W418 L419 F431 L441	W410-V415 HydrophobicContact CE3-CG2 4.05Å; K411-V415 PolarHBondContact O-N 2.93Å; T412-V415 PolarHBondContact O-N 3.46Å; V415-T417 PolarHBondContact O-N 2.61Å; V415-W418 PolarHBondContact O-N 3.33Å; V415-L419 HydrophobicContact CG1-CD1 4.22Å; V415-L419 HydrophobicContact CG1-CG 4.5Å; V415-L419 WeakPolarHBondContact O-CG 3.39Å; V415-L419 PolarHBondContact O-N 3.32Å; V415-F431 HydrophobicContact CG1-CD1 3.83Å; V415-F431 HydrophobicContact CG1-CE1 4.47Å; V415-L441 HydrophobicContact CG1-CD2 4.26Å; V415-L441 HydrophobicContact CG2-CD2 4.12Å
416	Q	94.6	Very high	94	Very high	29 Å²	29	44.5 Å²	44.5	14%	0.136	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-44.2	175.6	-74.1	-172.1	-41.7	0	0	112.7	T412 C413 E414 W418 L419 Q420 S428 Q432	T412-Q416 WeakPolarHBondContact O-CG 3.44Å; T412-Q416 PolarHBondContact O-N 2.92Å; C413-Q416 PolarHBondContact O-N 2.97Å; E414-Q416 PolarHBondContact O-N 3.18Å; Q416-W418 VanDerWaalsContact C-N 3.27Å; Q416-W418 PolarHBondContact O-N 3.39Å; Q416-L419 PolarHBondContact O-N 3.12Å; Q416-Q420 WeakPolarHBondContact O-CG 3.41Å; Q416-Q420 PolarHBondContact O-N 2.84Å; Q416-S428 PolarHBondContact NE2-O 2.75Å; Q416-Q432 VanDerWaalsContact NE2-CB 3.31Å
417	T	93.4	Very high	94.2	Very high	48 Å²	48	45.3 Å²	45.3	29%	0.294	26%	0.264	S	S	.	.	H	α-helix	trans	-60.6	-40.4	178.3	-60.8	0	0	0	0	111	C413 E414 V415 Q421	C413-T417 PolarHBondContact O-N 3.46Å; C413-T417 PolarHBondContact O-OG1 2.69Å; E414-T417 PolarHBondContact O-N 3.19Å; V415-T417 PolarHBondContact O-N 2.61Å; T417-Q421 WeakPolarHBondContact O-CG 3.43Å; T417-Q421 PolarHBondContact O-N 3.06Å
418	W	95.6	Very high	94.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.5	-45.7	175.6	175.9	79.8	0	0	0	112.1	Y378 W410 E414 V415 Q416 Q420 Q421 V422 L441 F464 D467 L468 L471	Y378-W418 PolarHBondContact OH-NE1 3.09Å; W410-W418 HydrophobicContact CH2-CB 3.86Å; W410-W418 AromaticContact CH2-CG 3.97Å; W410-W418 HydrophobicContact CH2-CG 3.97Å; W410-W418 HydrophobicContact CZ3-CB 3.7Å; W410-W418 AromaticContact CZ3-CG 3.95Å; W410-W418 HydrophobicContact CZ3-CG 3.95Å; E414-W418 PolarHBondContact O-N 3.12Å; V415-W418 PolarHBondContact O-N 3.33Å; Q416-W418 VanDerWaalsContact C-N 3.27Å; Q416-W418 PolarHBondContact O-N 3.39Å; W418-Q420 VanDerWaalsContact C-N 3.31Å; W418-Q420 PolarHBondContact O-N 2.84Å; W418-Q421 PolarHBondContact O-N 2.71Å; W418-Q421 VanDerWaalsContact O-N 3.15Å; W418-V422 HydrophobicContact CD2-CG1 4.38Å; W418-V422 HydrophobicContact CD2-CG2 4.13Å; W418-V422 HydrophobicContact CE3-CG2 4.28Å; W418-V422 HydrophobicContact CH2-CG2 4.24Å; W418-V422 HydrophobicContact CZ2-CG1 4.19Å; W418-V422 HydrophobicContact CZ2-CG2 4.09Å; W418-V422 HydrophobicContact CZ3-CG2 4.33Å; W418-V422 WeakPolarHBondContact O-CG2 3.48Å; W418-V422 PolarHBondContact O-N 3.41Å; W418-L441 HydrophobicContact CE3-CD2 4.09Å; W418-L441 HydrophobicContact CZ3-CD1 4.02Å; W418-L441 HydrophobicContact CZ3-CD2 4.19Å; W418-F464 AromaticContact CH2-CE2 3.93Å; W418-F464 HydrophobicContact CH2-CE2 3.93Å; W418-F464 HydrophobicContact CH2-CZ 4.13Å; W418-F464 AromaticContact CZ3-CE2 3.68Å; W418-F464 HydrophobicContact CZ3-CE2 3.68Å; W418-F464 AromaticContact CZ3-CZ 3.91Å; W418-F464 HydrophobicContact CZ3-CZ 3.91Å; W418-D467 HydrophobicContact CZ2-CB 4.44Å; W418-L468 HydrophobicContact CH2-CB 4.35Å; W418-L468 HydrophobicContact CH2-CD1 4.49Å; W418-L471 HydrophobicContact CD2-CD2 4.07Å; W418-L471 HydrophobicContact CG-CD2 4.45Å; W418-L471 HydrophobicContact CZ2-CB 4.09Å; W418-L471 HydrophobicContact CZ2-CD2 4.02Å
419	L	94.6	Very high	94.1	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-56.3	-43.5	177.3	-73	171.9	0	0	0	112.5	V415 Q416 G423 F424 S425 F431 F464	V415-L419 HydrophobicContact CG1-CD1 4.22Å; V415-L419 HydrophobicContact CG1-CG 4.5Å; V415-L419 WeakPolarHBondContact O-CG 3.39Å; V415-L419 PolarHBondContact O-N 3.32Å; Q416-L419 PolarHBondContact O-N 3.12Å; L419-G423 PolarHBondContact O-N 2.84Å; L419-F424 HydrophobicContact CB-CB 4.48Å; L419-F424 HydrophobicContact CD2-CB 3.91Å; L419-F424 CarbonylContact O-C 3.46Å; L419-F424 WeakPolarHBondContact O-CA 3.5Å; L419-F424 PolarHBondContact O-N 2.85Å; L419-S425 PolarHBondContact O-N 3.31Å; L419-F431 HydrophobicContact CD1-CB 3.75Å; L419-F431 HydrophobicContact CD1-CD1 3.82Å; L419-F431 HydrophobicContact CD1-CD2 3.76Å; L419-F431 HydrophobicContact CD1-CE1 4.35Å; L419-F431 HydrophobicContact CD1-CE2 4.28Å; L419-F431 HydrophobicContact CD1-CG 3.5Å; L419-F431 HydrophobicContact CD2-CE1 4.44Å; L419-F431 HydrophobicContact CD2-CE2 4.33Å; L419-F431 HydrophobicContact CD2-CZ 4.25Å; L419-F464 HydrophobicContact CD2-CE2 3.66Å
420	Q	92.1	Very high	94.2	Very high	113 Å²	113	49.4 Å²	49.4	53%	0.528	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-44.4	178	-70.3	171.5	6.2	0	0	111.5	Q416 W418 G423	Q416-Q420 WeakPolarHBondContact O-CG 3.41Å; Q416-Q420 PolarHBondContact O-N 2.84Å; W418-Q420 VanDerWaalsContact C-N 3.31Å; W418-Q420 PolarHBondContact O-N 2.84Å; Q420-G423 PolarHBondContact O-N 3.49Å
421	Q	91.6	Very high	94.2	Very high	53 Å²	53	49.2 Å²	49.2	25%	0.248	28%	0.279	C	S	.	.	H	α-helix	trans	-72.8	-31.4	-177.6	-69	-175.4	44.8	0	0	114.1	M377 K401 T417 W418 G423	M377-Q421 HydrophobicContact CE-CB 3.78Å; M377-Q421 HydrophobicContact SD-CB 4.4Å; K401-Q421 PolarHBondContact O-NE2 3.1Å; K401-Q421 PolarHBondContact O-OE1 3.21Å; T417-Q421 WeakPolarHBondContact O-CG 3.43Å; T417-Q421 PolarHBondContact O-N 3.06Å; W418-Q421 PolarHBondContact O-N 2.71Å; W418-Q421 VanDerWaalsContact O-N 3.15Å; Q421-G423 VanDerWaalsContact C-N 3.28Å
422	V	91.1	Very high	94.1	Very high	25 Å²	25	47.6 Å²	47.6	15%	0.152	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	2.4	177	-59.9	0	0	0	0	113.3	M377 W418 F424	M377-V422 HydrophobicContact CE-CG1 3.96Å; W418-V422 HydrophobicContact CD2-CG1 4.38Å; W418-V422 HydrophobicContact CD2-CG2 4.13Å; W418-V422 HydrophobicContact CE3-CG2 4.28Å; W418-V422 HydrophobicContact CH2-CG2 4.24Å; W418-V422 HydrophobicContact CZ2-CG1 4.19Å; W418-V422 HydrophobicContact CZ2-CG2 4.09Å; W418-V422 HydrophobicContact CZ3-CG2 4.33Å; W418-V422 WeakPolarHBondContact O-CG2 3.48Å; W418-V422 PolarHBondContact O-N 3.41Å; V422-F424 HydrophobicContact CB-CD2 4.44Å; V422-F424 HydrophobicContact CG2-CD2 3.81Å; V422-F424 WeakPolarHBondContact O-CD2 3.43Å
423	G	90.9	Very high	94.1	Very high	46 Å²	46	51.4 Å²	51.4	47%	0.474	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	30	174.9	0	0	0	0	0	114.5	L419 Q420 Q421	L419-G423 PolarHBondContact O-N 2.84Å; Q420-G423 PolarHBondContact O-N 3.49Å; Q421-G423 VanDerWaalsContact C-N 3.28Å
424	F	94.5	Very high	94.2	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.009	28%	0.282	C	S	.	.			trans	-117.4	28.3	176.2	-72.4	-96.2	0	0	0	112.1	L419 V422 A426 F427 T460 R463 F464	L419-F424 HydrophobicContact CB-CB 4.48Å; L419-F424 HydrophobicContact CD2-CB 3.91Å; L419-F424 CarbonylContact O-C 3.46Å; L419-F424 WeakPolarHBondContact O-CA 3.5Å; L419-F424 PolarHBondContact O-N 2.85Å; V422-F424 HydrophobicContact CB-CD2 4.44Å; V422-F424 HydrophobicContact CG2-CD2 3.81Å; V422-F424 WeakPolarHBondContact O-CD2 3.43Å; F424-A426 PolarHBondContact O-N 3.43Å; F424-A426 VanDerWaalsContact O-N 3.16Å; F424-F427 HydrophobicContact CB-CD2 4.31Å; F424-F427 AromaticContact CD1-CD2 3.89Å; F424-F427 HydrophobicContact CD1-CD2 3.89Å; F424-F427 HydrophobicContact CD1-CE2 4.02Å; F424-F427 PolarHBondContact O-N 3.33Å; F424-T460 HydrophobicContact CD1-CG2 4.47Å; F424-T460 HydrophobicContact CE1-CG2 3.78Å; F424-R463 HydrophobicContact CE2-CG 4.38Å; F424-R463 HydrophobicContact CZ-CB 4.03Å; F424-R463 HydrophobicContact CZ-CG 3.98Å; F424-R463 VanDerWaalsContact CZ-NE 3.28Å; F424-F464 HydrophobicContact CD1-CB 4.37Å; F424-F464 AromaticContact CD1-CD2 3.91Å; F424-F464 HydrophobicContact CD1-CD2 3.91Å; F424-F464 HydrophobicContact CD2-CD2 4.42Å; F424-F464 HydrophobicContact CE1-CB 3.65Å; F424-F464 HydrophobicContact CE1-CD2 4.03Å; F424-F464 HydrophobicContact CE1-CG 4.35Å; F424-F464 HydrophobicContact CG-CD2 4.11Å; F424-F464 VanDerWaalsContact CZ-CA 3.48Å; F424-F464 HydrophobicContact CZ-CB 3.73Å; F424-F464 HydrophobicContact CZ-CD2 4.32Å
425	S	92.9	Very high	94.2	Very high	72 Å²	72	55.2 Å²	55.2	50%	0.503	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-55.4	-33.4	179.7	54.6	0	0	0	0	113.5	L419 F427 S428	L419-S425 PolarHBondContact O-N 3.31Å; S425-F427 PolarHBondContact O-N 2.98Å; S425-F427 VanDerWaalsContact O-N 3.11Å; S425-S428 WeakPolarHBondContact CA-OG 3.21Å; S425-S428 WeakPolarHBondContact O-CB 3.44Å; S425-S428 PolarHBondContact O-N 2.91Å; S425-S428 PolarHBondContact O-OG 3.18Å
426	A	93.9	Very high	94.3	Very high	87 Å²	87	55.7 Å²	55.7	72%	0.719	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-59.7	-19.2	177.2	0	0	0	0	0	114.6	F424	F424-A426 PolarHBondContact O-N 3.43Å; F424-A426 VanDerWaalsContact O-N 3.16Å
427	F	94.9	Very high	94.4	Very high	44 Å²	44	56.6 Å²	56.6	19%	0.193	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-103.4	1.5	178.6	-56.7	-79.3	0	0	0	112.8	F424 S425 D429 R430 F431 M455 T460	F424-F427 HydrophobicContact CB-CD2 4.31Å; F424-F427 AromaticContact CD1-CD2 3.89Å; F424-F427 HydrophobicContact CD1-CD2 3.89Å; F424-F427 HydrophobicContact CD1-CE2 4.02Å; F424-F427 PolarHBondContact O-N 3.33Å; S425-F427 PolarHBondContact O-N 2.98Å; S425-F427 VanDerWaalsContact O-N 3.11Å; F427-D429 VanDerWaalsContact C-N 3.34Å; F427-D429 PolarHBondContact O-N 2.82Å; F427-R430 PolarHBondContact O-N 2.91Å; F427-F431 HydrophobicContact CB-CD2 4.18Å; F427-F431 HydrophobicContact CB-CE2 4.19Å; F427-F431 WeakPolarHBondContact O-CD2 3.33Å; F427-F431 PolarHBondContact O-N 3.44Å; F427-F431 VanDerWaalsContact O-N 3.12Å; F427-M455 HydrophobicContact CB-CE 4.13Å; F427-M455 HydrophobicContact CD1-CE 4.23Å; F427-M455 HydrophobicContact CD1-CG 3.85Å; F427-M455 HydrophobicContact CD2-CE 4.04Å; F427-M455 HydrophobicContact CD2-SD 4.49Å; F427-M455 HydrophobicContact CE1-CB 4.39Å; F427-M455 HydrophobicContact CE1-CG 3.64Å; F427-M455 HydrophobicContact CE2-CG 4.44Å; F427-M455 HydrophobicContact CE2-SD 4.43Å; F427-M455 HydrophobicContact CG-CE 3.86Å; F427-M455 HydrophobicContact CG-CG 4.35Å; F427-M455 HydrophobicContact CZ-CG 3.95Å; F427-M455 HydrophobicContact CZ-SD 4.48Å; F427-T460 HydrophobicContact CE2-CG2 3.99Å; F427-T460 HydrophobicContact CZ-CG2 4.11Å
428	S	94	Very high	94.5	Very high	6 Å²	6	54.3 Å²	54.3	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-61.5	-40.3	-172.1	-51.7	0	0	0	0	113.1	Q416 S425 R430 F431 Q432	Q416-S428 PolarHBondContact NE2-O 2.75Å; S425-S428 WeakPolarHBondContact CA-OG 3.21Å; S425-S428 WeakPolarHBondContact O-CB 3.44Å; S425-S428 PolarHBondContact O-N 2.91Å; S425-S428 PolarHBondContact O-OG 3.18Å; S428-R430 VanDerWaalsContact C-N 3.32Å; S428-F431 PolarHBondContact O-N 3.29Å; S428-Q432 PolarHBondContact O-N 2.95Å
429	D	93.9	Very high	94.4	Very high	110 Å²	110	56.9 Å²	56.9	59%	0.588	31%	0.309	S	S	*	.	H	α-helix	trans	-64.6	-42	-179.5	-59.9	-22.7	0	0	0	110.1	F427 Q432 E433	F427-D429 VanDerWaalsContact C-N 3.34Å; F427-D429 PolarHBondContact O-N 2.82Å; D429-Q432 WeakPolarHBondContact O-CB 3.3Å; D429-Q432 PolarHBondContact O-N 2.75Å; D429-Q432 VanDerWaalsContact O-N 3.12Å; D429-E433 WeakPolarHBondContact O-CG 2.95Å; D429-E433 PolarHBondContact O-N 3.48Å
430	R	95.2	Very high	94.5	Very high	83 Å²	83	61 Å²	61	31%	0.313	33%	0.33	S	S	.	.	H	α-helix	trans	-67.5	-40.3	-179.8	-167.8	58.8	177.7	168.7	4	112.7	F427 S428 Q432 E433 L434 D452 L453	F427-R430 PolarHBondContact O-N 2.91Å; S428-R430 VanDerWaalsContact C-N 3.32Å; R430-Q432 VanDerWaalsContact C-N 3.25Å; R430-Q432 PolarHBondContact O-N 3.49Å; R430-E433 WeakPolarHBondContact CD-OE2 3.5Å; R430-E433 IonicContact CZ-OE2 3.84Å; R430-E433 IonicContact NH1-OE2 2.85Å; R430-E433 PolarHBondContact NH1-OE2 3.3Å; R430-E433 PolarHBondContact O-N 2.88Å; R430-L434 WeakPolarHBondContact O-CG 3.42Å; R430-L434 PolarHBondContact O-N 3.1Å; R430-L434 VanDerWaalsContact O-N 3.16Å; R430-D452 PolarHBondContact NE-O 3.2Å; R430-D452 PolarHBondContact NH2-O 3.41Å; R430-D452 VanDerWaalsContact NH2-O 3.1Å; R430-L453 HydrophobicContact CG-CD2 3.99Å
431	F	96.4	Very high	94.7	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.009	31%	0.305	C	S	.	.	H	α-helix	trans	-62.6	-34.5	172.3	-87	-109.6	0	0	0	111.8	V415 L419 F427 S428 Q435 V436 L441 I444 L449 L453 M455 F464	V415-F431 HydrophobicContact CG1-CD1 3.83Å; V415-F431 HydrophobicContact CG1-CE1 4.47Å; L419-F431 HydrophobicContact CD1-CB 3.75Å; L419-F431 HydrophobicContact CD1-CD1 3.82Å; L419-F431 HydrophobicContact CD1-CD2 3.76Å; L419-F431 HydrophobicContact CD1-CE1 4.35Å; L419-F431 HydrophobicContact CD1-CE2 4.28Å; L419-F431 HydrophobicContact CD1-CG 3.5Å; L419-F431 HydrophobicContact CD2-CE1 4.44Å; L419-F431 HydrophobicContact CD2-CE2 4.33Å; L419-F431 HydrophobicContact CD2-CZ 4.25Å; F427-F431 HydrophobicContact CB-CD2 4.18Å; F427-F431 HydrophobicContact CB-CE2 4.19Å; F427-F431 WeakPolarHBondContact O-CD2 3.33Å; F427-F431 PolarHBondContact O-N 3.44Å; F427-F431 VanDerWaalsContact O-N 3.12Å; S428-F431 PolarHBondContact O-N 3.29Å; F431-Q435 PolarHBondContact O-N 3.34Å; F431-V436 HydrophobicContact CB-CB 4.39Å; F431-V436 HydrophobicContact CB-CG2 4.47Å; F431-V436 HydrophobicContact CD1-CB 3.68Å; F431-V436 HydrophobicContact CD1-CG1 3.68Å; F431-V436 HydrophobicContact CD1-CG2 3.94Å; F431-V436 HydrophobicContact CE1-CB 4.43Å; F431-V436 HydrophobicContact CE1-CG1 3.98Å; F431-V436 HydrophobicContact CG-CB 4.37Å; F431-V436 HydrophobicContact CG-CG2 4.36Å; F431-V436 PolarHBondContact O-N 2.96Å; F431-L441 HydrophobicContact CE1-CD1 4.07Å; F431-I444 HydrophobicContact CE1-CD1 4.23Å; F431-I444 HydrophobicContact CZ-CD1 4.29Å; F431-L449 HydrophobicContact CZ-CD2 4.47Å; F431-L453 HydrophobicContact CD2-CD1 4.19Å; F431-L453 HydrophobicContact CD2-CD2 3.59Å; F431-L453 HydrophobicContact CD2-CG 4.47Å; F431-L453 HydrophobicContact CE1-CD1 4.01Å; F431-L453 HydrophobicContact CE2-CB 4.45Å; F431-L453 HydrophobicContact CE2-CD1 3.47Å; F431-L453 VanDerWaalsContact CE2-CD1 3.47Å; F431-L453 HydrophobicContact CE2-CD2 3.72Å; F431-L453 HydrophobicContact CE2-CG 4.11Å; F431-L453 HydrophobicContact CG-CD2 4.07Å; F431-L453 HydrophobicContact CZ-CD1 3.36Å; F431-L453 HydrophobicContact CZ-CD2 4.27Å; F431-L453 HydrophobicContact CZ-CG 4.42Å; F431-M455 HydrophobicContact CE2-CE 3.63Å; F431-M455 HydrophobicContact CZ-CE 4.05Å; F431-F464 HydrophobicContact CE1-CZ 4.13Å; F431-F464 AromaticContact CZ-CE2 3.9Å; F431-F464 HydrophobicContact CZ-CE2 3.9Å; F431-F464 AromaticContact CZ-CZ 3.66Å; F431-F464 HydrophobicContact CZ-CZ 3.66Å
432	Q	95.1	Very high	94.9	Very high	98 Å²	98	53.2 Å²	53.2	46%	0.458	29%	0.294	S	S	.	.	H	α-helix	trans	-72.3	-44.7	177.5	-165.5	175.9	8	0	0	112.8	Q416 S428 D429 R430 L434 Q435	Q416-Q432 VanDerWaalsContact NE2-CB 3.31Å; S428-Q432 PolarHBondContact O-N 2.95Å; D429-Q432 WeakPolarHBondContact O-CB 3.3Å; D429-Q432 PolarHBondContact O-N 2.75Å; D429-Q432 VanDerWaalsContact O-N 3.12Å; R430-Q432 VanDerWaalsContact C-N 3.25Å; R430-Q432 PolarHBondContact O-N 3.49Å; Q432-L434 VanDerWaalsContact C-N 3.27Å; Q432-L434 PolarHBondContact O-N 2.82Å; Q432-Q435 WeakPolarHBondContact O-CA 3.35Å; Q432-Q435 PolarHBondContact O-N 2.76Å
433	E	95.6	Very high	95	Very high	126 Å²	126	54.3 Å²	54.3	59%	0.589	30%	0.299	S	S	*	.	H	α-helix	trans	-56.5	-43.3	176.4	-75.7	174.1	-177.4	0	0	111.5	D429 R430 Q435	D429-E433 WeakPolarHBondContact O-CG 2.95Å; D429-E433 PolarHBondContact O-N 3.48Å; R430-E433 WeakPolarHBondContact CD-OE2 3.5Å; R430-E433 IonicContact CZ-OE2 3.84Å; R430-E433 IonicContact NH1-OE2 2.85Å; R430-E433 PolarHBondContact NH1-OE2 3.3Å; R430-E433 PolarHBondContact O-N 2.88Å; E433-Q435 PolarHBondContact O-N 3.14Å
434	L	96.3	Very high	95.2	Very high	71 Å²	71	53 Å²	53	37%	0.372	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	2.9	177.4	-61.8	-176.7	0	0	0	113.5	R430 Q432 V436 D452 L453	R430-L434 WeakPolarHBondContact O-CG 3.42Å; R430-L434 PolarHBondContact O-N 3.1Å; R430-L434 VanDerWaalsContact O-N 3.16Å; Q432-L434 VanDerWaalsContact C-N 3.27Å; Q432-L434 PolarHBondContact O-N 2.82Å; L434-V436 HydrophobicContact CB-CG2 4.02Å; L434-V436 PolarHBondContact O-N 3.06Å; L434-D452 HydrophobicContact CD1-CB 4.03Å; L434-L453 HydrophobicContact CD1-CD2 3.77Å; L434-L453 HydrophobicContact CD1-CG 4.37Å
435	Q	96.2	Very high	95.1	Very high	144 Å²	144	55.7 Å²	55.7	67%	0.673	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	39.1	179.4	-57.2	-175.2	-6.3	0	0	113.7	T412 F431 Q432 E433 D437	T412-Q435 HydrophobicContact CG2-CB 4.22Å; F431-Q435 PolarHBondContact O-N 3.34Å; Q432-Q435 WeakPolarHBondContact O-CA 3.35Å; Q432-Q435 PolarHBondContact O-N 2.76Å; E433-Q435 PolarHBondContact O-N 3.14Å; Q435-D437 PolarHBondContact O-N 2.91Å; Q435-D437 VanDerWaalsContact O-N 3.09Å
436	V	97.1	Very high	95.1	Very high	11 Å²	11	55.3 Å²	55.3	7%	0.067	29%	0.29	C	S	.	.			trans	-65.9	112.8	179.7	-176.6	0	0	0	0	109.4	F431 L434 L440 L441	F431-V436 HydrophobicContact CB-CB 4.39Å; F431-V436 HydrophobicContact CB-CG2 4.47Å; F431-V436 HydrophobicContact CD1-CB 3.68Å; F431-V436 HydrophobicContact CD1-CG1 3.68Å; F431-V436 HydrophobicContact CD1-CG2 3.94Å; F431-V436 HydrophobicContact CE1-CB 4.43Å; F431-V436 HydrophobicContact CE1-CG1 3.98Å; F431-V436 HydrophobicContact CG-CB 4.37Å; F431-V436 HydrophobicContact CG-CG2 4.36Å; F431-V436 PolarHBondContact O-N 2.96Å; L434-V436 HydrophobicContact CB-CG2 4.02Å; L434-V436 PolarHBondContact O-N 3.06Å; V436-L440 HydrophobicContact CG1-CB 3.97Å; V436-L441 HydrophobicContact CG1-CB 4.24Å
437	D	96.4	Very high	95	Very high	47 Å²	47	58.1 Å²	58.1	25%	0.251	29%	0.288	S	S	.	.			trans	-102.6	-170.6	176.3	70.8	-2.6	0	0	0	111.4	Q435 D439 L440 L441	Q435-D437 PolarHBondContact O-N 2.91Å; Q435-D437 VanDerWaalsContact O-N 3.09Å; D437-D439 PolarHBondContact O-N 3.46Å; D437-D439 PolarHBondContact OD1-N 3.16Å; D437-L440 WeakPolarHBondContact OD1-CG 3.4Å; D437-L440 PolarHBondContact OD1-N 3.07Å; D437-L440 VanDerWaalsContact OD1-N 3.16Å; D437-L441 WeakPolarHBondContact O-CB 3.46Å; D437-L441 PolarHBondContact O-N 3.38Å
438	G	95.6	Very high	95	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-40.6	-176.1	0	0	0	0	0	114.7	V407 W410 L442	V407-G438 VanDerWaalsContact O-CA 3.32Å; V407-G438 WeakPolarHBondContact O-CA 3.26Å; W410-G438 PolarHBondContact O-N 3.5Å; G438-L442 WeakPolarHBondContact O-CB 3.3Å; G438-L442 WeakPolarHBondContact O-CG 3.15Å; G438-L442 PolarHBondContact O-N 3.16Å; G438-L442 VanDerWaalsContact O-N 3.08Å
439	D	94.8	Very high	95	Very high	55 Å²	55	58.4 Å²	58.4	29%	0.294	29%	0.291	S	S	.	.	H	α-helix	trans	-65.5	-52.2	178.3	172.9	33.7	0	0	0	110.6	D437 L441 L442 N443 Y501	D437-D439 PolarHBondContact O-N 3.46Å; D437-D439 PolarHBondContact OD1-N 3.16Å; D439-L441 VanDerWaalsContact C-N 3.31Å; D439-L441 PolarHBondContact O-N 2.76Å; D439-L442 PolarHBondContact O-N 3.08Å; D439-L442 VanDerWaalsContact O-N 3.13Å; D439-N443 PolarHBondContact O-N 2.91Å; D439-N443 VanDerWaalsContact O-N 3.14Å; D439-N443 PolarHBondContact O-ND2 3.12Å; D439-N443 PolarHBondContact OD1-ND2 3.2Å; D439-Y501 WeakPolarHBondContact OD1-CE1 3.45Å; D439-Y501 PolarHBondContact OD1-OH 2.75Å
440	L	95.9	Very high	95.1	Very high	87 Å²	87	55.4 Å²	55.4	46%	0.455	28%	0.278	S	S	.	.	H	α-helix	trans	-60.1	-40.7	177.6	-68.1	176.7	0	0	0	112	V436 D437 L442 N443 I444	V436-L440 HydrophobicContact CG1-CB 3.97Å; D437-L440 WeakPolarHBondContact OD1-CG 3.4Å; D437-L440 PolarHBondContact OD1-N 3.07Å; D437-L440 VanDerWaalsContact OD1-N 3.16Å; L440-L442 VanDerWaalsContact C-N 3.33Å; L440-L442 PolarHBondContact O-N 2.83Å; L440-N443 PolarHBondContact O-N 3.47Å; L440-I444 PolarHBondContact O-N 3.35Å
441	L	96.9	Very high	95	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.3	-40	177	178.8	64.9	0	0	0	112.2	W410 V415 W418 F431 V436 D437 D439 N443 I444 F464 L468 L471	W410-L441 HydrophobicContact CE3-CD2 4.31Å; W410-L441 HydrophobicContact CZ3-CD2 4.14Å; V415-L441 HydrophobicContact CG1-CD2 4.26Å; V415-L441 HydrophobicContact CG2-CD2 4.12Å; W418-L441 HydrophobicContact CE3-CD2 4.09Å; W418-L441 HydrophobicContact CZ3-CD1 4.02Å; W418-L441 HydrophobicContact CZ3-CD2 4.19Å; F431-L441 HydrophobicContact CE1-CD1 4.07Å; V436-L441 HydrophobicContact CG1-CB 4.24Å; D437-L441 WeakPolarHBondContact O-CB 3.46Å; D437-L441 PolarHBondContact O-N 3.38Å; D439-L441 VanDerWaalsContact C-N 3.31Å; D439-L441 PolarHBondContact O-N 2.76Å; L441-N443 VanDerWaalsContact C-N 3.27Å; L441-N443 PolarHBondContact O-N 3.25Å; L441-I444 WeakPolarHBondContact O-CG2 3.41Å; L441-F464 HydrophobicContact CD1-CZ 3.85Å; L441-L468 HydrophobicContact CD1-CD1 4.09Å; L441-L468 HydrophobicContact CG-CD1 3.94Å; L441-L471 HydrophobicContact CD2-CD2 3.75Å
442	L	95.6	Very high	94.8	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-70.9	-24.1	179.2	-71.6	172.3	0	0	0	112.3	V407 P408 G438 D439 L440 K472 Y477 Y501	V407-L442 HydrophobicContact CB-CD1 4.23Å; V407-L442 HydrophobicContact CB-CD2 4.48Å; V407-L442 HydrophobicContact CG1-CD1 3.94Å; V407-L442 HydrophobicContact CG1-CD2 3.88Å; V407-L442 HydrophobicContact CG1-CG 3.86Å; P408-L442 HydrophobicContact CB-CD1 4.41Å; P408-L442 HydrophobicContact CG-CD1 3.87Å; G438-L442 WeakPolarHBondContact O-CB 3.3Å; G438-L442 WeakPolarHBondContact O-CG 3.15Å; G438-L442 PolarHBondContact O-N 3.16Å; G438-L442 VanDerWaalsContact O-N 3.08Å; D439-L442 PolarHBondContact O-N 3.08Å; D439-L442 VanDerWaalsContact O-N 3.13Å; L440-L442 VanDerWaalsContact C-N 3.33Å; L440-L442 PolarHBondContact O-N 2.83Å; L442-K472 HydrophobicContact CD2-CD 4.49Å; L442-K472 HydrophobicContact CD2-CG 3.64Å; L442-K472 WeakPolarHBondContact O-CE 3.4Å; L442-K472 PolarHBondContact O-NZ 3.29Å; L442-Y477 HydrophobicContact CD1-CE1 4.28Å; L442-Y501 HydrophobicContact CB-CD1 3.46Å; L442-Y501 VanDerWaalsContact CB-CD1 3.46Å; L442-Y501 HydrophobicContact CB-CE1 3.72Å; L442-Y501 HydrophobicContact CB-CG 4.13Å; L442-Y501 HydrophobicContact CD1-CD1 3.85Å; L442-Y501 HydrophobicContact CD1-CD2 3.92Å; L442-Y501 HydrophobicContact CD1-CE1 3.93Å; L442-Y501 HydrophobicContact CD1-CE2 4.05Å; L442-Y501 HydrophobicContact CD1-CG 3.81Å; L442-Y501 HydrophobicContact CG-CD1 4.27Å; L442-Y501 HydrophobicContact CG-CE1 4.5Å
443	N	93	Very high	94.7	Very high	48 Å²	48	53.8 Å²	53.8	26%	0.257	29%	0.285	S	S	.	.	H	α-helix	trans	-100.7	-0.2	-179.7	-73.6	-37.9	0	0	0	115	D439 L440 L441 Y501 Q505	D439-N443 PolarHBondContact O-N 2.91Å; D439-N443 VanDerWaalsContact O-N 3.14Å; D439-N443 PolarHBondContact O-ND2 3.12Å; D439-N443 PolarHBondContact OD1-ND2 3.2Å; L440-N443 PolarHBondContact O-N 3.47Å; L441-N443 VanDerWaalsContact C-N 3.27Å; L441-N443 PolarHBondContact O-N 3.25Å; N443-Y501 WeakPolarHBondContact ND2-CE1 3.28Å; N443-Q505 PolarHBondContact ND2-NE2 3.48Å; N443-Q505 PolarHBondContact ND2-OE1 3.42Å; N443-Q505 PolarHBondContact OD1-OE1 2.98Å
444	I	94.5	Very high	94.5	Very high	20 Å²	20	52.8 Å²	52.8	10%	0.103	28%	0.283	C	S	.	.			trans	-63.4	136.6	-174.2	-151.5	163.1	0	0	0	113.7	F431 L440 L441 D448 L449 L453 F464 L468	F431-I444 HydrophobicContact CE1-CD1 4.23Å; F431-I444 HydrophobicContact CZ-CD1 4.29Å; L440-I444 PolarHBondContact O-N 3.35Å; L441-I444 WeakPolarHBondContact O-CG2 3.41Å; I444-D448 HydrophobicContact CG1-CB 3.92Å; I444-L449 HydrophobicContact CD1-CD2 4.02Å; I444-L449 HydrophobicContact CD1-CG 4.4Å; I444-L449 HydrophobicContact CG1-CD2 4.46Å; I444-L449 HydrophobicContact CG1-CG 4.33Å; I444-L453 HydrophobicContact CD1-CD1 3.31Å; I444-L453 HydrophobicContact CG1-CD1 4.46Å; I444-F464 HydrophobicContact CG2-CE1 4.04Å; I444-L468 HydrophobicContact CG2-CD2 3.54Å
445	T	92.3	Very high	94.4	Very high	57 Å²	57	49.4 Å²	49.4	35%	0.35	27%	0.266	S	S	.	.			trans	-105.1	168.2	-178.2	72.7	0	0	0	0	112.5	E447 D448 L449	T445-E447 PolarHBondContact O-N 2.93Å; T445-E447 PolarHBondContact OG1-N 3.08Å; T445-D448 WeakPolarHBondContact CB-OD2 3.16Å; T445-D448 PolarHBondContact N-OD2 2.93Å; T445-D448 PolarHBondContact OG1-N 2.91Å; T445-D448 PolarHBondContact OG1-OD1 3.17Å; T445-D448 PolarHBondContact OG1-OD2 3.47Å; T445-L449 VanDerWaalsContact O-CG 3.26Å; T445-L449 WeakPolarHBondContact O-CG 3.48Å; T445-L449 PolarHBondContact O-N 3.5Å
446	D	93.3	Very high	94.2	Very high	64 Å²	64	46.8 Å²	46.8	34%	0.342	27%	0.269	S	S	.	.	H	α-helix	trans	-64.1	-29.4	173.5	-166.4	72.1	0	0	0	111.8	S450 R461 L465	D446-S450 WeakPolarHBondContact O-CB 3.28Å; D446-S450 PolarHBondContact O-N 3.04Å; D446-S450 VanDerWaalsContact O-N 3.09Å; D446-S450 PolarHBondContact O-OG 3.33Å; D446-R461 VanDerWaalsContact CG-NE 3.26Å; D446-R461 WeakPolarHBondContact OD1-CB 3.38Å; D446-R461 WeakPolarHBondContact OD1-CD 3.16Å; D446-R461 IonicContact OD1-CZ 3.9Å; D446-R461 IonicContact OD1-NE 2.89Å; D446-R461 PolarHBondContact OD1-NE 2.9Å; D446-R461 IonicContact OD1-NH2 4Å; D446-R461 IonicContact OD2-CZ 3.49Å; D446-R461 IonicContact OD2-NE 3.09Å; D446-R461 PolarHBondContact OD2-NE 3.46Å; D446-R461 VanDerWaalsContact OD2-NE 3.09Å; D446-R461 IonicContact OD2-NH2 3.01Å; D446-R461 PolarHBondContact OD2-NH2 3.21Å; D446-L465 HydrophobicContact CB-CD1 4.4Å
447	E	93	Very high	94.1	Very high	146 Å²	146	48.8 Å²	48.8	68%	0.682	29%	0.287	S	S	*	.	H	α-helix	trans	-67.4	-53.2	178.2	-69.4	177.8	-171.3	0	0	110	T445 L449 S450 S451	T445-E447 PolarHBondContact O-N 2.93Å; T445-E447 PolarHBondContact OG1-N 3.08Å; E447-L449 VanDerWaalsContact C-N 3.26Å; E447-L449 PolarHBondContact O-N 2.89Å; E447-S450 CarbonylContact O-C 3.57Å; E447-S450 WeakPolarHBondContact O-CA 3.26Å; E447-S450 WeakPolarHBondContact O-CB 3.32Å; E447-S450 PolarHBondContact O-N 2.85Å; E447-S450 PolarHBondContact O-OG 3.37Å; E447-S451 PolarHBondContact O-N 3.49Å; E447-S451 PolarHBondContact O-OG 2.89Å; E447-S451 VanDerWaalsContact O-OG 3.12Å
448	D	94.3	Very high	93.9	Very high	57 Å²	57	48 Å²	48	31%	0.305	29%	0.29	S	S	.	.	H	α-helix	trans	-56.5	-41	177	-48.5	-41.7	0	0	0	111.8	I444 T445 S450 D452 L453	I444-D448 HydrophobicContact CG1-CB 3.92Å; T445-D448 WeakPolarHBondContact CB-OD2 3.16Å; T445-D448 PolarHBondContact N-OD2 2.93Å; T445-D448 PolarHBondContact OG1-N 2.91Å; T445-D448 PolarHBondContact OG1-OD1 3.17Å; T445-D448 PolarHBondContact OG1-OD2 3.47Å; D448-S450 PolarHBondContact O-N 3.16Å; D448-D452 WeakPolarHBondContact O-CB 3.49Å; D448-D452 PolarHBondContact O-N 3.47Å; D448-L453 PolarHBondContact O-N 3.46Å; D448-L453 VanDerWaalsContact O-N 3.1Å
449	L	94.6	Very high	93.9	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-61.4	-36.6	175.9	-72.6	169.1	0	0	0	111.8	F431 I444 T445 E447 L453 M455 R461 F464 L465	F431-L449 HydrophobicContact CZ-CD2 4.47Å; I444-L449 HydrophobicContact CD1-CD2 4.02Å; I444-L449 HydrophobicContact CD1-CG 4.4Å; I444-L449 HydrophobicContact CG1-CD2 4.46Å; I444-L449 HydrophobicContact CG1-CG 4.33Å; T445-L449 VanDerWaalsContact O-CG 3.26Å; T445-L449 WeakPolarHBondContact O-CG 3.48Å; T445-L449 PolarHBondContact O-N 3.5Å; E447-L449 VanDerWaalsContact C-N 3.26Å; E447-L449 PolarHBondContact O-N 2.89Å; L449-L453 HydrophobicContact CD2-CD1 3.68Å; L449-M455 HydrophobicContact CD2-CE 3.69Å; L449-M455 HydrophobicContact CD2-SD 3.86Å; L449-M455 WeakPolarHBondContact O-CA 3.4Å; L449-M455 VanDerWaalsContact O-CB 3.24Å; L449-M455 WeakPolarHBondContact O-CB 3.27Å; L449-M455 PolarHBondContact O-N 3.33Å; L449-R461 HydrophobicContact CB-CG 4.14Å; L449-F464 HydrophobicContact CD1-CD1 3.63Å; L449-F464 HydrophobicContact CD1-CE1 4.1Å; L449-F464 HydrophobicContact CD2-CD1 3.6Å; L449-F464 HydrophobicContact CD2-CE1 3.58Å; L449-F464 HydrophobicContact CD2-CG 4.25Å; L449-F464 HydrophobicContact CD2-CZ 4.2Å; L449-F464 HydrophobicContact CG-CD1 4.29Å; L449-F464 HydrophobicContact CG-CE1 4.43Å; L449-L465 HydrophobicContact CD1-CD1 4.38Å; L449-L465 HydrophobicContact CD1-CD2 3.76Å; L449-L465 HydrophobicContact CD1-CG 3.87Å
450	S	95.1	Very high	93.9	Very high	46 Å²	46	54 Å²	54	32%	0.322	32%	0.322	S	S	.	.	H	α-helix	trans	-82.8	-45.1	-176.9	75.6	0	0	0	0	113.5	D446 E447 D448	D446-S450 WeakPolarHBondContact O-CB 3.28Å; D446-S450 PolarHBondContact O-N 3.04Å; D446-S450 VanDerWaalsContact O-N 3.09Å; D446-S450 PolarHBondContact O-OG 3.33Å; E447-S450 CarbonylContact O-C 3.57Å; E447-S450 WeakPolarHBondContact O-CA 3.26Å; E447-S450 WeakPolarHBondContact O-CB 3.32Å; E447-S450 PolarHBondContact O-N 2.85Å; E447-S450 PolarHBondContact O-OG 3.37Å; D448-S450 PolarHBondContact O-N 3.16Å
451	S	93.1	Very high	93.9	Very high	70 Å²	70	51.6 Å²	51.6	49%	0.49	31%	0.307	S	S	.	.	H	α-helix	trans	-86.3	-44.3	-173.1	60.6	0	0	0	0	112.4	E447	E447-S451 PolarHBondContact O-N 3.49Å; E447-S451 PolarHBondContact O-OG 2.89Å; E447-S451 VanDerWaalsContact O-OG 3.12Å
452	D	92.6	Very high	93.8	Very high	76 Å²	76	58.5 Å²	58.5	41%	0.406	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-39.3	-165	-60.3	-5.5	0	0	0	110.9	R430 L434 D448	R430-D452 PolarHBondContact NE-O 3.2Å; R430-D452 PolarHBondContact NH2-O 3.41Å; R430-D452 VanDerWaalsContact NH2-O 3.1Å; L434-D452 HydrophobicContact CD1-CB 4.03Å; D448-D452 WeakPolarHBondContact O-CB 3.49Å; D448-D452 PolarHBondContact O-N 3.47Å
453	L	92.4	Very high	93.8	Very high	4 Å²	4	63.7 Å²	63.7	2%	0.021	36%	0.356	C	S	.	.	S	Bend	trans	-93	1.3	-179.8	-66.3	173.3	0	0	0	114.4	R430 F431 L434 I444 D448 L449 M455	R430-L453 HydrophobicContact CG-CD2 3.99Å; F431-L453 HydrophobicContact CD2-CD1 4.19Å; F431-L453 HydrophobicContact CD2-CD2 3.59Å; F431-L453 HydrophobicContact CD2-CG 4.47Å; F431-L453 HydrophobicContact CE1-CD1 4.01Å; F431-L453 HydrophobicContact CE2-CB 4.45Å; F431-L453 HydrophobicContact CE2-CD1 3.47Å; F431-L453 VanDerWaalsContact CE2-CD1 3.47Å; F431-L453 HydrophobicContact CE2-CD2 3.72Å; F431-L453 HydrophobicContact CE2-CG 4.11Å; F431-L453 HydrophobicContact CG-CD2 4.07Å; F431-L453 HydrophobicContact CZ-CD1 3.36Å; F431-L453 HydrophobicContact CZ-CD2 4.27Å; F431-L453 HydrophobicContact CZ-CG 4.42Å; L434-L453 HydrophobicContact CD1-CD2 3.77Å; L434-L453 HydrophobicContact CD1-CG 4.37Å; I444-L453 HydrophobicContact CD1-CD1 3.31Å; I444-L453 HydrophobicContact CG1-CD1 4.46Å; D448-L453 PolarHBondContact O-N 3.46Å; D448-L453 VanDerWaalsContact O-N 3.1Å; L449-L453 HydrophobicContact CD2-CD1 3.68Å; L453-M455 VanDerWaalsContact C-N 3.25Å; L453-M455 PolarHBondContact O-N 3.17Å
454	N	91.9	Very high	93.9	Very high	104 Å²	104	61.4 Å²	61.4	56%	0.556	34%	0.344	S	S	*	.			trans	57.4	29.1	175.5	-65.1	-32.4	0	0	0	115	A456	N454-A456 VanDerWaalsContact C-N 3.26Å; N454-A456 PolarHBondContact O-N 3.27Å
455	M	94.8	Very high	93.9	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.005	35%	0.351	C	S	.	.			trans	-81.5	70.8	171.4	-58.4	-160.8	-164.5	0	0	111	F427 F431 L449 L453 A457 R461 F464	F427-M455 HydrophobicContact CB-CE 4.13Å; F427-M455 HydrophobicContact CD1-CE 4.23Å; F427-M455 HydrophobicContact CD1-CG 3.85Å; F427-M455 HydrophobicContact CD2-CE 4.04Å; F427-M455 HydrophobicContact CD2-SD 4.49Å; F427-M455 HydrophobicContact CE1-CB 4.39Å; F427-M455 HydrophobicContact CE1-CG 3.64Å; F427-M455 HydrophobicContact CE2-CG 4.44Å; F427-M455 HydrophobicContact CE2-SD 4.43Å; F427-M455 HydrophobicContact CG-CE 3.86Å; F427-M455 HydrophobicContact CG-CG 4.35Å; F427-M455 HydrophobicContact CZ-CG 3.95Å; F427-M455 HydrophobicContact CZ-SD 4.48Å; F431-M455 HydrophobicContact CE2-CE 3.63Å; F431-M455 HydrophobicContact CZ-CE 4.05Å; L449-M455 HydrophobicContact CD2-CE 3.69Å; L449-M455 HydrophobicContact CD2-SD 3.86Å; L449-M455 WeakPolarHBondContact O-CA 3.4Å; L449-M455 VanDerWaalsContact O-CB 3.24Å; L449-M455 WeakPolarHBondContact O-CB 3.27Å; L449-M455 PolarHBondContact O-N 3.33Å; L453-M455 VanDerWaalsContact C-N 3.25Å; L453-M455 PolarHBondContact O-N 3.17Å; M455-A457 VanDerWaalsContact C-N 3.32Å; M455-A457 PolarHBondContact O-N 3.36Å; M455-R461 HydrophobicContact CB-CG 3.56Å; M455-R461 VanDerWaalsContact O-CD 3.25Å; M455-R461 WeakPolarHBondContact O-CD 3.37Å; M455-R461 VanDerWaalsContact O-CG 3.27Å; M455-R461 WeakPolarHBondContact O-CG 3.13Å; M455-R461 PolarHBondContact O-NH1 3.17Å; M455-F464 HydrophobicContact CE-CD2 3.95Å; M455-F464 HydrophobicContact CE-CE2 4.2Å; M455-F464 HydrophobicContact CE-CG 4.25Å; M455-F464 HydrophobicContact SD-CB 4.3Å; M455-F464 HydrophobicContact SD-CG 4.34Å
456	A	91.1	Very high	94	Very high	89 Å²	89	65.7 Å²	65.7	74%	0.736	36%	0.356	S	S	*	.			trans	-59.2	-39.5	-174.7	0	0	0	0	0	113.6	N454 G458 R461	N454-A456 VanDerWaalsContact C-N 3.26Å; N454-A456 PolarHBondContact O-N 3.27Å; A456-G458 PolarHBondContact O-N 3.38Å; A456-R461 PolarHBondContact O-NH1 3.34Å
457	A	94.1	Very high	94.1	Very high	53 Å²	53	63.3 Å²	63.3	44%	0.438	34%	0.343	S	S	.	.			trans	-73.3	113.9	-178.6	0	0	0	0	0	111.8	M455 L459 T460 R461	M455-A457 VanDerWaalsContact C-N 3.32Å; M455-A457 PolarHBondContact O-N 3.36Å; A457-L459 PolarHBondContact O-N 3.4Å; A457-T460 WeakPolarHBondContact O-CB 3.41Å; A457-T460 PolarHBondContact O-N 2.98Å; A457-R461 PolarHBondContact O-N 3.23Å
458	G	93.9	Very high	94.2	Very high	31 Å²	31	56.5 Å²	56.5	32%	0.32	31%	0.311	S	S	.	.	H	α-helix	trans	-60.3	-28.8	-179.1	0	0	0	0	0	114.6	A456 R461 K462	A456-G458 PolarHBondContact O-N 3.38Å; G458-R461 PolarHBondContact O-N 3.49Å; G458-K462 WeakPolarHBondContact O-CG 3.4Å; G458-K462 PolarHBondContact O-N 3.41Å
459	L	94.7	Very high	94.2	Very high	143 Å²	143	59.3 Å²	59.3	75%	0.749	32%	0.318	S	S	*	.	H	α-helix	trans	-67.8	-37.7	173.5	-71.1	176.4	0	0	0	112.3	A457 K462 R463	A457-L459 PolarHBondContact O-N 3.4Å; L459-K462 PolarHBondContact O-N 2.86Å; L459-R463 PolarHBondContact O-N 2.88Å
460	T	94.7	Very high	94.1	Very high	36 Å²	36	60.9 Å²	60.9	22%	0.221	33%	0.327	C	S	.	.	H	α-helix	trans	-64.2	-43.6	175.5	-57	0	0	0	0	110.5	F424 F427 A457 R463 F464	F424-T460 HydrophobicContact CD1-CG2 4.47Å; F424-T460 HydrophobicContact CE1-CG2 3.78Å; F427-T460 HydrophobicContact CE2-CG2 3.99Å; F427-T460 HydrophobicContact CZ-CG2 4.11Å; A457-T460 WeakPolarHBondContact O-CB 3.41Å; A457-T460 PolarHBondContact O-N 2.98Å; T460-R463 WeakPolarHBondContact O-CB 3.23Å; T460-R463 PolarHBondContact O-N 3.04Å; T460-F464 PolarHBondContact O-N 3.4Å
461	R	95.8	Very high	94	Very high	38 Å²	38	58.8 Å²	58.8	14%	0.143	31%	0.312	C	S	.	.	H	α-helix	trans	-62.6	-43.8	174.5	-62.3	-162.8	-54.7	-91.9	11.8	112.7	D446 L449 M455 A456 A457 G458 R463 F464 L465	D446-R461 VanDerWaalsContact CG-NE 3.26Å; D446-R461 WeakPolarHBondContact OD1-CB 3.38Å; D446-R461 WeakPolarHBondContact OD1-CD 3.16Å; D446-R461 IonicContact OD1-CZ 3.9Å; D446-R461 IonicContact OD1-NE 2.89Å; D446-R461 PolarHBondContact OD1-NE 2.9Å; D446-R461 IonicContact OD1-NH2 4Å; D446-R461 IonicContact OD2-CZ 3.49Å; D446-R461 IonicContact OD2-NE 3.09Å; D446-R461 PolarHBondContact OD2-NE 3.46Å; D446-R461 VanDerWaalsContact OD2-NE 3.09Å; D446-R461 IonicContact OD2-NH2 3.01Å; D446-R461 PolarHBondContact OD2-NH2 3.21Å; L449-R461 HydrophobicContact CB-CG 4.14Å; M455-R461 HydrophobicContact CB-CG 3.56Å; M455-R461 VanDerWaalsContact O-CD 3.25Å; M455-R461 WeakPolarHBondContact O-CD 3.37Å; M455-R461 VanDerWaalsContact O-CG 3.27Å; M455-R461 WeakPolarHBondContact O-CG 3.13Å; M455-R461 PolarHBondContact O-NH1 3.17Å; A456-R461 PolarHBondContact O-NH1 3.34Å; A457-R461 PolarHBondContact O-N 3.23Å; G458-R461 PolarHBondContact O-N 3.49Å; R461-R463 VanDerWaalsContact C-N 3.29Å; R461-R463 PolarHBondContact O-N 2.9Å; R461-F464 WeakPolarHBondContact O-CB 3.29Å; R461-F464 PolarHBondContact O-N 3.16Å; R461-F464 VanDerWaalsContact O-N 3.17Å; R461-L465 WeakPolarHBondContact O-CB 3.18Å; R461-L465 WeakPolarHBondContact O-CG 3.42Å; R461-L465 PolarHBondContact O-N 3.44Å
462	K	94.8	Very high	94.1	Very high	144 Å²	144	57.4 Å²	57.4	63%	0.626	30%	0.298	S	S	*	.	H	α-helix	trans	-59.7	-38.7	174.1	-75.5	177.2	-179.3	-179.6	0	112.5	G458 L459 R466	G458-K462 WeakPolarHBondContact O-CG 3.4Å; G458-K462 PolarHBondContact O-N 3.41Å; L459-K462 PolarHBondContact O-N 2.86Å; K462-R466 WeakPolarHBondContact O-CB 3.2Å; K462-R466 PolarHBondContact O-N 3.01Å
463	R	94.9	Very high	94.1	Very high	110 Å²	110	55.6 Å²	55.6	42%	0.415	29%	0.29	S	S	.	.	H	α-helix	trans	-65.7	-46	174.6	-168.9	-180	74.1	-168.3	3.5	110.7	F424 L459 T460 R461 R466 D467	F424-R463 HydrophobicContact CE2-CG 4.38Å; F424-R463 HydrophobicContact CZ-CB 4.03Å; F424-R463 HydrophobicContact CZ-CG 3.98Å; F424-R463 VanDerWaalsContact CZ-NE 3.28Å; L459-R463 PolarHBondContact O-N 2.88Å; T460-R463 WeakPolarHBondContact O-CB 3.23Å; T460-R463 PolarHBondContact O-N 3.04Å; R461-R463 VanDerWaalsContact C-N 3.29Å; R461-R463 PolarHBondContact O-N 2.9Å; R463-R466 WeakPolarHBondContact O-CB 3.32Å; R463-R466 PolarHBondContact O-N 2.7Å; R463-R466 VanDerWaalsContact O-N 3.16Å; R463-D467 PolarHBondContact O-N 3.02Å
464	F	96.4	Very high	93.9	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58.4	-51.9	176.8	-178.9	-92.8	0	0	0	111.6	W418 L419 F424 F431 L441 I444 L449 M455 T460 R461 R466 D467 L468	W418-F464 AromaticContact CH2-CE2 3.93Å; W418-F464 HydrophobicContact CH2-CE2 3.93Å; W418-F464 HydrophobicContact CH2-CZ 4.13Å; W418-F464 AromaticContact CZ3-CE2 3.68Å; W418-F464 HydrophobicContact CZ3-CE2 3.68Å; W418-F464 AromaticContact CZ3-CZ 3.91Å; W418-F464 HydrophobicContact CZ3-CZ 3.91Å; L419-F464 HydrophobicContact CD2-CE2 3.66Å; F424-F464 HydrophobicContact CD1-CB 4.37Å; F424-F464 AromaticContact CD1-CD2 3.91Å; F424-F464 HydrophobicContact CD1-CD2 3.91Å; F424-F464 HydrophobicContact CD2-CD2 4.42Å; F424-F464 HydrophobicContact CE1-CB 3.65Å; F424-F464 HydrophobicContact CE1-CD2 4.03Å; F424-F464 HydrophobicContact CE1-CG 4.35Å; F424-F464 HydrophobicContact CG-CD2 4.11Å; F424-F464 VanDerWaalsContact CZ-CA 3.48Å; F424-F464 HydrophobicContact CZ-CB 3.73Å; F424-F464 HydrophobicContact CZ-CD2 4.32Å; F431-F464 HydrophobicContact CE1-CZ 4.13Å; F431-F464 AromaticContact CZ-CE2 3.9Å; F431-F464 HydrophobicContact CZ-CE2 3.9Å; F431-F464 AromaticContact CZ-CZ 3.66Å; F431-F464 HydrophobicContact CZ-CZ 3.66Å; L441-F464 HydrophobicContact CD1-CZ 3.85Å; I444-F464 HydrophobicContact CG2-CE1 4.04Å; L449-F464 HydrophobicContact CD1-CD1 3.63Å; L449-F464 HydrophobicContact CD1-CE1 4.1Å; L449-F464 HydrophobicContact CD2-CD1 3.6Å; L449-F464 HydrophobicContact CD2-CE1 3.58Å; L449-F464 HydrophobicContact CD2-CG 4.25Å; L449-F464 HydrophobicContact CD2-CZ 4.2Å; L449-F464 HydrophobicContact CG-CD1 4.29Å; L449-F464 HydrophobicContact CG-CE1 4.43Å; M455-F464 HydrophobicContact CE-CD2 3.95Å; M455-F464 HydrophobicContact CE-CE2 4.2Å; M455-F464 HydrophobicContact CE-CG 4.25Å; M455-F464 HydrophobicContact SD-CB 4.3Å; M455-F464 HydrophobicContact SD-CG 4.34Å; T460-F464 PolarHBondContact O-N 3.4Å; R461-F464 WeakPolarHBondContact O-CB 3.29Å; R461-F464 PolarHBondContact O-N 3.16Å; R461-F464 VanDerWaalsContact O-N 3.17Å; F464-R466 PolarHBondContact O-N 3.17Å; F464-D467 PolarHBondContact O-N 3Å; F464-L468 HydrophobicContact CE1-CB 4.44Å; F464-L468 HydrophobicContact CE1-CD2 4.21Å; F464-L468 WeakPolarHBondContact O-CB 3.36Å; F464-L468 PolarHBondContact O-N 3.17Å
465	L	95.1	Very high	93.9	Very high	46 Å²	46	54.1 Å²	54.1	24%	0.241	28%	0.277	C	S	.	.	H	α-helix	trans	-63.1	-27.5	178	-69	173.5	0	0	0	112.5	D446 L449 R461 L468 R469	D446-L465 HydrophobicContact CB-CD1 4.4Å; L449-L465 HydrophobicContact CD1-CD1 4.38Å; L449-L465 HydrophobicContact CD1-CD2 3.76Å; L449-L465 HydrophobicContact CD1-CG 3.87Å; R461-L465 WeakPolarHBondContact O-CB 3.18Å; R461-L465 WeakPolarHBondContact O-CG 3.42Å; R461-L465 PolarHBondContact O-N 3.44Å; L465-L468 HydrophobicContact CD2-CD2 4.29Å; L465-R469 WeakPolarHBondContact O-CB 3.38Å; L465-R469 WeakPolarHBondContact O-CG 3.48Å; L465-R469 PolarHBondContact O-N 3.11Å; L465-R469 VanDerWaalsContact O-N 3.07Å; L465-R469 PolarHBondContact O-NE 3.19Å
466	R	93.9	Very high	93.7	Very high	121 Å²	121	56.7 Å²	56.7	46%	0.457	29%	0.291	S	S	.	.	H	α-helix	trans	-66.7	-47.4	170.1	-176.7	-163.6	66.4	-168.9	-2.4	111.1	K462 R463 F464 R469 V470	K462-R466 WeakPolarHBondContact O-CB 3.2Å; K462-R466 PolarHBondContact O-N 3.01Å; R463-R466 WeakPolarHBondContact O-CB 3.32Å; R463-R466 PolarHBondContact O-N 2.7Å; R463-R466 VanDerWaalsContact O-N 3.16Å; F464-R466 PolarHBondContact O-N 3.17Å; R466-R469 WeakPolarHBondContact O-CB 3.26Å; R466-R469 PolarHBondContact O-N 3.1Å; R466-V470 PolarHBondContact O-N 3.45Å
467	D	94	Very high	93.8	Very high	14 Å²	14	52.6 Å²	52.6	8%	0.075	26%	0.256	C	S	.	.	H	α-helix	trans	-71.9	-33	-178.4	-59.9	-37.2	0	0	0	111.4	W418 R463 F464 V470 L471	W418-D467 HydrophobicContact CZ2-CB 4.44Å; R463-D467 PolarHBondContact O-N 3.02Å; F464-D467 PolarHBondContact O-N 3Å; D467-V470 WeakPolarHBondContact O-CB 3.35Å; D467-V470 PolarHBondContact O-N 3.12Å; D467-L471 PolarHBondContact O-N 3.31Å
468	L	95.7	Very high	93.5	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-63.1	-40.2	169.6	-179.3	60.8	0	0	0	112.1	W418 L441 I444 F464 L465 V470 L471 K472	W418-L468 HydrophobicContact CH2-CB 4.35Å; W418-L468 HydrophobicContact CH2-CD1 4.49Å; L441-L468 HydrophobicContact CD1-CD1 4.09Å; L441-L468 HydrophobicContact CG-CD1 3.94Å; I444-L468 HydrophobicContact CG2-CD2 3.54Å; F464-L468 HydrophobicContact CE1-CB 4.44Å; F464-L468 HydrophobicContact CE1-CD2 4.21Å; F464-L468 WeakPolarHBondContact O-CB 3.36Å; F464-L468 PolarHBondContact O-N 3.17Å; L465-L468 HydrophobicContact CD2-CD2 4.29Å; L468-V470 VanDerWaalsContact C-N 3.27Å; L468-V470 PolarHBondContact O-N 3.11Å; L468-L471 HydrophobicContact CD1-CD2 4.17Å; L468-L471 WeakPolarHBondContact O-CB 3.19Å; L468-L471 PolarHBondContact O-N 3.31Å; L468-K472 HydrophobicContact CD1-CG 4.41Å; L468-K472 HydrophobicContact CG-CD 4.33Å; L468-K472 HydrophobicContact CG-CG 4.45Å; L468-K472 WeakPolarHBondContact O-CG 3.19Å; L468-K472 PolarHBondContact O-N 3.42Å
469	R	94.4	Very high	93.2	Very high	117 Å²	117	56.1 Å²	56.1	44%	0.442	27%	0.27	S	S	.	.	H	α-helix	trans	-61.7	-36.5	173.7	-76.9	178.3	-69.3	166.9	-0.4	112.2	L465 R466 T473	L465-R469 WeakPolarHBondContact O-CB 3.38Å; L465-R469 WeakPolarHBondContact O-CG 3.48Å; L465-R469 PolarHBondContact O-N 3.11Å; L465-R469 VanDerWaalsContact O-N 3.07Å; L465-R469 PolarHBondContact O-NE 3.19Å; R466-R469 WeakPolarHBondContact O-CB 3.26Å; R466-R469 PolarHBondContact O-N 3.1Å; R469-T473 WeakPolarHBondContact O-CB 3.32Å; R469-T473 PolarHBondContact O-N 3.19Å; R469-T473 PolarHBondContact O-OG1 3.2Å
470	V	91.8	Very high	92.9	Very high	32 Å²	32	51 Å²	51	19%	0.194	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-48.7	172.7	176.6	0	0	0	0	109.8	Y378 R466 D467 L468 K472 T473 Y474	Y378-V470 HydrophobicContact CD2-CG1 4.48Å; Y378-V470 HydrophobicContact CE2-CG1 3.95Å; R466-V470 PolarHBondContact O-N 3.45Å; D467-V470 WeakPolarHBondContact O-CB 3.35Å; D467-V470 PolarHBondContact O-N 3.12Å; L468-V470 VanDerWaalsContact C-N 3.27Å; L468-V470 PolarHBondContact O-N 3.11Å; V470-K472 PolarHBondContact O-N 3.33Å; V470-T473 WeakPolarHBondContact O-CB 3.48Å; V470-T473 PolarHBondContact O-N 3.1Å; V470-T473 VanDerWaalsContact O-N 3.1Å; V470-Y474 HydrophobicContact CG1-CD2 3.86Å; V470-Y474 HydrophobicContact CG1-CE2 4.02Å; V470-Y474 WeakPolarHBondContact O-CD2 2.84Å; V470-Y474 PolarHBondContact O-N 3.25Å; V470-Y474 VanDerWaalsContact O-N 3.13Å
471	L	95	Very high	92.6	Very high	2 Å²	2	50 Å²	50	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-55.1	-50	176.1	178.7	64.1	0	0	0	111.9	Y378 I403 V407 W410 W418 L441 D467 L468 T473 Y474 A475	Y378-L471 HydrophobicContact CE1-CD1 3.86Å; I403-L471 HydrophobicContact CD1-CD1 3.68Å; V407-L471 HydrophobicContact CG1-CD2 4.07Å; V407-L471 HydrophobicContact CG1-CG 4.36Å; V407-L471 HydrophobicContact CG2-CD1 3.67Å; V407-L471 HydrophobicContact CG2-CG 4.04Å; W410-L471 HydrophobicContact CH2-CD1 3.55Å; W410-L471 HydrophobicContact CH2-CD2 3.96Å; W410-L471 HydrophobicContact CH2-CG 4.41Å; W410-L471 HydrophobicContact CZ2-CD1 4.07Å; W410-L471 HydrophobicContact CZ3-CD1 4.3Å; W410-L471 HydrophobicContact CZ3-CD2 3.86Å; W418-L471 HydrophobicContact CD2-CD2 4.07Å; W418-L471 HydrophobicContact CG-CD2 4.45Å; W418-L471 HydrophobicContact CZ2-CB 4.09Å; W418-L471 HydrophobicContact CZ2-CD2 4.02Å; L441-L471 HydrophobicContact CD2-CD2 3.75Å; D467-L471 PolarHBondContact O-N 3.31Å; L468-L471 HydrophobicContact CD1-CD2 4.17Å; L468-L471 WeakPolarHBondContact O-CB 3.19Å; L468-L471 PolarHBondContact O-N 3.31Å; L471-T473 PolarHBondContact O-N 3.48Å; L471-Y474 PolarHBondContact O-N 2.86Å; L471-Y474 VanDerWaalsContact O-N 3.13Å; L471-A475 WeakPolarHBondContact O-CB 3.45Å; L471-A475 PolarHBondContact O-N 3.29Å
472	K	94.7	Very high	91.9	Very high	41 Å²	41	53.6 Å²	53.6	18%	0.178	27%	0.267	C	S	.	.	H	α-helix	trans	-59	-34.1	177.2	-70.7	179.3	170.8	-169	0	113	L442 L468 V470 Y477 Q498	L442-K472 HydrophobicContact CD2-CD 4.49Å; L442-K472 HydrophobicContact CD2-CG 3.64Å; L442-K472 WeakPolarHBondContact O-CE 3.4Å; L442-K472 PolarHBondContact O-NZ 3.29Å; L468-K472 HydrophobicContact CD1-CG 4.41Å; L468-K472 HydrophobicContact CG-CD 4.33Å; L468-K472 HydrophobicContact CG-CG 4.45Å; L468-K472 WeakPolarHBondContact O-CG 3.19Å; L468-K472 PolarHBondContact O-N 3.42Å; V470-K472 PolarHBondContact O-N 3.33Å; K472-Y477 WeakPolarHBondContact CA-OH 3.42Å; K472-Y477 WeakPolarHBondContact O-CE2 3.47Å; K472-Y477 PolarHBondContact O-OH 3.32Å; K472-Y477 VanDerWaalsContact O-OH 3.1Å; K472-Q498 HydrophobicContact CB-CB 4.02Å
473	T	91.5	Very high	91.3	Very high	39 Å²	39	49.9 Å²	49.9	24%	0.239	25%	0.254	C	S	.	.	H	α-helix	trans	-71.2	-35.5	178.3	-55.6	0	0	0	0	111.7	R469 V470 L471 R497	R469-T473 WeakPolarHBondContact O-CB 3.32Å; R469-T473 PolarHBondContact O-N 3.19Å; R469-T473 PolarHBondContact O-OG1 3.2Å; V470-T473 WeakPolarHBondContact O-CB 3.48Å; V470-T473 PolarHBondContact O-N 3.1Å; V470-T473 VanDerWaalsContact O-N 3.1Å; L471-T473 PolarHBondContact O-N 3.48Å; T473-R497 WeakPolarHBondContact O-CD 3.36Å; T473-R497 PolarHBondContact O-NE 3.48Å
474	Y	89.8	Confident	91	Very high	73 Å²	73	47.8 Å²	47.8	29%	0.286	25%	0.251	S	S	.	.	H	α-helix	trans	-92.8	-6.3	-178.4	-79	-77.3	0	0	0	114.3	K340 Y378 V470 L471	K340-Y474 PolarHBondContact NZ-OH 3.1Å; Y378-Y474 HydrophobicContact CD1-CD2 4.28Å; Y378-Y474 HydrophobicContact CD1-CG 4.02Å; Y378-Y474 HydrophobicContact CD2-CD2 4.18Å; Y378-Y474 HydrophobicContact CD2-CG 4.47Å; Y378-Y474 HydrophobicContact CG-CD1 4.34Å; Y378-Y474 AromaticContact CG-CD2 3.95Å; Y378-Y474 HydrophobicContact CG-CD2 3.95Å; Y378-Y474 AromaticContact CG-CG 3.8Å; Y378-Y474 HydrophobicContact CG-CG 3.8Å; V470-Y474 HydrophobicContact CG1-CD2 3.86Å; V470-Y474 HydrophobicContact CG1-CE2 4.02Å; V470-Y474 WeakPolarHBondContact O-CD2 2.84Å; V470-Y474 PolarHBondContact O-N 3.25Å; V470-Y474 VanDerWaalsContact O-N 3.13Å; L471-Y474 PolarHBondContact O-N 2.86Å; L471-Y474 VanDerWaalsContact O-N 3.13Å
475	A	91.6	Very high	90.7	Very high	3 Å²	3	47.8 Å²	47.8	3%	0.025	25%	0.251	C	S	.	.			trans	-65.2	144.6	-179.8	0	0	0	0	0	112.1	S405 V407 L471 Y477	S405-A475 WeakPolarHBondContact O-CA 3.45Å; V407-A475 HydrophobicContact CB-CB 4.05Å; V407-A475 HydrophobicContact CG2-CB 3.57Å; L471-A475 WeakPolarHBondContact O-CB 3.45Å; L471-A475 PolarHBondContact O-N 3.29Å; A475-Y477 HydrophobicContact CB-CD2 4.42Å; A475-Y477 HydrophobicContact CB-CE1 4.08Å; A475-Y477 HydrophobicContact CB-CE2 3.76Å
476	D	90.4	Very high	90.5	Very high	56 Å²	56	45.8 Å²	45.8	30%	0.299	24%	0.241	S	C	.	.			trans	-90.9	120.6	168.1	-179.4	4.6	0	0	0	108.8	S405 S478	S405-D476 PolarHBondContact O-N 3.03Å; D476-S478 WeakPolarHBondContact OD1-CB 3.44Å; D476-S478 PolarHBondContact OD1-N 3.43Å; D476-S478 PolarHBondContact OD1-OG 3.16Å; D476-S478 PolarHBondContact OD2-OG 3.29Å
477	Y	91.9	Very high	90.2	Very high	2 Å²	2	43 Å²	43	1%	0.008	24%	0.236	C	C	.	.			trans	-106.6	8.6	-177.7	-64.9	-69.5	0	0	0	112.6	P408 L442 K472 A475 T479 C480 D481 A486 T500 Y501	P408-Y477 HydrophobicContact CG-CD1 3.91Å; P408-Y477 HydrophobicContact CG-CE1 4.16Å; L442-Y477 HydrophobicContact CD1-CE1 4.28Å; K472-Y477 WeakPolarHBondContact CA-OH 3.42Å; K472-Y477 WeakPolarHBondContact O-CE2 3.47Å; K472-Y477 PolarHBondContact O-OH 3.32Å; K472-Y477 VanDerWaalsContact O-OH 3.1Å; A475-Y477 HydrophobicContact CB-CD2 4.42Å; A475-Y477 HydrophobicContact CB-CE1 4.08Å; A475-Y477 HydrophobicContact CB-CE2 3.76Å; Y477-T479 PolarHBondContact O-N 2.9Å; Y477-C480 PolarHBondContact O-N 2.99Å; Y477-C480 PolarHBondContact O-SG 3.16Å; Y477-C480 VanDerWaalsContact O-SG 3.35Å; Y477-D481 WeakPolarHBondContact O-CB 3.34Å; Y477-D481 PolarHBondContact O-N 2.94Å; Y477-A486 HydrophobicContact CD2-CB 4.31Å; Y477-T500 HydrophobicContact CD1-CG2 4.42Å; Y477-T500 HydrophobicContact CD2-CG2 3.62Å; Y477-T500 HydrophobicContact CE2-CG2 4.15Å; Y477-T500 HydrophobicContact CG-CG2 3.76Å; Y477-Y501 AromaticContact CD1-CD2 3.98Å; Y477-Y501 HydrophobicContact CD1-CD2 3.98Å; Y477-Y501 AromaticContact CE1-CD2 3.83Å; Y477-Y501 HydrophobicContact CE1-CD2 3.83Å; Y477-Y501 HydrophobicContact CE1-CG 4.12Å
478	S	87.9	Confident	90	Very high	81 Å²	81	43.8 Å²	43.8	57%	0.566	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-24.7	-176.5	54	0	0	0	0	115.1	D476	D476-S478 WeakPolarHBondContact OD1-CB 3.44Å; D476-S478 PolarHBondContact OD1-N 3.43Å; D476-S478 PolarHBondContact OD1-OG 3.16Å; D476-S478 PolarHBondContact OD2-OG 3.29Å
479	T	88.4	Confident	89.8	Confident	78 Å²	78	43.7 Å²	43.7	48%	0.479	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-21.5	177.3	53.1	0	0	0	0	114.1	Y477	Y477-T479 PolarHBondContact O-N 2.9Å
480	C	88.1	Confident	89.5	Confident	36 Å²	36	39.3 Å²	39.3	24%	0.243	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.1	-16.3	-175.3	53	0	0	0	0	113.7	Y477 P482 V504	Y477-C480 PolarHBondContact O-N 2.99Å; Y477-C480 PolarHBondContact O-SG 3.16Å; Y477-C480 VanDerWaalsContact O-SG 3.35Å; C480-P482 VanDerWaalsContact C-CD 3.44Å; C480-P482 WeakPolarHBondContact O-CD 3.24Å; C480-V504 HydrophobicContact CB-CG1 4.05Å; C480-V504 WeakPolarHBondContact O-CG1 3.31Å
481	D	88.8	Confident	89.3	Confident	14 Å²	14	45 Å²	45	8%	0.075	25%	0.25	C	S	.	.			trans	-108.1	78.3	-178.4	-176.4	13	0	0	0	112.2	Y477 N483 N484 M485 A486 V504	Y477-D481 WeakPolarHBondContact O-CB 3.34Å; Y477-D481 PolarHBondContact O-N 2.94Å; D481-N483 PolarHBondContact O-N 2.62Å; D481-N484 PolarHBondContact OD1-N 3.47Å; D481-M485 VanDerWaalsContact CG-N 3.25Å; D481-M485 WeakPolarHBondContact OD1-CB 3Å; D481-M485 PolarHBondContact OD1-N 3.29Å; D481-M485 PolarHBondContact OD2-N 3.41Å; D481-A486 WeakPolarHBondContact OD2-CB 3.22Å; D481-A486 PolarHBondContact OD2-N 2.92Å; D481-V504 HydrophobicContact CB-CG2 4.08Å
482	P	80.9	Confident	88.9	Confident	114 Å²	114	47.1 Å²	47.1	74%	0.74	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-20.2	-179.6	29.2	-36.2	0	0	0	113.4	C480	C480-P482 VanDerWaalsContact C-CD 3.44Å; C480-P482 WeakPolarHBondContact O-CD 3.24Å
483	N	83.2	Confident	88.6	Confident	66 Å²	66	45.9 Å²	45.9	35%	0.353	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	9.3	-173	-68.1	-43	0	0	0	113.4	D481 M485 D509 R510	D481-N483 PolarHBondContact O-N 2.62Å; N483-M485 PolarHBondContact O-N 2.92Å; N483-D509 HydrophobicContact CB-CB 4.18Å; N483-D509 VanDerWaalsContact ND2-CB 3.26Å; N483-D509 WeakPolarHBondContact ND2-CB 3.3Å; N483-D509 PolarHBondContact ND2-OD2 2.83Å; N483-R510 WeakPolarHBondContact O-CD 3.21Å; N483-R510 PolarHBondContact O-NE 2.84Å
484	N	87.4	Confident	88.4	Confident	66 Å²	66	45.2 Å²	45.2	35%	0.353	26%	0.255	S	S	.	.			trans	52.9	50.1	177.8	-159.8	9.8	0	0	0	113.6	D481 A486 D487 W488 R510	D481-N484 PolarHBondContact OD1-N 3.47Å; N484-A486 VanDerWaalsContact C-N 3.32Å; N484-D487 VanDerWaalsContact CG-OD2 3.3Å; N484-D487 PolarHBondContact ND2-OD2 2.94Å; N484-D487 WeakPolarHBondContact OD1-CB 3.44Å; N484-D487 PolarHBondContact OD1-N 2.91Å; N484-D487 PolarHBondContact OD1-OD2 3.44Å; N484-W488 PolarHBondContact O-N 2.99Å; N484-R510 PolarHBondContact O-NE 3.5Å; N484-R510 PolarHBondContact O-NH2 3.16Å
485	M	90.6	Very high	88.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.4	-35.4	170.9	-74.4	-62.8	-70.6	0	0	111.9	D481 N483 D487 W488 L489 V504 V508 R510 V513	D481-M485 VanDerWaalsContact CG-N 3.25Å; D481-M485 WeakPolarHBondContact OD1-CB 3Å; D481-M485 PolarHBondContact OD1-N 3.29Å; D481-M485 PolarHBondContact OD2-N 3.41Å; N483-M485 PolarHBondContact O-N 2.92Å; M485-D487 VanDerWaalsContact C-N 3.34Å; M485-D487 PolarHBondContact O-N 2.9Å; M485-W488 HydrophobicContact CE-CE3 3.86Å; M485-W488 HydrophobicContact CE-CZ3 4Å; M485-W488 PolarHBondContact O-N 3.29Å; M485-W488 HydrophobicContact SD-CE3 4.37Å; M485-L489 WeakPolarHBondContact O-CB 3.27Å; M485-L489 VanDerWaalsContact O-CG 3.32Å; M485-L489 WeakPolarHBondContact O-CG 3.28Å; M485-L489 PolarHBondContact O-N 3.4Å; M485-V504 HydrophobicContact CB-CG2 4.34Å; M485-V508 HydrophobicContact CE-CG1 4.03Å; M485-R510 HydrophobicContact SD-CB 4.38Å; M485-R510 HydrophobicContact SD-CG 3.73Å; M485-R510 PolarHBondContact SD-N 3.08Å; M485-R510 VanDerWaalsContact SD-N 3.37Å; M485-V513 HydrophobicContact CE-CG2 4.4Å
486	A	90.2	Very high	88.5	Confident	3 Å²	3	48 Å²	48	3%	0.025	26%	0.264	C	S	.	.	H	α-helix	trans	-58.1	-44.6	179.8	0	0	0	0	0	112.5	Y477 D481 N484 A490 R497 T500	Y477-A486 HydrophobicContact CD2-CB 4.31Å; D481-A486 WeakPolarHBondContact OD2-CB 3.22Å; D481-A486 PolarHBondContact OD2-N 2.92Å; N484-A486 VanDerWaalsContact C-N 3.32Å; A486-A490 WeakPolarHBondContact O-CB 3.1Å; A486-A490 PolarHBondContact O-N 3.38Å; A486-R497 HydrophobicContact CB-CG 4.41Å; A486-R497 PolarHBondContact O-NH1 2.79Å; A486-T500 WeakPolarHBondContact CA-OG1 3.38Å; A486-T500 HydrophobicContact CB-CG2 3.67Å
487	D	88.3	Confident	88.6	Confident	64 Å²	64	47.9 Å²	47.9	34%	0.342	26%	0.26	S	S	.	.	H	α-helix	trans	-74.2	-38	178.9	-67.4	-12.2	0	0	0	111.2	N484 M485 L489 A490 E491 R497	N484-D487 VanDerWaalsContact CG-OD2 3.3Å; N484-D487 PolarHBondContact ND2-OD2 2.94Å; N484-D487 WeakPolarHBondContact OD1-CB 3.44Å; N484-D487 PolarHBondContact OD1-N 2.91Å; N484-D487 PolarHBondContact OD1-OD2 3.44Å; M485-D487 VanDerWaalsContact C-N 3.34Å; M485-D487 PolarHBondContact O-N 2.9Å; D487-L489 PolarHBondContact O-N 3.31Å; D487-A490 PolarHBondContact O-N 3.46Å; D487-A490 VanDerWaalsContact O-N 3.16Å; D487-E491 WeakPolarHBondContact O-CG 3.4Å; D487-E491 PolarHBondContact O-N 2.89Å; D487-R497 IonicContact OD1-CZ 3.91Å; D487-R497 IonicContact OD1-NH1 3.47Å; D487-R497 PolarHBondContact OD1-NH1 2.97Å; D487-R497 IonicContact OD1-NH2 3.59Å
488	W	90.2	Very high	88.8	Confident	30 Å²	30	49.1 Å²	49.1	11%	0.114	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-47	174.4	176.8	73.7	0	0	0	112	N484 M485 A490 E491 V492 V513 I536 A539 A540	N484-W488 PolarHBondContact O-N 2.99Å; M485-W488 HydrophobicContact CE-CE3 3.86Å; M485-W488 HydrophobicContact CE-CZ3 4Å; M485-W488 PolarHBondContact O-N 3.29Å; M485-W488 HydrophobicContact SD-CE3 4.37Å; W488-A490 VanDerWaalsContact C-N 3.25Å; W488-A490 PolarHBondContact O-N 3.19Å; W488-E491 WeakPolarHBondContact O-CB 3.47Å; W488-E491 PolarHBondContact O-N 3.1Å; W488-E491 VanDerWaalsContact O-N 3.17Å; W488-V492 HydrophobicContact CZ2-CG2 4.29Å; W488-V492 PolarHBondContact O-N 3.19Å; W488-V513 HydrophobicContact CH2-CG1 4.45Å; W488-V513 HydrophobicContact CH2-CG2 3.75Å; W488-V513 HydrophobicContact CZ3-CG2 3.98Å; W488-I536 HydrophobicContact CH2-CG2 3.8Å; W488-I536 HydrophobicContact CZ3-CG2 4.06Å; W488-A539 HydrophobicContact CZ2-CB 4.12Å; W488-A540 HydrophobicContact CH2-CB 4.3Å; W488-A540 HydrophobicContact CZ2-CB 4.18Å
489	L	91.9	Very high	89.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.4	-41.4	176.2	-72.4	168	0	0	0	110.8	M485 D487 E491 V492 D493 F496 L503 I536	M485-L489 WeakPolarHBondContact O-CB 3.27Å; M485-L489 VanDerWaalsContact O-CG 3.32Å; M485-L489 WeakPolarHBondContact O-CG 3.28Å; M485-L489 PolarHBondContact O-N 3.4Å; D487-L489 PolarHBondContact O-N 3.31Å; L489-E491 VanDerWaalsContact C-N 3.34Å; L489-E491 PolarHBondContact O-N 3.09Å; L489-V492 PolarHBondContact O-N 3.06Å; L489-D493 CarbonylContact O-C 3.58Å; L489-D493 PolarHBondContact O-N 2.97Å; L489-F496 HydrophobicContact CB-CB 3.99Å; L489-F496 HydrophobicContact CD2-CB 4.19Å; L489-L503 HydrophobicContact CD1-CD1 3.7Å; L489-L503 HydrophobicContact CD2-CD1 3.94Å; L489-L503 HydrophobicContact CG-CD1 4.4Å; L489-I536 HydrophobicContact CD2-CD1 4.18Å; L489-I536 HydrophobicContact CD2-CG1 4.31Å
490	A	87.9	Confident	89.4	Confident	25 Å²	25	43 Å²	43	21%	0.207	22%	0.221	C	C	.	.	H	α-helix	trans	-66.5	-33.2	178.2	0	0	0	0	0	113.3	A486 D487 W488 V492 D493 P494	A486-A490 WeakPolarHBondContact O-CB 3.1Å; A486-A490 PolarHBondContact O-N 3.38Å; D487-A490 PolarHBondContact O-N 3.46Å; D487-A490 VanDerWaalsContact O-N 3.16Å; W488-A490 VanDerWaalsContact C-N 3.25Å; W488-A490 PolarHBondContact O-N 3.19Å; A490-V492 VanDerWaalsContact C-N 3.32Å; A490-D493 CarbonylContact O-C 3.49Å; A490-P494 WeakPolarHBondContact O-CD 3.44Å; A490-P494 WeakPolarHBondContact O-CG 3.26Å; A490-P494 VanDerWaalsContact O-N 3.17Å
491	E	85.8	Confident	89.8	Confident	152 Å²	152	42.5 Å²	42.5	71%	0.71	21%	0.214	S	C	*	.	H	α-helix	trans	-64.2	-36.1	172.6	-73.4	178.4	-179.5	0	0	112.3	D487 W488 L489	D487-E491 WeakPolarHBondContact O-CG 3.4Å; D487-E491 PolarHBondContact O-N 2.89Å; W488-E491 WeakPolarHBondContact O-CB 3.47Å; W488-E491 PolarHBondContact O-N 3.1Å; W488-E491 VanDerWaalsContact O-N 3.17Å; L489-E491 VanDerWaalsContact C-N 3.34Å; L489-E491 PolarHBondContact O-N 3.09Å
492	V	88.3	Confident	90	Very high	47 Å²	47	42.5 Å²	42.5	29%	0.285	22%	0.218	S	C	.	.	H	α-helix	trans	-70.5	-53.4	175.1	-179	0	0	0	0	110.5	W488 L489 A490 F496 A539	W488-V492 HydrophobicContact CZ2-CG2 4.29Å; W488-V492 PolarHBondContact O-N 3.19Å; L489-V492 PolarHBondContact O-N 3.06Å; A490-V492 VanDerWaalsContact C-N 3.32Å; V492-F496 HydrophobicContact CB-CD2 4.1Å; V492-F496 HydrophobicContact CB-CE2 4.47Å; V492-F496 HydrophobicContact CG1-CD2 3.79Å; V492-F496 HydrophobicContact CG1-CE2 3.67Å; V492-A539 HydrophobicContact CB-CB 4.42Å; V492-A539 HydrophobicContact CG1-CB 3.99Å; V492-A539 HydrophobicContact CG2-CB 3.48Å; V492-A539 VanDerWaalsContact CG2-CB 3.48Å
493	D	87.6	Confident	90.6	Very high	14 Å²	14	37.1 Å²	37.1	8%	0.075	18%	0.183	C	C	.	.			trans	-158.8	124.3	171.3	-170.8	-44.6	0	0	0	107.6	L489 A490 R495 F496	L489-D493 CarbonylContact O-C 3.58Å; L489-D493 PolarHBondContact O-N 2.97Å; A490-D493 CarbonylContact O-C 3.49Å; D493-R495 PolarHBondContact O-N 3.38Å; D493-R495 WeakPolarHBondContact OD1-CB 3.48Å; D493-R495 WeakPolarHBondContact OD1-CG 3.34Å; D493-R495 IonicContact OD1-CZ 3.06Å; D493-R495 PolarHBondContact OD1-N 3.48Å; D493-R495 IonicContact OD1-NE 3.81Å; D493-R495 PolarHBondContact OD1-NE 3.31Å; D493-R495 IonicContact OD1-NH2 3.27Å; D493-R495 IonicContact OD2-CZ 3.35Å; D493-R495 IonicContact OD2-NE 3.94Å; D493-R495 PolarHBondContact OD2-NE 3.35Å; D493-R495 IonicContact OD2-NH2 3.95Å; D493-R495 PolarHBondContact OD2-NH2 3.48Å; D493-F496 HydrophobicContact CB-CD1 3.92Å; D493-F496 HydrophobicContact CB-CD2 3.84Å; D493-F496 HydrophobicContact CB-CE1 3.98Å; D493-F496 HydrophobicContact CB-CE2 3.92Å; D493-F496 HydrophobicContact CB-CG 3.85Å; D493-F496 HydrophobicContact CB-CZ 3.99Å; D493-F496 WeakPolarHBondContact O-CA 3.27Å; D493-F496 VanDerWaalsContact O-CB 3.26Å; D493-F496 WeakPolarHBondContact O-CB 3.31Å; D493-F496 PolarHBondContact O-N 3.06Å
494	P	86.8	Confident	91.1	Very high	25 Å²	25	35.1 Å²	35.1	16%	0.162	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-53.8	-23.1	179.4	-36.2	44.9	0	0	0	114.9	T335 A490 F496	T335-P494 HydrophobicContact CG2-CB 4.28Å; A490-P494 WeakPolarHBondContact O-CD 3.44Å; A490-P494 WeakPolarHBondContact O-CG 3.26Å; A490-P494 VanDerWaalsContact O-N 3.17Å; P494-F496 VanDerWaalsContact C-N 3.26Å; P494-F496 PolarHBondContact O-N 3.32Å
495	R	90.3	Very high	91.3	Very high	136 Å²	136	37.1 Å²	37.1	51%	0.513	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-69.3	-25.4	172.9	-61.4	176.1	-65.7	171.3	1	112.2	D493 R497 Q498	D493-R495 PolarHBondContact O-N 3.38Å; D493-R495 WeakPolarHBondContact OD1-CB 3.48Å; D493-R495 WeakPolarHBondContact OD1-CG 3.34Å; D493-R495 IonicContact OD1-CZ 3.06Å; D493-R495 PolarHBondContact OD1-N 3.48Å; D493-R495 IonicContact OD1-NE 3.81Å; D493-R495 PolarHBondContact OD1-NE 3.31Å; D493-R495 IonicContact OD1-NH2 3.27Å; D493-R495 IonicContact OD2-CZ 3.35Å; D493-R495 IonicContact OD2-NE 3.94Å; D493-R495 PolarHBondContact OD2-NE 3.35Å; D493-R495 IonicContact OD2-NH2 3.95Å; D493-R495 PolarHBondContact OD2-NH2 3.48Å; R495-R497 PolarHBondContact O-N 2.9Å; R495-Q498 VanDerWaalsContact O-CG 3.22Å; R495-Q498 WeakPolarHBondContact O-CG 3.29Å; R495-Q498 PolarHBondContact O-N 3.27Å; R495-Q498 PolarHBondContact O-NE2 3.08Å
496	F	94.2	Very high	91.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-73.6	-14.7	-177	-65.7	-3.9	0	0	0	112.9	L489 V492 D493 P494 Q498 Y499 H532 K535 I536	L489-F496 HydrophobicContact CB-CB 3.99Å; L489-F496 HydrophobicContact CD2-CB 4.19Å; V492-F496 HydrophobicContact CB-CD2 4.1Å; V492-F496 HydrophobicContact CB-CE2 4.47Å; V492-F496 HydrophobicContact CG1-CD2 3.79Å; V492-F496 HydrophobicContact CG1-CE2 3.67Å; D493-F496 HydrophobicContact CB-CD1 3.92Å; D493-F496 HydrophobicContact CB-CD2 3.84Å; D493-F496 HydrophobicContact CB-CE1 3.98Å; D493-F496 HydrophobicContact CB-CE2 3.92Å; D493-F496 HydrophobicContact CB-CG 3.85Å; D493-F496 HydrophobicContact CB-CZ 3.99Å; D493-F496 WeakPolarHBondContact O-CA 3.27Å; D493-F496 VanDerWaalsContact O-CB 3.26Å; D493-F496 WeakPolarHBondContact O-CB 3.31Å; D493-F496 PolarHBondContact O-N 3.06Å; P494-F496 VanDerWaalsContact C-N 3.26Å; P494-F496 PolarHBondContact O-N 3.32Å; F496-Q498 PolarHBondContact O-N 3.26Å; F496-Y499 HydrophobicContact CB-CD2 4.08Å; F496-Y499 HydrophobicContact CD1-CD2 4.27Å; F496-Y499 AromaticContact CD1-CE2 3.89Å; F496-Y499 HydrophobicContact CD1-CE2 3.89Å; F496-Y499 HydrophobicContact CG-CD2 4.35Å; F496-Y499 HydrophobicContact CG-CE2 4.42Å; F496-Y499 WeakPolarHBondContact O-CB 3.49Å; F496-Y499 WeakPolarHBondContact O-CD2 3.31Å; F496-Y499 PolarHBondContact O-N 3.14Å; F496-H532 HydrophobicContact CE1-CB 3.77Å; F496-H532 AromaticContact CE1-CD2 3.57Å; F496-H532 AromaticContact CE1-CE1 3.98Å; F496-H532 AromaticContact CE1-CG 3.42Å; F496-H532 VanDerWaalsContact CE1-CG 3.42Å; F496-H532 AromaticContact CE1-ND1 3.69Å; F496-H532 AromaticContact CE1-NE2 3.93Å; F496-H532 HydrophobicContact CZ-CB 3.9Å; F496-H532 AromaticContact CZ-CD2 3.99Å; F496-H532 AromaticContact CZ-CG 3.94Å; F496-K535 HydrophobicContact CE2-CB 3.82Å; F496-K535 HydrophobicContact CE2-CD 4.37Å; F496-K535 HydrophobicContact CZ-CB 3.99Å; F496-K535 HydrophobicContact CZ-CD 3.91Å; F496-I536 HydrophobicContact CD2-CD1 4.17Å; F496-I536 HydrophobicContact CD2-CG1 3.74Å; F496-I536 HydrophobicContact CE2-CD1 4.47Å; F496-I536 HydrophobicContact CE2-CG1 3.85Å
497	R	93.1	Very high	91.3	Very high	53 Å²	53	41.8 Å²	41.8	20%	0.2	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-53.9	-24.9	169.8	-166.2	170.5	-179	105.7	-2.2	112.6	T473 A486 D487 R495 Y499 T500	T473-R497 WeakPolarHBondContact O-CD 3.36Å; T473-R497 PolarHBondContact O-NE 3.48Å; A486-R497 HydrophobicContact CB-CG 4.41Å; A486-R497 PolarHBondContact O-NH1 2.79Å; D487-R497 IonicContact OD1-CZ 3.91Å; D487-R497 IonicContact OD1-NH1 3.47Å; D487-R497 PolarHBondContact OD1-NH1 2.97Å; D487-R497 IonicContact OD1-NH2 3.59Å; R495-R497 PolarHBondContact O-N 2.9Å; R497-Y499 PolarHBondContact O-N 3.35Å; R497-T500 WeakPolarHBondContact O-CB 3.45Å; R497-T500 PolarHBondContact O-N 3.45Å; R497-T500 PolarHBondContact O-OG1 3.28Å
498	Q	94.6	Very high	91.4	Very high	27 Å²	27	39.2 Å²	39.2	13%	0.126	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-60.9	-21.3	173.4	81.9	-171.3	-89.1	0	0	114.4	K472 R495 F496	K472-Q498 HydrophobicContact CB-CB 4.02Å; R495-Q498 VanDerWaalsContact O-CG 3.22Å; R495-Q498 WeakPolarHBondContact O-CG 3.29Å; R495-Q498 PolarHBondContact O-N 3.27Å; R495-Q498 PolarHBondContact O-NE2 3.08Å; F496-Q498 PolarHBondContact O-N 3.26Å
499	Y	95.3	Very high	91.2	Very high	31 Å²	31	39.5 Å²	39.5	12%	0.122	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-90.9	-7.4	-177.7	-58.8	-55.5	0	0	0	113.3	F496 R497 Y501 G502 L503 I527 H532 I536	F496-Y499 HydrophobicContact CB-CD2 4.08Å; F496-Y499 HydrophobicContact CD1-CD2 4.27Å; F496-Y499 AromaticContact CD1-CE2 3.89Å; F496-Y499 HydrophobicContact CD1-CE2 3.89Å; F496-Y499 HydrophobicContact CG-CD2 4.35Å; F496-Y499 HydrophobicContact CG-CE2 4.42Å; F496-Y499 WeakPolarHBondContact O-CB 3.49Å; F496-Y499 WeakPolarHBondContact O-CD2 3.31Å; F496-Y499 PolarHBondContact O-N 3.14Å; R497-Y499 PolarHBondContact O-N 3.35Å; Y499-Y501 VanDerWaalsContact C-N 3.33Å; Y499-Y501 PolarHBondContact O-N 2.84Å; Y499-G502 PolarHBondContact O-N 3.43Å; Y499-L503 WeakPolarHBondContact O-CD1 3.33Å; Y499-L503 PolarHBondContact O-N 3.38Å; Y499-L503 VanDerWaalsContact O-N 3.13Å; Y499-I527 HydrophobicContact CD1-CB 4.46Å; Y499-I527 HydrophobicContact CD1-CD1 4.27Å; Y499-I527 HydrophobicContact CD1-CG1 3.8Å; Y499-I527 HydrophobicContact CD1-CG2 4.32Å; Y499-I527 HydrophobicContact CD2-CD1 4.26Å; Y499-I527 HydrophobicContact CD2-CG2 4.42Å; Y499-I527 HydrophobicContact CE1-CB 4.44Å; Y499-I527 HydrophobicContact CE1-CG1 4.26Å; Y499-I527 HydrophobicContact CE1-CG2 4Å; Y499-I527 HydrophobicContact CE2-CG2 4.1Å; Y499-I527 HydrophobicContact CG-CD1 3.93Å; Y499-I527 HydrophobicContact CG-CG1 3.99Å; Y499-H532 HydrophobicContact CE2-CB 4.21Å; Y499-H532 AromaticContact CE2-ND1 3.54Å; Y499-H532 AromaticContact CZ-ND1 3.56Å; Y499-H532 PolarHBondContact OH-ND1 2.97Å; Y499-I536 HydrophobicContact CD2-CD1 4.3Å
500	T	95	Very high	90.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-50.3	-51.8	-173.7	-51.9	0	0	0	0	112	Y477 A486 R497 G502 L503 V504	Y477-T500 HydrophobicContact CD1-CG2 4.42Å; Y477-T500 HydrophobicContact CD2-CG2 3.62Å; Y477-T500 HydrophobicContact CE2-CG2 4.15Å; Y477-T500 HydrophobicContact CG-CG2 3.76Å; A486-T500 WeakPolarHBondContact CA-OG1 3.38Å; A486-T500 HydrophobicContact CB-CG2 3.67Å; R497-T500 WeakPolarHBondContact O-CB 3.45Å; R497-T500 PolarHBondContact O-N 3.45Å; R497-T500 PolarHBondContact O-OG1 3.28Å; T500-G502 PolarHBondContact O-N 3.37Å; T500-L503 PolarHBondContact O-N 3.34Å; T500-V504 HydrophobicContact CG2-CG2 4.13Å; T500-V504 WeakPolarHBondContact O-CB 3.47Å; T500-V504 VanDerWaalsContact O-CG2 3.26Å; T500-V504 WeakPolarHBondContact O-CG2 3.43Å; T500-V504 PolarHBondContact O-N 2.64Å
501	Y	94.9	Very high	90.5	Very high	26 Å²	26	47.9 Å²	47.9	10%	0.102	25%	0.246	C	C	.	.	H	α-helix	trans	-62	-46	-174.4	-161.1	-116	0	0	0	112.8	P408 D439 L442 N443 Y477 Y499 L503 V504 Q505	P408-Y501 HydrophobicContact CB-CE2 3.81Å; P408-Y501 HydrophobicContact CG-CD2 4.04Å; P408-Y501 HydrophobicContact CG-CE2 3.74Å; D439-Y501 WeakPolarHBondContact OD1-CE1 3.45Å; D439-Y501 PolarHBondContact OD1-OH 2.75Å; L442-Y501 HydrophobicContact CB-CD1 3.46Å; L442-Y501 VanDerWaalsContact CB-CD1 3.46Å; L442-Y501 HydrophobicContact CB-CE1 3.72Å; L442-Y501 HydrophobicContact CB-CG 4.13Å; L442-Y501 HydrophobicContact CD1-CD1 3.85Å; L442-Y501 HydrophobicContact CD1-CD2 3.92Å; L442-Y501 HydrophobicContact CD1-CE1 3.93Å; L442-Y501 HydrophobicContact CD1-CE2 4.05Å; L442-Y501 HydrophobicContact CD1-CG 3.81Å; L442-Y501 HydrophobicContact CG-CD1 4.27Å; L442-Y501 HydrophobicContact CG-CE1 4.5Å; N443-Y501 WeakPolarHBondContact ND2-CE1 3.28Å; Y477-Y501 AromaticContact CD1-CD2 3.98Å; Y477-Y501 HydrophobicContact CD1-CD2 3.98Å; Y477-Y501 AromaticContact CE1-CD2 3.83Å; Y477-Y501 HydrophobicContact CE1-CD2 3.83Å; Y477-Y501 HydrophobicContact CE1-CG 4.12Å; Y499-Y501 VanDerWaalsContact C-N 3.33Å; Y499-Y501 PolarHBondContact O-N 2.84Å; Y501-L503 PolarHBondContact O-N 3.35Å; Y501-V504 PolarHBondContact O-N 2.71Å; Y501-Q505 VanDerWaalsContact O-CB 3.25Å; Y501-Q505 WeakPolarHBondContact O-CB 3.26Å; Y501-Q505 PolarHBondContact O-N 3.46Å
502	G	93.3	Very high	90.6	Very high	14 Å²	14	43 Å²	43	14%	0.144	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-45.1	178.9	0	0	0	0	0	112.1	Y499 T500 Q505 S506	Y499-G502 PolarHBondContact O-N 3.43Å; T500-G502 PolarHBondContact O-N 3.37Å; G502-Q505 PolarHBondContact O-N 3.07Å; G502-S506 PolarHBondContact O-N 3.42Å; G502-S506 PolarHBondContact O-OG 3.47Å
503	L	93.8	Very high	90.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.2	-51.1	176.1	-81.5	146.1	0	0	0	111.9	L489 Y499 T500 Y501 Q505 S506 G507 V508 L521 C525 I527	L489-L503 HydrophobicContact CD1-CD1 3.7Å; L489-L503 HydrophobicContact CD2-CD1 3.94Å; L489-L503 HydrophobicContact CG-CD1 4.4Å; Y499-L503 WeakPolarHBondContact O-CD1 3.33Å; Y499-L503 PolarHBondContact O-N 3.38Å; Y499-L503 VanDerWaalsContact O-N 3.13Å; T500-L503 PolarHBondContact O-N 3.34Å; Y501-L503 PolarHBondContact O-N 3.35Å; L503-Q505 VanDerWaalsContact C-N 3.33Å; L503-Q505 PolarHBondContact O-N 3.34Å; L503-S506 PolarHBondContact O-N 3.47Å; L503-G507 PolarHBondContact O-N 3.13Å; L503-V508 HydrophobicContact CB-CB 4.22Å; L503-V508 HydrophobicContact CD2-CB 3.93Å; L503-V508 HydrophobicContact CD2-CG1 3.67Å; L503-V508 HydrophobicContact CD2-CG2 4.14Å; L503-V508 VanDerWaalsContact O-CB 3.24Å; L503-V508 WeakPolarHBondContact O-CB 3.44Å; L503-V508 PolarHBondContact O-N 3.23Å; L503-L521 HydrophobicContact CD2-CD2 3.88Å; L503-C525 HydrophobicContact CD2-CB 4.38Å; L503-C525 HydrophobicContact CG-CB 4.19Å; L503-I527 HydrophobicContact CD1-CD1 4.2Å
504	V	92.9	Very high	90.4	Very high	25 Å²	25	46.1 Å²	46.1	15%	0.152	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-40.9	-178.1	167.1	0	0	0	0	111.3	C480 D481 M485 T500 Y501 S506 G507	C480-V504 HydrophobicContact CB-CG1 4.05Å; C480-V504 WeakPolarHBondContact O-CG1 3.31Å; D481-V504 HydrophobicContact CB-CG2 4.08Å; M485-V504 HydrophobicContact CB-CG2 4.34Å; T500-V504 HydrophobicContact CG2-CG2 4.13Å; T500-V504 WeakPolarHBondContact O-CB 3.47Å; T500-V504 VanDerWaalsContact O-CG2 3.26Å; T500-V504 WeakPolarHBondContact O-CG2 3.43Å; T500-V504 PolarHBondContact O-N 2.64Å; Y501-V504 PolarHBondContact O-N 2.71Å; V504-S506 VanDerWaalsContact C-N 3.33Å; V504-S506 PolarHBondContact O-N 2.9Å; V504-G507 PolarHBondContact O-N 2.94Å
505	Q	91.7	Very high	90.5	Very high	107 Å²	107	50.6 Å²	50.6	50%	0.5	26%	0.259	S	S	.	.	H	α-helix	trans	-68.5	-31.7	177.9	-170.9	174.6	7.9	0	0	112.6	N443 Y501 G502 L503 G507	N443-Q505 PolarHBondContact ND2-NE2 3.48Å; N443-Q505 PolarHBondContact ND2-OE1 3.42Å; N443-Q505 PolarHBondContact OD1-OE1 2.98Å; Y501-Q505 VanDerWaalsContact O-CB 3.25Å; Y501-Q505 WeakPolarHBondContact O-CB 3.26Å; Y501-Q505 PolarHBondContact O-N 3.46Å; G502-Q505 PolarHBondContact O-N 3.07Å; L503-Q505 VanDerWaalsContact C-N 3.33Å; L503-Q505 PolarHBondContact O-N 3.34Å; Q505-G507 PolarHBondContact O-N 3.3Å
506	S	91.4	Very high	90.5	Very high	51 Å²	51	45.5 Å²	45.5	36%	0.357	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	1.4	169.6	-51.1	0	0	0	0	113.5	G502 L503 V504 V508 D524	G502-S506 PolarHBondContact O-N 3.42Å; G502-S506 PolarHBondContact O-OG 3.47Å; L503-S506 PolarHBondContact O-N 3.47Å; V504-S506 VanDerWaalsContact C-N 3.33Å; V504-S506 PolarHBondContact O-N 2.9Å; S506-V508 VanDerWaalsContact C-N 3.34Å; S506-D524 PolarHBondContact OG-O 2.79Å
507	G	89.4	Confident	90.4	Very high	50 Å²	50	48.7 Å²	48.7	52%	0.515	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	18.7	-177.8	0	0	0	0	0	114	L503 V504 Q505 N512	L503-G507 PolarHBondContact O-N 3.13Å; V504-G507 PolarHBondContact O-N 2.94Å; Q505-G507 PolarHBondContact O-N 3.3Å; G507-N512 PolarHBondContact O-ND2 2.87Å
508	V	90.1	Very high	90.4	Very high	10 Å²	10	49.1 Å²	49.1	6%	0.061	27%	0.267	C	S	.	.			trans	-81	131.5	178.4	-179.5	0	0	0	0	110.4	M485 L503 S506 N512 V513 L516	M485-V508 HydrophobicContact CE-CG1 4.03Å; L503-V508 HydrophobicContact CB-CB 4.22Å; L503-V508 HydrophobicContact CD2-CB 3.93Å; L503-V508 HydrophobicContact CD2-CG1 3.67Å; L503-V508 HydrophobicContact CD2-CG2 4.14Å; L503-V508 VanDerWaalsContact O-CB 3.24Å; L503-V508 WeakPolarHBondContact O-CB 3.44Å; L503-V508 PolarHBondContact O-N 3.23Å; S506-V508 VanDerWaalsContact C-N 3.34Å; V508-N512 VanDerWaalsContact CA-OD1 3.31Å; V508-N512 WeakPolarHBondContact CA-OD1 3.4Å; V508-N512 WeakPolarHBondContact CG1-OD1 3.31Å; V508-V513 HydrophobicContact CG1-CB 4.08Å; V508-V513 HydrophobicContact CG1-CG2 4.23Å; V508-L516 HydrophobicContact CB-CD1 4.27Å; V508-L516 HydrophobicContact CG1-CD1 3.55Å; V508-L516 HydrophobicContact CG2-CD1 3.67Å; V508-L516 HydrophobicContact CG2-CD2 4.19Å
509	D	86.9	Confident	90.4	Very high	37 Å²	37	54.6 Å²	54.6	20%	0.198	29%	0.293	C	S	.	.			trans	-132.9	178.5	174	69.6	20.2	0	0	0	112.2	N483 N511 N512 V513	N483-D509 HydrophobicContact CB-CB 4.18Å; N483-D509 VanDerWaalsContact ND2-CB 3.26Å; N483-D509 WeakPolarHBondContact ND2-CB 3.3Å; N483-D509 PolarHBondContact ND2-OD2 2.83Å; D509-N511 PolarHBondContact O-N 2.92Å; D509-N511 VanDerWaalsContact O-N 3.16Å; D509-N511 WeakPolarHBondContact OD1-CA 3.4Å; D509-N511 WeakPolarHBondContact OD1-CB 3.39Å; D509-N511 PolarHBondContact OD1-N 3.46Å; D509-N512 PolarHBondContact N-OD1 2.73Å; D509-N512 PolarHBondContact O-N 3.04Å; D509-N512 PolarHBondContact O-OD1 3.45Å; D509-N512 VanDerWaalsContact OD1-CG 3.25Å; D509-N512 PolarHBondContact OD1-N 2.74Å; D509-N512 PolarHBondContact OD1-ND2 3.02Å; D509-N512 PolarHBondContact OD1-OD1 2.93Å; D509-V513 WeakPolarHBondContact O-CB 3.45Å; D509-V513 PolarHBondContact O-N 3.03Å
510	R	83.1	Confident	90.3	Very high	84 Å²	84	56.6 Å²	56.6	32%	0.317	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-21.5	179.8	-78.2	-167.3	-179.8	-146.7	1.2	113.7	N483 N484 M485	N483-R510 WeakPolarHBondContact O-CD 3.21Å; N483-R510 PolarHBondContact O-NE 2.84Å; N484-R510 PolarHBondContact O-NE 3.5Å; N484-R510 PolarHBondContact O-NH2 3.16Å; M485-R510 HydrophobicContact SD-CB 4.38Å; M485-R510 HydrophobicContact SD-CG 3.73Å; M485-R510 PolarHBondContact SD-N 3.08Å; M485-R510 VanDerWaalsContact SD-N 3.37Å
511	N	82.6	Confident	90.2	Very high	116 Å²	116	56.6 Å²	56.6	62%	0.62	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-27.5	-176	-55.1	-43.6	0	0	0	111.8	D509	D509-N511 PolarHBondContact O-N 2.92Å; D509-N511 VanDerWaalsContact O-N 3.16Å; D509-N511 WeakPolarHBondContact OD1-CA 3.4Å; D509-N511 WeakPolarHBondContact OD1-CB 3.39Å; D509-N511 PolarHBondContact OD1-N 3.46Å
512	N	87.1	Confident	90.2	Very high	51 Å²	51	58.6 Å²	58.6	27%	0.273	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-10.8	-176.7	70.9	24.6	0	0	0	114.2	G507 V508 D509 E514 N515	G507-N512 PolarHBondContact O-ND2 2.87Å; V508-N512 VanDerWaalsContact CA-OD1 3.31Å; V508-N512 WeakPolarHBondContact CA-OD1 3.4Å; V508-N512 WeakPolarHBondContact CG1-OD1 3.31Å; D509-N512 PolarHBondContact N-OD1 2.73Å; D509-N512 PolarHBondContact O-N 3.04Å; D509-N512 PolarHBondContact O-OD1 3.45Å; D509-N512 VanDerWaalsContact OD1-CG 3.25Å; D509-N512 PolarHBondContact OD1-N 2.74Å; D509-N512 PolarHBondContact OD1-ND2 3.02Å; D509-N512 PolarHBondContact OD1-OD1 2.93Å; N512-E514 PolarHBondContact O-N 3.35Å; N512-E514 VanDerWaalsContact O-N 3.17Å; N512-N515 PolarHBondContact O-N 3.06Å
513	V	86.4	Confident	90.2	Very high	7 Å²	7	63.7 Å²	63.7	4%	0.042	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-59.1	-28.2	-179.7	69.2	0	0	0	0	113.4	M485 W488 V508 D509 N515 L516 A540	M485-V513 HydrophobicContact CE-CG2 4.4Å; W488-V513 HydrophobicContact CH2-CG1 4.45Å; W488-V513 HydrophobicContact CH2-CG2 3.75Å; W488-V513 HydrophobicContact CZ3-CG2 3.98Å; V508-V513 HydrophobicContact CG1-CB 4.08Å; V508-V513 HydrophobicContact CG1-CG2 4.23Å; D509-V513 WeakPolarHBondContact O-CB 3.45Å; D509-V513 PolarHBondContact O-N 3.03Å; V513-N515 VanDerWaalsContact C-N 3.27Å; V513-N515 PolarHBondContact O-N 2.8Å; V513-L516 HydrophobicContact CG2-CD1 4.2Å; V513-L516 PolarHBondContact O-N 2.65Å; V513-A540 HydrophobicContact CG1-CB 3.95Å; V513-A540 HydrophobicContact CG2-CB 4.1Å
514	E	86.2	Confident	90.1	Very high	118 Å²	118	67.9 Å²	67.9	55%	0.551	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-67.7	-25.1	176	60.5	176.4	-168.1	0	0	113.6	N512	N512-E514 PolarHBondContact O-N 3.35Å; N512-E514 VanDerWaalsContact O-N 3.17Å
515	N	87.3	Confident	90	Very high	119 Å²	119	66.9 Å²	66.9	64%	0.636	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-93.3	0.2	-176.9	-64.1	-45.4	0	0	0	112.9	N512 V513	N512-N515 PolarHBondContact O-N 3.06Å; V513-N515 VanDerWaalsContact C-N 3.27Å; V513-N515 PolarHBondContact O-N 2.8Å
516	L	90.9	Very high	89.9	Confident	30 Å²	30	67.4 Å²	67.4	16%	0.157	35%	0.352	C	S	.	.			trans	-77.2	145.9	-177.9	-67.5	178.2	0	0	0	112.5	V508 V513 Q520 L521 L537	V508-L516 HydrophobicContact CB-CD1 4.27Å; V508-L516 HydrophobicContact CG1-CD1 3.55Å; V508-L516 HydrophobicContact CG2-CD1 3.67Å; V508-L516 HydrophobicContact CG2-CD2 4.19Å; V513-L516 HydrophobicContact CG2-CD1 4.2Å; V513-L516 PolarHBondContact O-N 2.65Å; L516-Q520 HydrophobicContact CD2-CB 4.44Å; L516-L521 HydrophobicContact CD1-CD2 3.82Å; L516-L537 HydrophobicContact CB-CD2 4.29Å; L516-L537 WeakPolarHBondContact O-CD2 3.36Å
517	T	92.3	Very high	90.1	Very high	67 Å²	67	65 Å²	65	41%	0.411	34%	0.335	S	S	.	.			trans	-96.3	159.2	173	63.6	0	0	0	0	111.6	Q519 Q520 L521	T517-Q519 PolarHBondContact O-N 3.23Å; T517-Q520 PolarHBondContact O-N 2.92Å; T517-Q520 WeakPolarHBondContact OG1-CG 3.3Å; T517-Q520 PolarHBondContact OG1-N 2.81Å; T517-Q520 PolarHBondContact OG1-OE1 2.95Å; T517-L521 PolarHBondContact O-N 2.77Å; T517-L521 VanDerWaalsContact O-N 3.11Å
518	D	93	Very high	90.2	Very high	62 Å²	62	68.8 Å²	68.8	33%	0.332	34%	0.344	S	S	.	.	H	α-helix	trans	-57.3	-35	173.6	-171.7	71.2	0	0	0	112.2	Q522 R533 L537	D518-Q522 WeakPolarHBondContact O-CB 3.47Å; D518-Q522 PolarHBondContact O-N 2.79Å; D518-R533 WeakPolarHBondContact O-CD 3.26Å; D518-R533 VanDerWaalsContact OD1-CB 3.27Å; D518-R533 WeakPolarHBondContact OD1-CB 3.24Å; D518-R533 IonicContact OD1-CZ 3.62Å; D518-R533 IonicContact OD1-NE 3.46Å; D518-R533 PolarHBondContact OD1-NE 3.35Å; D518-R533 IonicContact OD1-NH2 2.75Å; D518-R533 IonicContact OD2-CZ 2.82Å; D518-R533 IonicContact OD2-NE 2.77Å; D518-R533 PolarHBondContact OD2-NE 2.98Å; D518-R533 IonicContact OD2-NH2 3.25Å; D518-R533 PolarHBondContact OD2-NH2 3.48Å; D518-L537 HydrophobicContact CB-CD1 4.22Å
519	Q	93.8	Very high	90.3	Very high	142 Å²	142	71.4 Å²	71.4	66%	0.664	36%	0.358	S	S	*	.	H	α-helix	trans	-67.9	-43.3	178.7	-70.3	-176.8	-12.3	0	0	112.2	T517 Q522 H523	T517-Q519 PolarHBondContact O-N 3.23Å; Q519-Q522 PolarHBondContact O-N 3.13Å; Q519-H523 WeakPolarHBondContact O-CB 3.46Å; Q519-H523 PolarHBondContact O-CD2 3.38Å; Q519-H523 PolarHBondContact O-N 3.13Å
520	Q	93.8	Very high	90.7	Very high	73 Å²	73	71.1 Å²	71.1	34%	0.341	36%	0.363	S	S	.	.	H	α-helix	trans	-63.6	-43.5	175.8	-73	165	-48.3	0	0	111.2	L516 T517 Q522 D524 C525	L516-Q520 HydrophobicContact CD2-CB 4.44Å; T517-Q520 PolarHBondContact O-N 2.92Å; T517-Q520 WeakPolarHBondContact OG1-CG 3.3Å; T517-Q520 PolarHBondContact OG1-N 2.81Å; T517-Q520 PolarHBondContact OG1-OE1 2.95Å; Q520-Q522 PolarHBondContact O-N 3.2Å; Q520-D524 WeakPolarHBondContact O-CA 3.42Å; Q520-D524 WeakPolarHBondContact O-CB 3.26Å; Q520-D524 PolarHBondContact O-N 3.31Å; Q520-C525 PolarHBondContact O-N 2.82Å; Q520-C525 VanDerWaalsContact O-N 3.15Å
521	L	93.6	Very high	91.3	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-62.2	-32.3	175.2	-73.1	-177.8	0	0	0	112.9	L503 L516 T517 C525 H526 I527 R533 I536 L537	L503-L521 HydrophobicContact CD2-CD2 3.88Å; L516-L521 HydrophobicContact CD1-CD2 3.82Å; T517-L521 PolarHBondContact O-N 2.77Å; T517-L521 VanDerWaalsContact O-N 3.11Å; L521-C525 HydrophobicContact CD2-CB 4.34Å; L521-C525 CarbonylContact O-C 3.58Å; L521-H526 PolarHBondContact O-N 3.49Å; L521-I527 HydrophobicContact CD2-CD1 4.21Å; L521-I527 WeakPolarHBondContact O-CB 3.43Å; L521-I527 PolarHBondContact O-N 3.13Å; L521-R533 HydrophobicContact CB-CB 4.47Å; L521-R533 HydrophobicContact CB-CG 3.97Å; L521-R533 HydrophobicContact CD1-CB 4.13Å; L521-R533 HydrophobicContact CD1-CG 4.4Å; L521-I536 HydrophobicContact CD1-CG2 4.23Å; L521-L537 HydrophobicContact CD1-CD1 4.08Å; L521-L537 HydrophobicContact CD1-CD2 3.62Å; L521-L537 HydrophobicContact CD1-CG 3.58Å
522	Q	95.1	Very high	91.9	Very high	68 Å²	68	67.2 Å²	67.2	32%	0.318	35%	0.351	S	S	.	.	H	α-helix	trans	-77	-50.3	177.8	-179.3	169.7	-13.4	0	0	112.6	D518 Q519 Q520 H526	D518-Q522 WeakPolarHBondContact O-CB 3.47Å; D518-Q522 PolarHBondContact O-N 2.79Å; Q519-Q522 PolarHBondContact O-N 3.13Å; Q520-Q522 PolarHBondContact O-N 3.2Å; Q522-H526 WeakPolarHBondContact O-CA 3.48Å
523	H	92.1	Very high	92.3	Very high	121 Å²	121	65.6 Å²	65.6	56%	0.56	34%	0.341	S	S	*	.	H	α-helix	trans	-88.4	-42.9	-170.1	-72.5	-67.7	0	0	0	113.1	Q519 H526	Q519-H523 WeakPolarHBondContact O-CB 3.46Å; Q519-H523 PolarHBondContact O-CD2 3.38Å; Q519-H523 PolarHBondContact O-N 3.13Å; H523-H526 PolarHBondContact O-CE1 3.35Å; H523-H526 PolarHBondContact O-ND1 3.38Å
524	D	91.6	Very high	92.6	Very high	88 Å²	88	68 Å²	68	47%	0.471	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-41.5	-174.2	-51.5	-37	0	0	0	111	S506 Q520	S506-D524 PolarHBondContact OG-O 2.79Å; Q520-D524 WeakPolarHBondContact O-CA 3.42Å; Q520-D524 WeakPolarHBondContact O-CB 3.26Å; Q520-D524 PolarHBondContact O-N 3.31Å
525	C	91.3	Very high	92.9	Very high	4 Å²	4	67.1 Å²	67.1	3%	0.027	36%	0.355	C	S	.	.	S	Bend	trans	-94.3	-0.2	-179.9	-50.7	0	0	0	0	113.9	L503 Q520 L521 I527	L503-C525 HydrophobicContact CD2-CB 4.38Å; L503-C525 HydrophobicContact CG-CB 4.19Å; Q520-C525 PolarHBondContact O-N 2.82Å; Q520-C525 VanDerWaalsContact O-N 3.15Å; L521-C525 HydrophobicContact CD2-CB 4.34Å; L521-C525 CarbonylContact O-C 3.58Å; C525-I527 VanDerWaalsContact C-N 3.31Å; C525-I527 HydrophobicContact CB-CD1 4.43Å; C525-I527 HydrophobicContact CB-CG1 4.2Å; C525-I527 PolarHBondContact O-N 3.04Å
526	H	90.8	Very high	93.1	Very high	117 Å²	117	61.4 Å²	61.4	54%	0.542	33%	0.325	S	S	.	.			trans	56.1	33.8	176.3	-54.9	-55	0	0	0	115.8	L521 Q522 H523 N528	L521-H526 PolarHBondContact O-N 3.49Å; Q522-H526 WeakPolarHBondContact O-CA 3.48Å; H523-H526 PolarHBondContact O-CE1 3.35Å; H523-H526 PolarHBondContact O-ND1 3.38Å; H526-N528 PolarHBondContact O-N 3.41Å
527	I	93.9	Very high	93.2	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.327	C	S	.	.			trans	-90.1	82	177.2	-49.1	-175	0	0	0	109.7	Y499 L503 L521 C525 N529 H532 R533 I536	Y499-I527 HydrophobicContact CD1-CB 4.46Å; Y499-I527 HydrophobicContact CD1-CD1 4.27Å; Y499-I527 HydrophobicContact CD1-CG1 3.8Å; Y499-I527 HydrophobicContact CD1-CG2 4.32Å; Y499-I527 HydrophobicContact CD2-CD1 4.26Å; Y499-I527 HydrophobicContact CD2-CG2 4.42Å; Y499-I527 HydrophobicContact CE1-CB 4.44Å; Y499-I527 HydrophobicContact CE1-CG1 4.26Å; Y499-I527 HydrophobicContact CE1-CG2 4Å; Y499-I527 HydrophobicContact CE2-CG2 4.1Å; Y499-I527 HydrophobicContact CG-CD1 3.93Å; Y499-I527 HydrophobicContact CG-CG1 3.99Å; L503-I527 HydrophobicContact CD1-CD1 4.2Å; L521-I527 HydrophobicContact CD2-CD1 4.21Å; L521-I527 WeakPolarHBondContact O-CB 3.43Å; L521-I527 PolarHBondContact O-N 3.13Å; C525-I527 VanDerWaalsContact C-N 3.31Å; C525-I527 HydrophobicContact CB-CD1 4.43Å; C525-I527 HydrophobicContact CB-CG1 4.2Å; C525-I527 PolarHBondContact O-N 3.04Å; I527-N529 VanDerWaalsContact C-N 3.26Å; I527-N529 PolarHBondContact O-N 3.27Å; I527-H532 HydrophobicContact CG2-CB 4.03Å; I527-R533 HydrophobicContact CB-CG 3.78Å; I527-R533 HydrophobicContact CG2-CG 3.59Å; I527-R533 WeakPolarHBondContact O-CD 3.47Å; I527-R533 WeakPolarHBondContact O-CG 2.96Å; I527-R533 PolarHBondContact O-NH1 3Å; I527-I536 HydrophobicContact CD1-CD1 3.66Å
528	N	91.6	Very high	93	Very high	130 Å²	130	61.7 Å²	61.7	70%	0.695	33%	0.329	S	S	*	.			trans	-61.4	-29.1	-175.5	-67.4	-26.3	0	0	0	114.6	H526 G530 R533	H526-N528 PolarHBondContact O-N 3.41Å; N528-G530 PolarHBondContact O-N 3.45Å; N528-R533 PolarHBondContact O-NH1 3.4Å
529	N	93.8	Very high	92.8	Very high	66 Å²	66	59.7 Å²	59.7	35%	0.353	32%	0.321	S	S	.	.			trans	-79.5	106.9	-178.2	-173.3	-26.4	0	0	0	111.1	I527 V531 H532 R533	I527-N529 VanDerWaalsContact C-N 3.26Å; I527-N529 PolarHBondContact O-N 3.27Å; N529-V531 PolarHBondContact O-N 2.89Å; N529-V531 WeakPolarHBondContact OD1-CB 3.01Å; N529-V531 PolarHBondContact OD1-N 3.28Å; N529-H532 HydrophobicContact CB-CB 4.09Å; N529-H532 PolarHBondContact ND2-CD2 3.27Å; N529-H532 PolarHBondContact ND2-NE2 3.45Å; N529-H532 WeakPolarHBondContact O-CB 3.37Å; N529-H532 PolarHBondContact O-N 2.95Å; N529-H532 PolarHBondContact OD1-N 3.2Å; N529-R533 PolarHBondContact O-N 3.05Å; N529-R533 VanDerWaalsContact O-N 3.1Å
530	G	94.5	Very high	92.4	Very high	31 Å²	31	53.4 Å²	53.4	32%	0.32	29%	0.294	S	S	.	.	H	α-helix	trans	-59.1	-28.9	179.5	0	0	0	0	0	114.6	N528 R533 A534	N528-G530 PolarHBondContact O-N 3.45Å; G530-R533 PolarHBondContact O-N 3.3Å; G530-A534 WeakPolarHBondContact O-CB 3.36Å; G530-A534 PolarHBondContact O-N 3.01Å
531	V	95.4	Very high	91.6	Very high	92 Å²	92	54.4 Å²	54.4	56%	0.558	31%	0.308	S	S	*	.	H	α-helix	trans	-69.7	-37.1	174.7	-178.3	0	0	0	0	111	N529 K535	N529-V531 PolarHBondContact O-N 2.89Å; N529-V531 WeakPolarHBondContact OD1-CB 3.01Å; N529-V531 PolarHBondContact OD1-N 3.28Å; V531-K535 WeakPolarHBondContact O-CG 3.42Å; V531-K535 PolarHBondContact O-N 2.98Å; V531-K535 VanDerWaalsContact O-N 3.08Å
532	H	95.3	Very high	90.5	Very high	26 Å²	26	62.8 Å²	62.8	12%	0.12	34%	0.34	C	S	.	.	H	α-helix	trans	-67	-44.5	176.2	-64.6	-174.1	0	0	0	110.4	F496 Y499 I527 N529 A534 K535 I536	F496-H532 HydrophobicContact CE1-CB 3.77Å; F496-H532 AromaticContact CE1-CD2 3.57Å; F496-H532 AromaticContact CE1-CE1 3.98Å; F496-H532 AromaticContact CE1-CG 3.42Å; F496-H532 VanDerWaalsContact CE1-CG 3.42Å; F496-H532 AromaticContact CE1-ND1 3.69Å; F496-H532 AromaticContact CE1-NE2 3.93Å; F496-H532 HydrophobicContact CZ-CB 3.9Å; F496-H532 AromaticContact CZ-CD2 3.99Å; F496-H532 AromaticContact CZ-CG 3.94Å; Y499-H532 HydrophobicContact CE2-CB 4.21Å; Y499-H532 AromaticContact CE2-ND1 3.54Å; Y499-H532 AromaticContact CZ-ND1 3.56Å; Y499-H532 PolarHBondContact OH-ND1 2.97Å; I527-H532 HydrophobicContact CG2-CB 4.03Å; N529-H532 HydrophobicContact CB-CB 4.09Å; N529-H532 PolarHBondContact ND2-CD2 3.27Å; N529-H532 PolarHBondContact ND2-NE2 3.45Å; N529-H532 WeakPolarHBondContact O-CB 3.37Å; N529-H532 PolarHBondContact O-N 2.95Å; N529-H532 PolarHBondContact OD1-N 3.2Å; H532-A534 PolarHBondContact O-N 3.48Å; H532-K535 PolarHBondContact O-N 3.09Å; H532-I536 VanDerWaalsContact O-CG1 3.3Å; H532-I536 WeakPolarHBondContact O-CG1 3.21Å; H532-I536 PolarHBondContact O-N 3.2Å
533	R	95.2	Very high	88.6	Confident	17 Å²	17	65.4 Å²	65.4	6%	0.064	36%	0.363	C	S	.	.	H	α-helix	trans	-58	-49.4	175.1	-62.4	-166.3	-56.4	-105.1	18.2	112.1	D518 L521 I527 N528 N529 G530 K535 I536 L537	D518-R533 WeakPolarHBondContact O-CD 3.26Å; D518-R533 VanDerWaalsContact OD1-CB 3.27Å; D518-R533 WeakPolarHBondContact OD1-CB 3.24Å; D518-R533 IonicContact OD1-CZ 3.62Å; D518-R533 IonicContact OD1-NE 3.46Å; D518-R533 PolarHBondContact OD1-NE 3.35Å; D518-R533 IonicContact OD1-NH2 2.75Å; D518-R533 IonicContact OD2-CZ 2.82Å; D518-R533 IonicContact OD2-NE 2.77Å; D518-R533 PolarHBondContact OD2-NE 2.98Å; D518-R533 IonicContact OD2-NH2 3.25Å; D518-R533 PolarHBondContact OD2-NH2 3.48Å; L521-R533 HydrophobicContact CB-CB 4.47Å; L521-R533 HydrophobicContact CB-CG 3.97Å; L521-R533 HydrophobicContact CD1-CB 4.13Å; L521-R533 HydrophobicContact CD1-CG 4.4Å; I527-R533 HydrophobicContact CB-CG 3.78Å; I527-R533 HydrophobicContact CG2-CG 3.59Å; I527-R533 WeakPolarHBondContact O-CD 3.47Å; I527-R533 WeakPolarHBondContact O-CG 2.96Å; I527-R533 PolarHBondContact O-NH1 3Å; N528-R533 PolarHBondContact O-NH1 3.4Å; N529-R533 PolarHBondContact O-N 3.05Å; N529-R533 VanDerWaalsContact O-N 3.1Å; G530-R533 PolarHBondContact O-N 3.3Å; R533-K535 VanDerWaalsContact C-N 3.29Å; R533-K535 PolarHBondContact O-N 3.02Å; R533-I536 PolarHBondContact O-N 3.44Å; R533-I536 VanDerWaalsContact O-N 3.13Å; R533-L537 WeakPolarHBondContact O-CG 3.37Å; R533-L537 PolarHBondContact O-N 2.82Å
534	A	92.9	Very high	86.7	Confident	56 Å²	56	65.7 Å²	65.7	46%	0.463	37%	0.368	S	S	.	.	H	α-helix	trans	-57.9	-39.9	177.2	0	0	0	0	0	112.7	G530 H532 S538	G530-A534 WeakPolarHBondContact O-CB 3.36Å; G530-A534 PolarHBondContact O-N 3.01Å; H532-A534 PolarHBondContact O-N 3.48Å; A534-S538 WeakPolarHBondContact O-CB 3.1Å; A534-S538 PolarHBondContact O-N 3.44Å
535	K	92.6	Very high	84.4	Confident	100 Å²	100	70.1 Å²	70.1	44%	0.435	38%	0.383	S	S	.	.	H	α-helix	trans	-66.8	-41.9	175.4	-77.2	-178.2	171.8	-167.9	0	112.7	F496 V531 H532 R533 S538 A539	F496-K535 HydrophobicContact CE2-CB 3.82Å; F496-K535 HydrophobicContact CE2-CD 4.37Å; F496-K535 HydrophobicContact CZ-CB 3.99Å; F496-K535 HydrophobicContact CZ-CD 3.91Å; V531-K535 WeakPolarHBondContact O-CG 3.42Å; V531-K535 PolarHBondContact O-N 2.98Å; V531-K535 VanDerWaalsContact O-N 3.08Å; H532-K535 PolarHBondContact O-N 3.09Å; R533-K535 VanDerWaalsContact C-N 3.29Å; R533-K535 PolarHBondContact O-N 3.02Å; K535-S538 PolarHBondContact O-N 2.97Å; K535-A539 VanDerWaalsContact O-CB 3.32Å; K535-A539 WeakPolarHBondContact O-CB 3.49Å; K535-A539 PolarHBondContact O-N 3.18Å
536	I	92.5	Very high	81.6	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-63.1	-49.7	177.6	-70.5	168.7	0	0	0	109.9	W488 L489 F496 Y499 L521 I527 H532 R533 S538 A539 A540	W488-I536 HydrophobicContact CH2-CG2 3.8Å; W488-I536 HydrophobicContact CZ3-CG2 4.06Å; L489-I536 HydrophobicContact CD2-CD1 4.18Å; L489-I536 HydrophobicContact CD2-CG1 4.31Å; F496-I536 HydrophobicContact CD2-CD1 4.17Å; F496-I536 HydrophobicContact CD2-CG1 3.74Å; F496-I536 HydrophobicContact CE2-CD1 4.47Å; F496-I536 HydrophobicContact CE2-CG1 3.85Å; Y499-I536 HydrophobicContact CD2-CD1 4.3Å; L521-I536 HydrophobicContact CD1-CG2 4.23Å; I527-I536 HydrophobicContact CD1-CD1 3.66Å; H532-I536 VanDerWaalsContact O-CG1 3.3Å; H532-I536 WeakPolarHBondContact O-CG1 3.21Å; H532-I536 PolarHBondContact O-N 3.2Å; R533-I536 PolarHBondContact O-N 3.44Å; R533-I536 VanDerWaalsContact O-N 3.13Å; I536-S538 PolarHBondContact O-N 3.05Å; I536-A539 PolarHBondContact O-N 3.33Å; I536-A540 WeakPolarHBondContact O-CB 3.37Å; I536-A540 PolarHBondContact O-N 3.07Å
537	L	91.7	Very high	78.9	Confident	37 Å²	37	73.1 Å²	73.1	19%	0.194	42%	0.415	C	S	.	.	H	α-helix	trans	-62.1	-42.2	177.6	-67.6	173.4	0	0	0	112.2	L516 D518 L521 R533 A539 A540 S541	L516-L537 HydrophobicContact CB-CD2 4.29Å; L516-L537 WeakPolarHBondContact O-CD2 3.36Å; D518-L537 HydrophobicContact CB-CD1 4.22Å; L521-L537 HydrophobicContact CD1-CD1 4.08Å; L521-L537 HydrophobicContact CD1-CD2 3.62Å; L521-L537 HydrophobicContact CD1-CG 3.58Å; R533-L537 WeakPolarHBondContact O-CG 3.37Å; R533-L537 PolarHBondContact O-N 2.82Å; L537-A539 VanDerWaalsContact C-N 3.33Å; L537-A539 PolarHBondContact O-N 3.48Å; L537-A540 PolarHBondContact O-N 3.07Å; L537-S541 PolarHBondContact O-N 3.35Å; L537-S541 PolarHBondContact O-OG 3.07Å
538	S	89.6	Confident	76.2	Confident	66 Å²	66	80.8 Å²	80.8	46%	0.462	45%	0.451	S	S	.	.	H	α-helix	trans	-64.5	-36.9	176.2	176.4	0	0	0	0	112.5	A534 K535 I536	A534-S538 WeakPolarHBondContact O-CB 3.1Å; A534-S538 PolarHBondContact O-N 3.44Å; K535-S538 PolarHBondContact O-N 2.97Å; I536-S538 PolarHBondContact O-N 3.05Å
539	A	87.9	Confident	73.6	Confident	19 Å²	19	79.4 Å²	79.4	16%	0.157	45%	0.447	C	S	.	.	H	α-helix	trans	-71.4	-37.8	176.1	0	0	0	0	0	112.1	W488 V492 K535 I536 L537 S541 R542	W488-A539 HydrophobicContact CZ2-CB 4.12Å; V492-A539 HydrophobicContact CB-CB 4.42Å; V492-A539 HydrophobicContact CG1-CB 3.99Å; V492-A539 HydrophobicContact CG2-CB 3.48Å; V492-A539 VanDerWaalsContact CG2-CB 3.48Å; K535-A539 VanDerWaalsContact O-CB 3.32Å; K535-A539 WeakPolarHBondContact O-CB 3.49Å; K535-A539 PolarHBondContact O-N 3.18Å; I536-A539 PolarHBondContact O-N 3.33Å; L537-A539 VanDerWaalsContact C-N 3.33Å; L537-A539 PolarHBondContact O-N 3.48Å; A539-S541 VanDerWaalsContact C-N 3.3Å; A539-S541 PolarHBondContact O-N 3.14Å; A539-R542 PolarHBondContact O-N 3.06Å
540	A	84.6	Confident	70.6	Confident	11 Å²	11	84.1 Å²	84.1	9%	0.091	47%	0.472	C	S	.	.	H	α-helix	trans	-64.2	-34	175.8	0	0	0	0	0	112.5	W488 V513 I536 L537 R542	W488-A540 HydrophobicContact CH2-CB 4.3Å; W488-A540 HydrophobicContact CZ2-CB 4.18Å; V513-A540 HydrophobicContact CG1-CB 3.95Å; V513-A540 HydrophobicContact CG2-CB 4.1Å; I536-A540 WeakPolarHBondContact O-CB 3.37Å; I536-A540 PolarHBondContact O-N 3.07Å; L537-A540 PolarHBondContact O-N 3.07Å; A540-R542 VanDerWaalsContact C-N 3.26Å; A540-R542 PolarHBondContact O-N 3.29Å
541	S	76.8	Confident	67.9	Low	93 Å²	93	85.9 Å²	85.9	65%	0.65	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-6.3	178.8	-55.3	0	0	0	0	114.2	L537 A539	L537-S541 PolarHBondContact O-N 3.35Å; L537-S541 PolarHBondContact O-OG 3.07Å; A539-S541 VanDerWaalsContact C-N 3.3Å; A539-S541 PolarHBondContact O-N 3.14Å
542	R	70.5	Confident	65.5	Low	176 Å²	176	88 Å²	88	66%	0.664	49%	0.488	S	S	*	.	S	Bend	trans	-79.3	133	176.4	-72.2	176.3	179.8	-177.1	-1.3	108.3	A539 A540 L544	A539-R542 PolarHBondContact O-N 3.06Å; A540-R542 VanDerWaalsContact C-N 3.26Å; A540-R542 PolarHBondContact O-N 3.29Å; R542-L544 PolarHBondContact O-N 3.26Å
543	P	56.8	Low	63.5	Low	123 Å²	123	92 Å²	92	80%	0.799	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-54.2	129.7	176.4	21.8	-30.9	0	0	0	108.5	K545	P543-K545 PolarHBondContact O-N 3.03Å
544	L	50.9	Low	61.9	Low	128 Å²	128	97 Å²	97	67%	0.67	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-46.2	118.7	171.2	-100.1	81.1	0	0	0	106.8	R542	R542-L544 PolarHBondContact O-N 3.26Å
545	K	43.8	Very low	60.7	Low	180 Å²	180	95.6 Å²	95.6	78%	0.783	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-53.8	128.3	156.6	-80.2	-175.8	176.3	-177	0	104.8	P543 S547	P543-K545 PolarHBondContact O-N 3.03Å; K545-S547 PolarHBondContact O-N 2.91Å
546	P	33.2	Very low	60.4	Low	105 Å²	105	91.7 Å²	91.7	68%	0.682	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-50.3	121.9	-179.6	18.1	-29.1	0	0	0	107.2	H548	P546-H548 PolarHBondContact O-N 3.26Å
547	S	33.1	Very low	60.2	Low	79 Å²	79	93.2 Å²	93.2	55%	0.552	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-54.4	117.3	170.5	49	0	0	0	0	105.6	K545 T549	K545-S547 PolarHBondContact O-N 2.91Å; S547-T549 WeakPolarHBondContact CB-OG1 3.22Å; S547-T549 PolarHBondContact O-N 3.11Å; S547-T549 PolarHBondContact OG-OG1 3.25Å; S547-T549 VanDerWaalsContact OG-OG1 3.1Å
548	H	36.8	Very low	60.3	Low	162 Å²	162	91.5 Å²	91.5	75%	0.75	53%	0.525	S	S	*	.			trans	-70.6	61.4	165.8	-75.8	-82.2	0	0	0	108.2	P546	P546-H548 PolarHBondContact O-N 3.26Å
549	T	37	Very low	60.5	Low	101 Å²	101	88.3 Å²	88.3	62%	0.62	50%	0.503	S	S	*	.	S	Bend	trans	-109.3	79.8	167.1	48.1	0	0	0	0	104.8	S547	S547-T549 WeakPolarHBondContact CB-OG1 3.22Å; S547-T549 PolarHBondContact O-N 3.11Å; S547-T549 PolarHBondContact OG-OG1 3.25Å; S547-T549 VanDerWaalsContact OG-OG1 3.1Å
550	D	32.5	Very low	60.8	Low	164 Å²	164	87.4 Å²	87.4	88%	0.877	50%	0.496	S	S	*	.	S	Bend	trans	149.2	-12.4	153.4	-81.3	-14.3	0	0	0	114.5	Q552	D550-Q552 PolarHBondContact O-N 2.75Å
551	A	37.6	Very low	61.2	Low	69 Å²	69	86.9 Å²	86.9	57%	0.57	49%	0.491	S	S	*	.	S	Bend	trans	-85.2	102.5	163.3	0	0	0	0	0	108.6
552	Q	45.1	Very low	62	Low	136 Å²	136	83.1 Å²	83.1	64%	0.636	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-50.5	134.9	167.7	-72.9	-159.4	-18.8	0	0	109	D550 R607	D550-Q552 PolarHBondContact O-N 2.75Å; Q552-R607 VanDerWaalsContact CD-NH2 3.34Å
553	P	53.6	Low	62.9	Low	109 Å²	109	75.7 Å²	75.7	71%	0.708	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-56.1	142.1	178.6	21.8	-30.9	0	0	0	109.4	G555	P553-G555 PolarHBondContact O-N 2.95Å
554	P	60.9	Low	64.1	Low	123 Å²	123	73.3 Å²	73.3	80%	0.799	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-54.2	133.2	174.7	21.9	-30.7	0	0	0	109.2
555	G	68.4	Low	65.6	Low	26 Å²	26	72.2 Å²	72.2	27%	0.268	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-57.8	157.8	178.2	0	0	0	0	0	112.3	P553	P553-G555 PolarHBondContact O-N 2.95Å
556	P	84.4	Confident	67.6	Low	18 Å²	18	66.6 Å²	66.6	12%	0.117	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-60.3	148.7	-178.2	26.1	-33.8	0	0	0	111.4	V558 F586 A608 R609	P556-V558 VanDerWaalsContact C-N 3.31Å; P556-F586 HydrophobicContact CB-CB 3.98Å; P556-F586 HydrophobicContact CG-CB 3.97Å; P556-A608 HydrophobicContact CG-CB 4.19Å; P556-A608 VanDerWaalsContact O-CA 3.26Å; P556-A608 WeakPolarHBondContact O-CA 3.47Å; P556-R609 PolarHBondContact O-N 3.15Å
557	D	89.9	Confident	70.2	Confident	33 Å²	33	61.6 Å²	61.6	18%	0.176	36%	0.358	C	S	.	.	S	Bend	trans	-70.9	-33.7	176	-65.6	-56.7	0	0	0	111.3	Y583 S584 R609 N610	D557-Y583 HydrophobicContact CB-CD1 3.99Å; D557-S584 PolarHBondContact N-O 3.5Å; D557-S584 PolarHBondContact OD2-N 3.47Å; D557-R609 IonicContact OD1-CZ 3.79Å; D557-R609 IonicContact OD1-NE 3.66Å; D557-R609 IonicContact OD1-NH1 2.93Å; D557-R609 PolarHBondContact OD1-NH1 3.14Å; D557-N610 WeakPolarHBondContact O-CB 3.33Å; D557-N610 PolarHBondContact O-N 3.47Å; D557-N610 PolarHBondContact O-ND2 3.41Å
558	V	93.4	Very high	72.7	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	130	-175.7	-176.8	0	0	0	0	110.4	P556 I560 L578 Y583 S584 V585 F586 N610 I612 L693	P556-V558 VanDerWaalsContact C-N 3.31Å; V558-I560 HydrophobicContact CG1-CG1 4.09Å; V558-L578 HydrophobicContact CG1-CD1 4.19Å; V558-L578 HydrophobicContact CG2-CD1 4.41Å; V558-Y583 HydrophobicContact CG2-CD1 4.25Å; V558-S584 PolarHBondContact N-O 3.1Å; V558-V585 HydrophobicContact CB-CG1 4.34Å; V558-V585 HydrophobicContact CB-CG2 4.31Å; V558-V585 HydrophobicContact CG1-CG1 4.41Å; V558-V585 WeakPolarHBondContact O-CA 3.27Å; V558-F586 PolarHBondContact O-N 2.98Å; V558-N610 HydrophobicContact CG2-CB 4.35Å; V558-I612 HydrophobicContact CG1-CB 4.35Å; V558-I612 HydrophobicContact CG1-CD1 3.55Å; V558-I612 HydrophobicContact CG1-CG1 3.73Å; V558-L693 HydrophobicContact CG2-CD1 3.98Å; V558-L693 HydrophobicContact CG2-CD2 4.28Å
559	F	93.5	Very high	75	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129.9	164.1	-175.4	-82	0	0	0	109.2	F586 L601 V605 A608 N610 F611 I612 E636	F559-F586 HydrophobicContact CD2-CB 4.49Å; F559-F586 AromaticContact CD2-CD1 3.57Å; F559-F586 HydrophobicContact CD2-CD1 3.57Å; F559-F586 HydrophobicContact CD2-CE1 4.29Å; F559-F586 HydrophobicContact CD2-CG 4.44Å; F559-F586 AromaticContact CE2-CD1 3.46Å; F559-F586 HydrophobicContact CE2-CD1 3.46Å; F559-F586 VanDerWaalsContact CE2-CD1 3.46Å; F559-F586 AromaticContact CE2-CE1 3.74Å; F559-F586 HydrophobicContact CE2-CE1 3.74Å; F559-F586 HydrophobicContact CZ-CD1 4.5Å; F559-L601 HydrophobicContact CE2-CD1 4.04Å; F559-L601 HydrophobicContact CZ-CD1 3.84Å; F559-L601 HydrophobicContact CZ-CG 4.49Å; F559-V605 HydrophobicContact CD1-CG2 3.95Å; F559-V605 HydrophobicContact CD2-CG2 3.81Å; F559-V605 HydrophobicContact CE1-CG2 3.69Å; F559-V605 HydrophobicContact CE2-CG2 3.52Å; F559-V605 HydrophobicContact CG-CG2 4.01Å; F559-V605 HydrophobicContact CZ-CG2 3.47Å; F559-V605 VanDerWaalsContact CZ-CG2 3.47Å; F559-A608 HydrophobicContact CB-CB 3.66Å; F559-N610 PolarHBondContact N-O 3.04Å; F559-F611 HydrophobicContact CB-CD2 4.28Å; F559-F611 AromaticContact CD1-CD2 3.63Å; F559-F611 HydrophobicContact CD1-CD2 3.63Å; F559-F611 AromaticContact CD1-CE2 3.46Å; F559-F611 HydrophobicContact CD1-CE2 3.46Å; F559-F611 VanDerWaalsContact CD1-CE2 3.46Å; F559-F611 HydrophobicContact CD1-CZ 4.47Å; F559-F611 HydrophobicContact CE1-CD2 4.42Å; F559-F611 AromaticContact CE1-CE2 3.8Å; F559-F611 HydrophobicContact CE1-CE2 3.8Å; F559-F611 HydrophobicContact CG-CD2 4.29Å; F559-F611 HydrophobicContact CG-CE2 4.46Å; F559-I612 PolarHBondContact O-N 3.3Å; F559-E636 HydrophobicContact CE1-CG 4.21Å; F559-E636 HydrophobicContact CZ-CG 4.27Å
560	I	94.4	Very high	77.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	111.9	175.8	-56.7	-177.4	0	0	0	109.7	V558 A571 L574 K575 V585 F586 I612 V614	V558-I560 HydrophobicContact CG1-CG1 4.09Å; I560-A571 HydrophobicContact CG2-CB 3.89Å; I560-L574 HydrophobicContact CD1-CB 3.89Å; I560-K575 HydrophobicContact CD1-CB 4.15Å; I560-V585 HydrophobicContact CD1-CG1 3.5Å; I560-V585 VanDerWaalsContact CD1-CG1 3.5Å; I560-V585 HydrophobicContact CG1-CG1 3.72Å; I560-F586 PolarHBondContact N-O 3.37Å; I560-I612 WeakPolarHBondContact CA-O 3.5Å; I560-I612 HydrophobicContact CG1-CB 4.29Å; I560-V614 HydrophobicContact CG2-CG2 3.79Å
561	S	93.2	Very high	80.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	134.2	168.5	178.7	0	0	0	0	109.8	I612 V614 E636	S561-I612 PolarHBondContact N-O 2.82Å; S561-V614 PolarHBondContact O-N 3.2Å; S561-E636 VanDerWaalsContact CB-OE2 3.25Å; S561-E636 WeakPolarHBondContact CB-OE2 3.47Å; S561-E636 PolarHBondContact OG-OE2 3.43Å
562	Y	92.4	Very high	82.9	Confident	14 Å²	14	38.4 Å²	38.4	6%	0.055	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	156.8	-177	69.9	-75.7	0	0	0	111.7	F257 R564 A571 I587 D588	F257-Y562 HydrophobicContact CE1-CE2 4.3Å; F257-Y562 HydrophobicContact CZ-CE2 4.21Å; F257-Y562 AromaticContact CZ-CZ 3.9Å; F257-Y562 VanDerWaalsContact CZ-OH 3.32Å; F257-Y562 WeakPolarHBondContact CZ-OH 3.34Å; Y562-R564 HydrophobicContact CE2-CB 4.49Å; Y562-R564 HydrophobicContact CE2-CG 4.16Å; Y562-R564 PolarHBondContact O-N 2.93Å; Y562-A571 HydrophobicContact CD1-CB 3.78Å; Y562-A571 HydrophobicContact CD2-CB 3.97Å; Y562-A571 HydrophobicContact CG-CB 3.52Å; Y562-I587 HydrophobicContact CD1-CD1 3.98Å; Y562-I587 HydrophobicContact CD1-CG1 3.83Å; Y562-I587 HydrophobicContact CE1-CD1 3.64Å; Y562-I587 HydrophobicContact CE1-CG1 3.33Å; Y562-D588 PolarHBondContact OH-O 3.37Å
563	R	89.8	Confident	85.1	Confident	19 Å²	19	32.2 Å²	32.2	7%	0.072	19%	0.19	C	C	.	.			trans	-81.7	118.2	172.9	-170.8	60	60.1	-171.5	13.5	110	T565 T566 G567 A619 C623 D631 V633	R563-T565 PolarHBondContact O-N 3.22Å; R563-T566 PolarHBondContact O-N 2.78Å; R563-G567 WeakPolarHBondContact O-CA 3.2Å; R563-G567 PolarHBondContact O-N 3.38Å; R563-A619 HydrophobicContact CB-CB 4.22Å; R563-A619 PolarHBondContact NE-O 3.25Å; R563-A619 PolarHBondContact NH2-O 3.15Å; R563-C623 PolarHBondContact NH2-SG 3.23Å; R563-D631 IonicContact CZ-OD1 3.23Å; R563-D631 IonicContact CZ-OD2 2.69Å; R563-D631 VanDerWaalsContact NH1-CG 3.3Å; R563-D631 IonicContact NH1-OD1 3.88Å; R563-D631 PolarHBondContact NH1-OD1 3.02Å; R563-D631 IonicContact NH1-OD2 2.89Å; R563-D631 PolarHBondContact NH1-OD2 3Å; R563-D631 IonicContact NH2-OD1 3.28Å; R563-D631 PolarHBondContact NH2-OD1 3.05Å; R563-D631 IonicContact NH2-OD2 2.55Å; R563-V633 VanDerWaalsContact CZ-CG2 3.49Å
564	R	82.3	Confident	87	Confident	73 Å²	73	27 Å²	27	28%	0.275	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-26.5	-174.6	-64.6	-175.6	-173.8	167.3	1.6	116.1	Y562 D588	Y562-R564 HydrophobicContact CE2-CB 4.49Å; Y562-R564 HydrophobicContact CE2-CG 4.16Å; Y562-R564 PolarHBondContact O-N 2.93Å; R564-D588 IonicContact CZ-OD2 3.07Å; R564-D588 IonicContact NE-OD2 3.48Å; R564-D588 IonicContact NH2-OD2 3.09Å; R564-D588 PolarHBondContact NH2-OD2 3.36Å
565	T	81.9	Confident	88.5	Confident	105 Å²	105	21.5 Å²	21.5	64%	0.644	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-30.4	-177.6	47.6	0	0	0	0	113.4	R563	R563-T565 PolarHBondContact O-N 3.22Å
566	T	86.9	Confident	89.5	Confident	62 Å²	62	20.3 Å²	20.3	38%	0.38	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.8	-17.4	-170.4	55.2	0	0	0	0	114.3	R563 S616 A617	R563-T566 PolarHBondContact O-N 2.78Å; T566-S616 WeakPolarHBondContact O-CB 3.37Å; T566-S616 PolarHBondContact OG1-OG 3.02Å; T566-A617 WeakPolarHBondContact CB-O 3.21Å; T566-A617 WeakPolarHBondContact CG2-O 3.46Å; T566-A617 PolarHBondContact OG1-O 3.06Å
567	G	86.1	Confident	89.8	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.01	10%	0.102	C	C	.	.	S	Bend	trans	-113.7	3.1	-173.8	0	0	0	0	0	115	R563 Q569 A571 S616	R563-G567 WeakPolarHBondContact O-CA 3.2Å; R563-G567 PolarHBondContact O-N 3.38Å; G567-Q569 PolarHBondContact O-N 2.95Å; G567-A571 VanDerWaalsContact O-CB 3.24Å; G567-A571 WeakPolarHBondContact O-CB 3.45Å; G567-A571 PolarHBondContact O-N 3.23Å; G567-S616 WeakPolarHBondContact CA-OG 3.43Å; G567-S616 PolarHBondContact N-OG 3.29Å
568	S	86.1	Confident	89.9	Confident	18 Å²	18	17.9 Å²	17.9	13%	0.126	9%	0.094	C	C	.	.	H	α-helix	trans	-61.4	-42.4	-175.6	49.2	0	0	0	0	113	S572	S568-S572 WeakPolarHBondContact O-CB 3.43Å; S568-S572 PolarHBondContact O-N 3.05Å; S568-S572 PolarHBondContact O-OG 3Å
569	Q	85.9	Confident	89.7	Confident	60 Å²	60	19.3 Å²	19.3	28%	0.28	10%	0.1	S	C	.	.	H	α-helix	trans	-66.1	-48.3	179.9	-173.5	-179.2	43.2	0	0	112	G567 A571 S572 L573	G567-Q569 PolarHBondContact O-N 2.95Å; Q569-A571 VanDerWaalsContact C-N 3.35Å; Q569-A571 PolarHBondContact O-N 3.48Å; Q569-S572 PolarHBondContact O-N 3.4Å; Q569-S572 PolarHBondContact O-OG 3.4Å; Q569-L573 HydrophobicContact CG-CD1 4.45Å; Q569-L573 WeakPolarHBondContact O-CG 3.41Å; Q569-L573 PolarHBondContact O-N 3.43Å
570	L	90.5	Very high	89.4	Confident	7 Å²	7	21 Å²	21	4%	0.037	11%	0.11	C	C	.	.	H	α-helix	trans	-65.4	-39.9	178	178.2	54.1	0	0	0	111.5	S572 L573 L574 V614 V650 D652 W677	L570-S572 PolarHBondContact O-N 2.94Å; L570-L573 PolarHBondContact O-N 3.49Å; L570-L574 HydrophobicContact CD1-CD1 4.22Å; L570-L574 HydrophobicContact CD1-CG 4.01Å; L570-L574 HydrophobicContact CG-CD1 4.13Å; L570-L574 HydrophobicContact CG-CG 4.39Å; L570-L574 WeakPolarHBondContact O-CB 3.48Å; L570-L574 VanDerWaalsContact O-CG 3.27Å; L570-L574 WeakPolarHBondContact O-CG 3.06Å; L570-L574 PolarHBondContact O-N 3.13Å; L570-V614 HydrophobicContact CB-CG1 4.11Å; L570-V614 HydrophobicContact CD2-CG1 3.82Å; L570-V614 HydrophobicContact CG-CG1 4.01Å; L570-V650 HydrophobicContact CD2-CG1 4.2Å; L570-D652 HydrophobicContact CD2-CB 3.6Å; L570-W677 HydrophobicContact CD1-CB 4.5Å; L570-W677 HydrophobicContact CD1-CD2 3.37Å; L570-W677 VanDerWaalsContact CD1-CE2 3.46Å; L570-W677 HydrophobicContact CD1-CE3 3.75Å; L570-W677 HydrophobicContact CD1-CG 3.7Å; L570-W677 HydrophobicContact CD1-CH2 4.27Å; L570-W677 HydrophobicContact CD1-CZ2 3.92Å; L570-W677 HydrophobicContact CD1-CZ3 4.19Å; L570-W677 HydrophobicContact CD2-CB 4.16Å; L570-W677 HydrophobicContact CD2-CG 4.1Å
571	A	91.8	Very high	89.1	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.2	-42	177.2	0	0	0	0	0	112.4	I560 Y562 G567 Q569 L574 K575 I587 V614	I560-A571 HydrophobicContact CG2-CB 3.89Å; Y562-A571 HydrophobicContact CD1-CB 3.78Å; Y562-A571 HydrophobicContact CD2-CB 3.97Å; Y562-A571 HydrophobicContact CG-CB 3.52Å; G567-A571 VanDerWaalsContact O-CB 3.24Å; G567-A571 WeakPolarHBondContact O-CB 3.45Å; G567-A571 PolarHBondContact O-N 3.23Å; Q569-A571 VanDerWaalsContact C-N 3.35Å; Q569-A571 PolarHBondContact O-N 3.48Å; A571-L574 PolarHBondContact O-N 3.21Å; A571-K575 WeakPolarHBondContact O-CB 3.36Å; A571-K575 PolarHBondContact O-N 3.5Å; A571-I587 HydrophobicContact CB-CD1 3.57Å; A571-V614 HydrophobicContact CB-CG2 4.12Å
572	S	89.9	Confident	88.8	Confident	2 Å²	2	27.7 Å²	27.7	1%	0.014	16%	0.156	C	C	.	.	H	α-helix	trans	-68.1	-39.2	177	67.4	0	0	0	0	112.3	S568 Q569 L570 K575 V576	S568-S572 WeakPolarHBondContact O-CB 3.43Å; S568-S572 PolarHBondContact O-N 3.05Å; S568-S572 PolarHBondContact O-OG 3Å; Q569-S572 PolarHBondContact O-N 3.4Å; Q569-S572 PolarHBondContact O-OG 3.4Å; L570-S572 PolarHBondContact O-N 2.94Å; S572-K575 WeakPolarHBondContact O-CB 3.38Å; S572-K575 PolarHBondContact O-N 3.26Å; S572-V576 WeakPolarHBondContact O-CG2 3.25Å; S572-V576 PolarHBondContact O-N 3.26Å; S572-V576 VanDerWaalsContact O-N 3.11Å
573	L	91.3	Very high	88.6	Confident	6 Å²	6	29 Å²	29	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-61.7	-49.1	173.1	-73.6	172.6	0	0	0	111.7	P254 Q569 L570 K575 V576 H577 W677	P254-L573 HydrophobicContact CG-CD2 4.45Å; Q569-L573 HydrophobicContact CG-CD1 4.45Å; Q569-L573 WeakPolarHBondContact O-CG 3.41Å; Q569-L573 PolarHBondContact O-N 3.43Å; L570-L573 PolarHBondContact O-N 3.49Å; L573-K575 VanDerWaalsContact C-N 3.28Å; L573-K575 PolarHBondContact O-N 3.35Å; L573-V576 PolarHBondContact O-N 3.17Å; L573-H577 PolarHBondContact O-CD2 3.34Å; L573-H577 VanDerWaalsContact O-CD2 3.25Å; L573-H577 PolarHBondContact O-N 2.75Å; L573-W677 HydrophobicContact CD1-CZ2 4.43Å
574	L	93.1	Very high	88.5	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57.4	-43	177.4	-72.4	174.1	0	0	0	111.5	I560 L570 A571 H577 L578 I612 V614 V650 W677 I686 I689	I560-L574 HydrophobicContact CD1-CB 3.89Å; L570-L574 HydrophobicContact CD1-CD1 4.22Å; L570-L574 HydrophobicContact CD1-CG 4.01Å; L570-L574 HydrophobicContact CG-CD1 4.13Å; L570-L574 HydrophobicContact CG-CG 4.39Å; L570-L574 WeakPolarHBondContact O-CB 3.48Å; L570-L574 VanDerWaalsContact O-CG 3.27Å; L570-L574 WeakPolarHBondContact O-CG 3.06Å; L570-L574 PolarHBondContact O-N 3.13Å; A571-L574 PolarHBondContact O-N 3.21Å; L574-H577 PolarHBondContact O-N 2.9Å; L574-L578 WeakPolarHBondContact O-CB 3.22Å; L574-L578 WeakPolarHBondContact O-CD1 3.49Å; L574-L578 WeakPolarHBondContact O-CG 3.32Å; L574-L578 PolarHBondContact O-N 3.36Å; L574-I612 HydrophobicContact CD1-CG2 4.11Å; L574-V614 HydrophobicContact CD1-CG2 3.79Å; L574-V650 HydrophobicContact CD1-CB 4.46Å; L574-V650 HydrophobicContact CD1-CG1 4.41Å; L574-V650 HydrophobicContact CD1-CG2 4.34Å; L574-W677 HydrophobicContact CD2-CE3 4.35Å; L574-W677 HydrophobicContact CD2-CZ3 3.91Å; L574-I686 HydrophobicContact CD2-CD1 3.63Å; L574-I689 HydrophobicContact CD2-CD1 3.6Å
575	K	92.6	Very high	88.9	Confident	8 Å²	8	28.2 Å²	28.2	4%	0.035	17%	0.169	C	C	.	.	H	α-helix	trans	-55.7	-53.7	176.4	-170.5	-146.2	176.9	-157.7	0	111.2	F253 S288 I560 A571 S572 L573 L578 Q579 V585 I587	F253-K575 HydrophobicContact CD1-CD 3.62Å; F253-K575 HydrophobicContact CD2-CD 4.35Å; F253-K575 HydrophobicContact CE1-CD 3.44Å; F253-K575 VanDerWaalsContact CE1-CD 3.44Å; F253-K575 HydrophobicContact CE2-CD 4.19Å; F253-K575 HydrophobicContact CG-CD 4.09Å; F253-K575 HydrophobicContact CZ-CD 3.74Å; S288-K575 PolarHBondContact O-NZ 2.81Å; I560-K575 HydrophobicContact CD1-CB 4.15Å; A571-K575 WeakPolarHBondContact O-CB 3.36Å; A571-K575 PolarHBondContact O-N 3.5Å; S572-K575 WeakPolarHBondContact O-CB 3.38Å; S572-K575 PolarHBondContact O-N 3.26Å; L573-K575 VanDerWaalsContact C-N 3.28Å; L573-K575 PolarHBondContact O-N 3.35Å; K575-L578 PolarHBondContact O-N 2.9Å; K575-Q579 VanDerWaalsContact CD-OE1 3.31Å; K575-Q579 WeakPolarHBondContact O-CB 3.29Å; K575-Q579 WeakPolarHBondContact O-CG 3.22Å; K575-Q579 PolarHBondContact O-N 2.72Å; K575-V585 HydrophobicContact CB-CG1 4.21Å; K575-V585 HydrophobicContact CG-CB 3.94Å; K575-V585 HydrophobicContact CG-CG1 3.79Å; K575-I587 HydrophobicContact CD-CG2 3.98Å
576	V	89.3	Confident	89.1	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.9	-49	-179.4	173.7	0	0	0	0	111.7	E250 W251 F253 P254 S572 L573 L578 Q579 V580	E250-V576 HydrophobicContact CB-CG1 4.02Å; E250-V576 WeakPolarHBondContact O-CG2 3.29Å; W251-V576 HydrophobicContact CD2-CG1 3.68Å; W251-V576 HydrophobicContact CE3-CG1 3.72Å; W251-V576 HydrophobicContact CG-CG1 4.21Å; W251-V576 HydrophobicContact CH2-CG1 4.07Å; W251-V576 HydrophobicContact CZ2-CG1 4.07Å; W251-V576 HydrophobicContact CZ3-CG1 3.9Å; F253-V576 HydrophobicContact CB-CG2 4.13Å; P254-V576 HydrophobicContact CG-CB 4.49Å; P254-V576 HydrophobicContact CG-CG2 3.61Å; S572-V576 WeakPolarHBondContact O-CG2 3.25Å; S572-V576 PolarHBondContact O-N 3.26Å; S572-V576 VanDerWaalsContact O-N 3.11Å; L573-V576 PolarHBondContact O-N 3.17Å; V576-L578 PolarHBondContact O-N 3.44Å; V576-Q579 PolarHBondContact O-N 3.03Å; V576-V580 HydrophobicContact CG1-CG2 4.06Å; V576-V580 WeakPolarHBondContact O-CB 3.08Å; V576-V580 VanDerWaalsContact O-CG2 3.23Å; V576-V580 WeakPolarHBondContact O-CG2 3.38Å; V576-V580 PolarHBondContact O-N 3.1Å
577	H	91.4	Very high	89.1	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-59	-36.7	-179.4	-86.5	-86.9	0	0	0	112.3	W251 L573 L574 R581 I686	W251-H577 AromaticContact CH2-CE1 3.85Å; W251-H577 AromaticContact CH2-NE2 3.61Å; L573-H577 PolarHBondContact O-CD2 3.34Å; L573-H577 VanDerWaalsContact O-CD2 3.25Å; L573-H577 PolarHBondContact O-N 2.75Å; L574-H577 PolarHBondContact O-N 2.9Å; H577-R581 PolarHBondContact ND1-NH1 3.2Å; H577-R581 WeakPolarHBondContact O-CD 3.48Å; H577-R581 WeakPolarHBondContact O-CG 3.32Å; H577-R581 PolarHBondContact O-NH1 3.18Å; H577-I686 HydrophobicContact CB-CD1 3.53Å; H577-I686 HydrophobicContact CB-CG1 3.81Å; H577-I686 HydrophobicContact CB-CG2 4.16Å
578	L	92.1	Very high	88.5	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-75.4	-41.8	176.8	-70.4	172.7	0	0	0	112.2	V558 L574 K575 V576 R581 G582 Y583 V585 I612 I690 L693	V558-L578 HydrophobicContact CG1-CD1 4.19Å; V558-L578 HydrophobicContact CG2-CD1 4.41Å; L574-L578 WeakPolarHBondContact O-CB 3.22Å; L574-L578 WeakPolarHBondContact O-CD1 3.49Å; L574-L578 WeakPolarHBondContact O-CG 3.32Å; L574-L578 PolarHBondContact O-N 3.36Å; K575-L578 PolarHBondContact O-N 2.9Å; V576-L578 PolarHBondContact O-N 3.44Å; L578-R581 CarbonylContact O-C 3.43Å; L578-R581 PolarHBondContact O-N 3.42Å; L578-R581 VanDerWaalsContact O-N 3.1Å; L578-G582 PolarHBondContact O-N 3.35Å; L578-Y583 HydrophobicContact CD2-CD2 4.18Å; L578-Y583 WeakPolarHBondContact O-CB 3.17Å; L578-Y583 PolarHBondContact O-N 3.12Å; L578-V585 HydrophobicContact CB-CG2 3.55Å; L578-V585 HydrophobicContact CD1-CG2 4.18Å; L578-I612 HydrophobicContact CD1-CD1 3.67Å; L578-I690 HydrophobicContact CD2-CG1 4Å; L578-L693 HydrophobicContact CD1-CD1 4.4Å; L578-L693 HydrophobicContact CD2-CD1 3.71Å
579	Q	89.6	Confident	87.5	Confident	29 Å²	29	24.5 Å²	24.5	14%	0.136	14%	0.139	C	C	.	.	H	α-helix	trans	-62.7	-43.2	177.2	-76.5	177.8	-70.6	0	0	112.5	E250 S288 K575 V576 R581 G582 V585	E250-Q579 PolarHBondContact OE2-NE2 3.1Å; E250-Q579 PolarHBondContact OE2-OE1 3.28Å; S288-Q579 PolarHBondContact O-NE2 2.95Å; K575-Q579 VanDerWaalsContact CD-OE1 3.31Å; K575-Q579 WeakPolarHBondContact O-CB 3.29Å; K575-Q579 WeakPolarHBondContact O-CG 3.22Å; K575-Q579 PolarHBondContact O-N 2.72Å; V576-Q579 PolarHBondContact O-N 3.03Å; Q579-R581 PolarHBondContact O-N 2.98Å; Q579-R581 VanDerWaalsContact O-N 3.11Å; Q579-G582 PolarHBondContact O-N 2.9Å; Q579-V585 HydrophobicContact CG-CB 4.29Å; Q579-V585 HydrophobicContact CG-CG2 4.11Å
580	V	87	Confident	85.9	Confident	36 Å²	36	26.1 Å²	26.1	22%	0.218	15%	0.147	C	C	.	.	H	α-helix	trans	-55	-29.4	174.1	159	0	0	0	0	111.8	Q247 E250 V576	Q247-V580 HydrophobicContact CB-CG2 4.4Å; Q247-V580 PolarHBondContact NE2-O 2.85Å; Q247-V580 VanDerWaalsContact OE1-CG2 3.31Å; E250-V580 HydrophobicContact CB-CG2 4.33Å; V576-V580 HydrophobicContact CG1-CG2 4.06Å; V576-V580 WeakPolarHBondContact O-CB 3.08Å; V576-V580 VanDerWaalsContact O-CG2 3.23Å; V576-V580 WeakPolarHBondContact O-CG2 3.38Å; V576-V580 PolarHBondContact O-N 3.1Å
581	R	88.4	Confident	84.1	Confident	75 Å²	75	32.6 Å²	32.6	28%	0.283	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	9.6	179.1	-66.5	173.5	178.8	70.6	-2.5	114.1	H577 L578 Q579 Y583 E683	H577-R581 PolarHBondContact ND1-NH1 3.2Å; H577-R581 WeakPolarHBondContact O-CD 3.48Å; H577-R581 WeakPolarHBondContact O-CG 3.32Å; H577-R581 PolarHBondContact O-NH1 3.18Å; L578-R581 CarbonylContact O-C 3.43Å; L578-R581 PolarHBondContact O-N 3.42Å; L578-R581 VanDerWaalsContact O-N 3.1Å; Q579-R581 PolarHBondContact O-N 2.98Å; Q579-R581 VanDerWaalsContact O-N 3.11Å; R581-Y583 HydrophobicContact CB-CD2 4.42Å; R581-E683 IonicContact CZ-OE1 3.97Å; R581-E683 IonicContact CZ-OE2 3.4Å; R581-E683 IonicContact NH2-OE1 3.88Å; R581-E683 PolarHBondContact NH2-OE1 3.39Å; R581-E683 IonicContact NH2-OE2 3.15Å; R581-E683 PolarHBondContact NH2-OE2 3.46Å
582	G	85.7	Confident	81.6	Confident	65 Å²	65	37.1 Å²	37.1	67%	0.67	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.8	8.8	172.1	0	0	0	0	0	116	L578 Q579	L578-G582 PolarHBondContact O-N 3.35Å; Q579-G582 PolarHBondContact O-N 2.9Å
583	Y	89.5	Confident	79	Confident	41 Å²	41	45.7 Å²	45.7	16%	0.161	24%	0.238	C	C	.	.			trans	-82.3	136.4	174.2	-72.5	-88.9	0	0	0	111.5	D557 V558 L578 R581 V585 I690 K694	D557-Y583 HydrophobicContact CB-CD1 3.99Å; V558-Y583 HydrophobicContact CG2-CD1 4.25Å; L578-Y583 HydrophobicContact CD2-CD2 4.18Å; L578-Y583 WeakPolarHBondContact O-CB 3.17Å; L578-Y583 PolarHBondContact O-N 3.12Å; R581-Y583 HydrophobicContact CB-CD2 4.42Å; Y583-V585 PolarHBondContact O-N 3.47Å; Y583-I690 HydrophobicContact CE2-CG1 4.24Å; Y583-I690 HydrophobicContact CE2-CG2 4.33Å; Y583-K694 VanDerWaalsContact OH-CE 3.27Å; Y583-K694 WeakPolarHBondContact OH-CE 3.38Å
584	S	87.2	Confident	76.2	Confident	61 Å²	61	50.8 Å²	50.8	43%	0.427	28%	0.281	S	S	.	.			trans	-76.8	116.4	165.7	175.7	0	0	0	0	109.7	D557 V558	D557-S584 PolarHBondContact N-O 3.5Å; D557-S584 PolarHBondContact OD2-N 3.47Å; V558-S584 PolarHBondContact N-O 3.1Å
585	V	89.7	Confident	73.8	Confident	15 Å²	15	54.4 Å²	54.4	9%	0.091	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129.6	-176.5	-170.8	0	0	0	0	110.8	V558 I560 K575 L578 Q579 Y583	V558-V585 HydrophobicContact CB-CG1 4.34Å; V558-V585 HydrophobicContact CB-CG2 4.31Å; V558-V585 HydrophobicContact CG1-CG1 4.41Å; V558-V585 WeakPolarHBondContact O-CA 3.27Å; I560-V585 HydrophobicContact CD1-CG1 3.5Å; I560-V585 VanDerWaalsContact CD1-CG1 3.5Å; I560-V585 HydrophobicContact CG1-CG1 3.72Å; K575-V585 HydrophobicContact CB-CG1 4.21Å; K575-V585 HydrophobicContact CG-CB 3.94Å; K575-V585 HydrophobicContact CG-CG1 3.79Å; L578-V585 HydrophobicContact CB-CG2 3.55Å; L578-V585 HydrophobicContact CD1-CG2 4.18Å; Q579-V585 HydrophobicContact CG-CB 4.29Å; Q579-V585 HydrophobicContact CG-CG2 4.11Å; Y583-V585 PolarHBondContact O-N 3.47Å
586	F	88.1	Confident	71.9	Confident	65 Å²	65	61.9 Å²	61.9	29%	0.285	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	133	171.9	-173	-90.8	0	0	0	110.6	P556 V558 F559 I560 L601	P556-F586 HydrophobicContact CB-CB 3.98Å; P556-F586 HydrophobicContact CG-CB 3.97Å; V558-F586 PolarHBondContact O-N 2.98Å; F559-F586 HydrophobicContact CD2-CB 4.49Å; F559-F586 AromaticContact CD2-CD1 3.57Å; F559-F586 HydrophobicContact CD2-CD1 3.57Å; F559-F586 HydrophobicContact CD2-CE1 4.29Å; F559-F586 HydrophobicContact CD2-CG 4.44Å; F559-F586 AromaticContact CE2-CD1 3.46Å; F559-F586 HydrophobicContact CE2-CD1 3.46Å; F559-F586 VanDerWaalsContact CE2-CD1 3.46Å; F559-F586 AromaticContact CE2-CE1 3.74Å; F559-F586 HydrophobicContact CE2-CE1 3.74Å; F559-F586 HydrophobicContact CZ-CD1 4.5Å; I560-F586 PolarHBondContact N-O 3.37Å; F586-L601 HydrophobicContact CE1-CD1 4.37Å
587	I	86.4	Confident	70.3	Confident	11 Å²	11	63.6 Å²	63.6	6%	0.056	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	141.1	173.8	-170.6	174.3	0	0	0	108.5	F253 F257 Y562 A571 K575 V589	F253-I587 HydrophobicContact CE1-CG2 4.22Å; F253-I587 HydrophobicContact CZ-CG2 3.74Å; F257-I587 HydrophobicContact CE1-CD1 4.44Å; Y562-I587 HydrophobicContact CD1-CD1 3.98Å; Y562-I587 HydrophobicContact CD1-CG1 3.83Å; Y562-I587 HydrophobicContact CE1-CD1 3.64Å; Y562-I587 HydrophobicContact CE1-CG1 3.33Å; A571-I587 HydrophobicContact CB-CD1 3.57Å; K575-I587 HydrophobicContact CD-CG2 3.98Å; I587-V589 HydrophobicContact CG2-CG2 4.48Å; I587-V589 PolarHBondContact O-N 3.03Å
588	D	73.7	Confident	68.9	Low	7 Å²	7	67.6 Å²	67.6	4%	0.037	38%	0.377	C	S	.	.			trans	-70.2	124.4	175.7	-179.6	30	0	0	0	111.4	Y562 R564 F597 L601	Y562-D588 PolarHBondContact OH-O 3.37Å; R564-D588 IonicContact CZ-OD2 3.07Å; R564-D588 IonicContact NE-OD2 3.48Å; R564-D588 IonicContact NH2-OD2 3.09Å; R564-D588 PolarHBondContact NH2-OD2 3.36Å; D588-F597 VanDerWaalsContact OD1-CZ 3.28Å; D588-F597 WeakPolarHBondContact OD1-CZ 3.35Å; D588-L601 HydrophobicContact CB-CD1 4.29Å
589	V	63.8	Low	67.8	Low	26 Å²	26	73.2 Å²	73.2	16%	0.158	41%	0.407	C	S	.	.			trans	-109.7	131	176.9	176.5	0	0	0	0	108.6	L293 I587 K591	L293-V589 HydrophobicContact CD2-CB 4.18Å; L293-V589 HydrophobicContact CD2-CG1 3.26Å; L293-V589 HydrophobicContact CD2-CG2 3.79Å; I587-V589 HydrophobicContact CG2-CG2 4.48Å; I587-V589 PolarHBondContact O-N 3.03Å; V589-K591 PolarHBondContact O-N 3.35Å
590	E	53.9	Low	67	Low	94 Å²	94	78.1 Å²	78.1	44%	0.439	43%	0.428	S	S	.	.	S	Bend	trans	-53.7	-7.9	-159	-142.1	161.3	-152.6	0	0	118.4	K259	K259-E590 WeakPolarHBondContact CE-OE2 3.48Å; K259-E590 VanDerWaalsContact NZ-CD 3.27Å; K259-E590 IonicContact NZ-OE1 3.68Å; K259-E590 PolarHBondContact NZ-OE1 3.12Å; K259-E590 IonicContact NZ-OE2 3.56Å; K259-E590 PolarHBondContact NZ-OE2 3.45Å
591	K	51.4	Low	66.5	Low	143 Å²	143	76.7 Å²	76.7	62%	0.622	42%	0.419	S	S	*	.			trans	-149.4	76.7	-177.5	-71.1	-174.9	179.4	172.3	0	113.8	P296 V589	P296-K591 HydrophobicContact CB-CB 4.42Å; P296-K591 HydrophobicContact CB-CD 4.38Å; V589-K591 PolarHBondContact O-N 3.35Å
592	L	40.2	Very low	66.2	Low	94 Å²	94	75.2 Å²	75.2	49%	0.492	42%	0.416	S	S	.	.	S	Bend	trans	-98.4	119	150.5	-81.9	152.3	0	0	0	107.6	F597	L592-F597 HydrophobicContact CB-CD2 4.11Å; L592-F597 HydrophobicContact CB-CE2 4.39Å
593	E	34.4	Very low	66	Low	182 Å²	182	76 Å²	76	85%	0.85	40%	0.403	S	S	*	.			trans	-19.1	123.8	-174.3	-64	173.2	159.8	0	0	117.1	G595	E593-G595 PolarHBondContact O-N 3.5Å; E593-G595 VanDerWaalsContact O-N 3.14Å
594	A	33.8	Very low	65.8	Low	113 Å²	113	75.1 Å²	75.1	93%	0.934	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	114.4	175.4	0	0	0	0	0	111.2
595	G	42.6	Very low	65.7	Low	76 Å²	76	72.3 Å²	72.3	78%	0.784	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	147.9	-27.3	166.4	0	0	0	0	0	115.8	E593	E593-G595 PolarHBondContact O-N 3.5Å; E593-G595 VanDerWaalsContact O-N 3.14Å
596	K	52.8	Low	65.6	Low	165 Å²	165	77 Å²	77	72%	0.717	40%	0.403	S	S	*	.	S	Bend	trans	-134.5	28	177.5	-66.4	-175.8	178.2	178.5	0	113.2
597	F	55.4	Low	65.6	Low	37 Å²	37	78.2 Å²	78.2	16%	0.162	41%	0.406	C	S	.	.	H	α-helix	trans	-78.4	-38.2	-172	178.2	-99	0	0	0	112.8	D588 L592 D599 K600 L601 W632	D588-F597 VanDerWaalsContact OD1-CZ 3.28Å; D588-F597 WeakPolarHBondContact OD1-CZ 3.35Å; L592-F597 HydrophobicContact CB-CD2 4.11Å; L592-F597 HydrophobicContact CB-CE2 4.39Å; F597-D599 PolarHBondContact O-N 3Å; F597-K600 PolarHBondContact O-N 3.12Å; F597-L601 HydrophobicContact CE1-CB 4.41Å; F597-L601 HydrophobicContact CE1-CD2 3.85Å; F597-L601 HydrophobicContact CZ-CD1 4.31Å; F597-L601 HydrophobicContact CZ-CD2 4.19Å; F597-L601 WeakPolarHBondContact O-CB 3.41Å; F597-L601 PolarHBondContact O-N 3.02Å; F597-W632 AromaticContact CD1-CH2 3.61Å; F597-W632 HydrophobicContact CD1-CH2 3.61Å; F597-W632 AromaticContact CD1-CZ2 4Å; F597-W632 HydrophobicContact CD1-CZ2 4Å; F597-W632 AromaticContact CD1-CZ3 3.89Å; F597-W632 HydrophobicContact CD1-CZ3 3.89Å; F597-W632 HydrophobicContact CE1-CD2 4.36Å; F597-W632 HydrophobicContact CE1-CE3 4.13Å; F597-W632 AromaticContact CE1-CH2 4Å; F597-W632 HydrophobicContact CE1-CH2 4Å; F597-W632 HydrophobicContact CE1-CZ2 4.21Å; F597-W632 AromaticContact CE1-CZ3 3.94Å; F597-W632 HydrophobicContact CE1-CZ3 3.94Å
598	E	61.3	Low	65.7	Low	84 Å²	84	77.8 Å²	77.8	39%	0.393	40%	0.404	S	S	.	.	H	α-helix	trans	-60.9	-46	-176.2	-174	162.6	-169.2	0	0	112.3	K600 L601 I602 W632 K635	E598-K600 PolarHBondContact O-N 3.5Å; E598-L601 PolarHBondContact O-N 3.33Å; E598-I602 HydrophobicContact CG-CD1 3.69Å; E598-I602 WeakPolarHBondContact O-CB 3.36Å; E598-I602 VanDerWaalsContact O-CG1 3.28Å; E598-I602 WeakPolarHBondContact O-CG1 3.38Å; E598-I602 PolarHBondContact O-N 3.09Å; E598-W632 HydrophobicContact CB-CH2 4.14Å; E598-W632 HydrophobicContact CB-CZ3 4.24Å; E598-W632 HydrophobicContact CG-CH2 4.47Å; E598-W632 HydrophobicContact CG-CZ3 4.26Å; E598-K635 VanDerWaalsContact CD-NZ 3.31Å; E598-K635 IonicContact OE1-NZ 3.67Å; E598-K635 PolarHBondContact OE1-NZ 3.23Å; E598-K635 IonicContact OE2-NZ 3.74Å
599	D	68.4	Low	66.5	Low	118 Å²	118	85.6 Å²	85.6	63%	0.631	43%	0.433	S	S	*	.	H	α-helix	trans	-63.9	-40.4	-180	-62.6	-31.7	0	0	0	112.2	F597 Q603	F597-D599 PolarHBondContact O-N 3Å; D599-Q603 WeakPolarHBondContact O-CB 3.48Å; D599-Q603 PolarHBondContact O-N 3.42Å
600	K	72.8	Confident	67.9	Low	132 Å²	132	85 Å²	85	57%	0.574	43%	0.429	S	S	*	.	H	α-helix	trans	-69.3	-42.9	179.6	-73.3	-174.3	179.4	-179.8	0	111.7	F597 E598 Q603 S604	F597-K600 PolarHBondContact O-N 3.12Å; E598-K600 PolarHBondContact O-N 3.5Å; K600-Q603 PolarHBondContact O-N 3.44Å; K600-S604 WeakPolarHBondContact O-CB 3.22Å; K600-S604 PolarHBondContact O-N 2.9Å; K600-S604 PolarHBondContact O-OG 3.02Å; K600-S604 VanDerWaalsContact O-OG 3.1Å
601	L	77.4	Confident	69.8	Low	7 Å²	7	80.6 Å²	80.6	4%	0.037	41%	0.408	C	S	.	.	H	α-helix	trans	-64.8	-49.1	-179.9	-172.3	72	0	0	0	111	F559 F586 D588 F597 E598 Q603 S604 V605 W632 E636	F559-L601 HydrophobicContact CE2-CD1 4.04Å; F559-L601 HydrophobicContact CZ-CD1 3.84Å; F559-L601 HydrophobicContact CZ-CG 4.49Å; F586-L601 HydrophobicContact CE1-CD1 4.37Å; D588-L601 HydrophobicContact CB-CD1 4.29Å; F597-L601 HydrophobicContact CE1-CB 4.41Å; F597-L601 HydrophobicContact CE1-CD2 3.85Å; F597-L601 HydrophobicContact CZ-CD1 4.31Å; F597-L601 HydrophobicContact CZ-CD2 4.19Å; F597-L601 WeakPolarHBondContact O-CB 3.41Å; F597-L601 PolarHBondContact O-N 3.02Å; E598-L601 PolarHBondContact O-N 3.33Å; L601-Q603 VanDerWaalsContact C-N 3.32Å; L601-Q603 PolarHBondContact O-N 2.75Å; L601-S604 WeakPolarHBondContact O-CB 3.37Å; L601-S604 PolarHBondContact O-N 3.35Å; L601-S604 VanDerWaalsContact O-N 3.16Å; L601-V605 WeakPolarHBondContact O-CG2 3.47Å; L601-V605 PolarHBondContact O-N 2.95Å; L601-W632 HydrophobicContact CD2-CE3 3.64Å; L601-W632 HydrophobicContact CD2-CZ3 4.03Å; L601-E636 HydrophobicContact CD2-CG 4.23Å
602	I	81.5	Confident	72	Confident	44 Å²	44	73.8 Å²	73.8	23%	0.226	38%	0.379	C	S	.	.	H	α-helix	trans	-61.4	-43.3	177.3	-67.4	172	0	0	0	110.2	E598 S604 V605 Q606 T639	E598-I602 HydrophobicContact CG-CD1 3.69Å; E598-I602 WeakPolarHBondContact O-CB 3.36Å; E598-I602 VanDerWaalsContact O-CG1 3.28Å; E598-I602 WeakPolarHBondContact O-CG1 3.38Å; E598-I602 PolarHBondContact O-N 3.09Å; I602-S604 VanDerWaalsContact C-N 3.31Å; I602-S604 PolarHBondContact O-N 3.16Å; I602-V605 PolarHBondContact O-N 2.98Å; I602-Q606 HydrophobicContact CG2-CG 4.39Å; I602-Q606 WeakPolarHBondContact O-CB 3.5Å; I602-Q606 VanDerWaalsContact O-CG 3.32Å; I602-Q606 WeakPolarHBondContact O-CG 3.43Å; I602-Q606 PolarHBondContact O-N 3.15Å; I602-T639 HydrophobicContact CG2-CG2 4Å
603	Q	82.7	Confident	74.6	Confident	82 Å²	82	69.4 Å²	69.4	38%	0.383	36%	0.356	S	S	.	.	H	α-helix	trans	-63.2	-36.8	176.7	-172.8	175.5	62.8	0	0	112	D599 K600 L601 Q606 R607	D599-Q603 WeakPolarHBondContact O-CB 3.48Å; D599-Q603 PolarHBondContact O-N 3.42Å; K600-Q603 PolarHBondContact O-N 3.44Å; L601-Q603 VanDerWaalsContact C-N 3.32Å; L601-Q603 PolarHBondContact O-N 2.75Å; Q603-Q606 PolarHBondContact O-N 3.21Å; Q603-R607 VanDerWaalsContact CD-NH1 3.32Å; Q603-R607 VanDerWaalsContact CD-NH2 3.26Å; Q603-R607 HydrophobicContact CG-CG 4.45Å; Q603-R607 VanDerWaalsContact NE2-NH2 3.16Å; Q603-R607 VanDerWaalsContact O-CB 3.3Å; Q603-R607 WeakPolarHBondContact O-CB 3.49Å; Q603-R607 VanDerWaalsContact O-CG 3.25Å; Q603-R607 WeakPolarHBondContact O-CG 3.47Å; Q603-R607 PolarHBondContact O-N 3.2Å; Q603-R607 VanDerWaalsContact OE1-NH1 3.08Å
604	S	83.9	Confident	77.4	Confident	22 Å²	22	60.8 Å²	60.8	15%	0.154	32%	0.316	C	S	.	.	H	α-helix	trans	-64.2	-44	173.8	-70.9	0	0	0	0	112	K600 L601 I602 R607 A608	K600-S604 WeakPolarHBondContact O-CB 3.22Å; K600-S604 PolarHBondContact O-N 2.9Å; K600-S604 PolarHBondContact O-OG 3.02Å; K600-S604 VanDerWaalsContact O-OG 3.1Å; L601-S604 WeakPolarHBondContact O-CB 3.37Å; L601-S604 PolarHBondContact O-N 3.35Å; L601-S604 VanDerWaalsContact O-N 3.16Å; I602-S604 VanDerWaalsContact C-N 3.31Å; I602-S604 PolarHBondContact O-N 3.16Å; S604-R607 PolarHBondContact O-N 3.45Å; S604-A608 WeakPolarHBondContact O-CB 3.25Å; S604-A608 PolarHBondContact O-N 3.19Å
605	V	86.6	Confident	80.2	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-62	-44.3	174.5	177.6	0	0	0	0	110.9	F559 L601 I602 R607 A608 F611 E636 T639 A640 K645	F559-V605 HydrophobicContact CD1-CG2 3.95Å; F559-V605 HydrophobicContact CD2-CG2 3.81Å; F559-V605 HydrophobicContact CE1-CG2 3.69Å; F559-V605 HydrophobicContact CE2-CG2 3.52Å; F559-V605 HydrophobicContact CG-CG2 4.01Å; F559-V605 HydrophobicContact CZ-CG2 3.47Å; F559-V605 VanDerWaalsContact CZ-CG2 3.47Å; L601-V605 WeakPolarHBondContact O-CG2 3.47Å; L601-V605 PolarHBondContact O-N 2.95Å; I602-V605 PolarHBondContact O-N 2.98Å; V605-R607 VanDerWaalsContact C-N 3.32Å; V605-R607 PolarHBondContact O-N 3.31Å; V605-A608 PolarHBondContact O-N 3.42Å; V605-F611 HydrophobicContact CG1-CD2 4.09Å; V605-F611 HydrophobicContact CG1-CE2 4.14Å; V605-F611 HydrophobicContact CG2-CE2 4.39Å; V605-E636 HydrophobicContact CG2-CG 4.4Å; V605-T639 HydrophobicContact CB-CG2 4.08Å; V605-T639 HydrophobicContact CG1-CG2 3.77Å; V605-A640 HydrophobicContact CG1-CB 4.19Å; V605-K645 VanDerWaalsContact O-CE 3.3Å; V605-K645 WeakPolarHBondContact O-CE 3.25Å
606	Q	86.6	Confident	82.4	Confident	113 Å²	113	51.9 Å²	51.9	53%	0.528	24%	0.235	S	C	.	.	H	α-helix	trans	-65.7	-33.4	178.7	-73.8	177.7	-3.2	0	0	113	I602 Q603 T639 K645	I602-Q606 HydrophobicContact CG2-CG 4.39Å; I602-Q606 WeakPolarHBondContact O-CB 3.5Å; I602-Q606 VanDerWaalsContact O-CG 3.32Å; I602-Q606 WeakPolarHBondContact O-CG 3.43Å; I602-Q606 PolarHBondContact O-N 3.15Å; Q603-Q606 PolarHBondContact O-N 3.21Å; Q606-T639 HydrophobicContact CG-CG2 4.02Å; Q606-K645 WeakPolarHBondContact O-CE 3.26Å; Q606-K645 PolarHBondContact O-NZ 2.98Å
607	R	87.1	Confident	84.1	Confident	92 Å²	92	45.8 Å²	45.8	35%	0.347	22%	0.215	S	C	.	.	H	α-helix	trans	-79.3	-25.2	176.8	-76.4	177.6	175.2	150.6	0.7	113	Q552 Q603 S604 V605	Q552-R607 VanDerWaalsContact CD-NH2 3.34Å; Q603-R607 VanDerWaalsContact CD-NH1 3.32Å; Q603-R607 VanDerWaalsContact CD-NH2 3.26Å; Q603-R607 HydrophobicContact CG-CG 4.45Å; Q603-R607 VanDerWaalsContact NE2-NH2 3.16Å; Q603-R607 VanDerWaalsContact O-CB 3.3Å; Q603-R607 WeakPolarHBondContact O-CB 3.49Å; Q603-R607 VanDerWaalsContact O-CG 3.25Å; Q603-R607 WeakPolarHBondContact O-CG 3.47Å; Q603-R607 PolarHBondContact O-N 3.2Å; Q603-R607 VanDerWaalsContact OE1-NH1 3.08Å; S604-R607 PolarHBondContact O-N 3.45Å; V605-R607 VanDerWaalsContact C-N 3.32Å; V605-R607 PolarHBondContact O-N 3.31Å
608	A	89.8	Confident	85.6	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.008	23%	0.233	C	C	.	.			trans	-65.3	142.1	-177.9	0	0	0	0	0	112.4	P556 F559 S604 V605 K645	P556-A608 HydrophobicContact CG-CB 4.19Å; P556-A608 VanDerWaalsContact O-CA 3.26Å; P556-A608 WeakPolarHBondContact O-CA 3.47Å; F559-A608 HydrophobicContact CB-CB 3.66Å; S604-A608 WeakPolarHBondContact O-CB 3.25Å; S604-A608 PolarHBondContact O-N 3.19Å; V605-A608 PolarHBondContact O-N 3.42Å; A608-K645 WeakPolarHBondContact O-CD 3.4Å; A608-K645 VanDerWaalsContact O-CE 3.3Å; A608-K645 WeakPolarHBondContact O-CE 3.4Å; A608-K645 PolarHBondContact O-NZ 3.22Å
609	R	90.1	Very high	86.9	Confident	171 Å²	171	45 Å²	45	65%	0.645	22%	0.216	S	C	*	.	S	Bend	trans	-76.7	-45.6	174.8	-66	176.2	173.8	163.9	-10	111.4	P556 D557	P556-R609 PolarHBondContact O-N 3.15Å; D557-R609 IonicContact OD1-CZ 3.79Å; D557-R609 IonicContact OD1-NE 3.66Å; D557-R609 IonicContact OD1-NH1 2.93Å; D557-R609 PolarHBondContact OD1-NH1 3.14Å
610	N	93.5	Very high	87.9	Confident	15 Å²	15	39.5 Å²	39.5	8%	0.08	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	153.3	-178.9	-54.8	-79.1	0	0	0	111.2	D557 V558 F559 N646 L693	D557-N610 WeakPolarHBondContact O-CB 3.33Å; D557-N610 PolarHBondContact O-N 3.47Å; D557-N610 PolarHBondContact O-ND2 3.41Å; V558-N610 HydrophobicContact CG2-CB 4.35Å; F559-N610 PolarHBondContact N-O 3.04Å; N610-N646 WeakPolarHBondContact OD1-CB 3.36Å; N610-N646 PolarHBondContact OD1-ND2 3.25Å; N610-L693 HydrophobicContact CB-CD2 3.48Å; N610-L693 VanDerWaalsContact CB-CD2 3.48Å; N610-L693 PolarHBondContact OD1-O 3.11Å; N610-L693 VanDerWaalsContact OD1-O 3.13Å
611	F	94.6	Very high	88.7	Confident	1 Å²	1	36.6 Å²	36.6	0%	0.004	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	112	178.8	-174.9	-89.6	0	0	0	109.3	F559 V605 L613 E636 I637 A640 K645 N646 I647 V648	F559-F611 HydrophobicContact CB-CD2 4.28Å; F559-F611 AromaticContact CD1-CD2 3.63Å; F559-F611 HydrophobicContact CD1-CD2 3.63Å; F559-F611 AromaticContact CD1-CE2 3.46Å; F559-F611 HydrophobicContact CD1-CE2 3.46Å; F559-F611 VanDerWaalsContact CD1-CE2 3.46Å; F559-F611 HydrophobicContact CD1-CZ 4.47Å; F559-F611 HydrophobicContact CE1-CD2 4.42Å; F559-F611 AromaticContact CE1-CE2 3.8Å; F559-F611 HydrophobicContact CE1-CE2 3.8Å; F559-F611 HydrophobicContact CG-CD2 4.29Å; F559-F611 HydrophobicContact CG-CE2 4.46Å; V605-F611 HydrophobicContact CG1-CD2 4.09Å; V605-F611 HydrophobicContact CG1-CE2 4.14Å; V605-F611 HydrophobicContact CG2-CE2 4.39Å; F611-L613 HydrophobicContact CD1-CB 4.48Å; F611-L613 HydrophobicContact CE1-CB 4.05Å; F611-L613 HydrophobicContact CE1-CD1 4.37Å; F611-E636 HydrophobicContact CE2-CB 4.15Å; F611-E636 HydrophobicContact CZ-CB 4.04Å; F611-I637 HydrophobicContact CE1-CG1 4.44Å; F611-I637 HydrophobicContact CZ-CG1 4.49Å; F611-A640 HydrophobicContact CB-CB 4.22Å; F611-A640 HydrophobicContact CD1-CB 3.93Å; F611-A640 HydrophobicContact CD2-CB 3.66Å; F611-A640 HydrophobicContact CE1-CB 4.15Å; F611-A640 HydrophobicContact CE2-CB 3.89Å; F611-A640 HydrophobicContact CG-CB 3.67Å; F611-A640 HydrophobicContact CZ-CB 4.12Å; F611-K645 HydrophobicContact CB-CB 4.14Å; F611-N646 PolarHBondContact N-O 3.38Å; F611-I647 HydrophobicContact CB-CG1 4.2Å; F611-I647 HydrophobicContact CD1-CG1 4.08Å; F611-I647 HydrophobicContact CD1-CG2 4.07Å; F611-I647 HydrophobicContact CG-CG1 4.47Å; F611-I647 CarbonylContact O-C 3.48Å; F611-I647 VanDerWaalsContact O-CA 3.29Å; F611-I647 WeakPolarHBondContact O-CA 3.5Å; F611-V648 PolarHBondContact O-N 3.45Å
612	I	95.7	Very high	89.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.6	173.8	-64.8	179.6	0	0	0	108.3	V558 F559 I560 S561 L574 L578 V648 V650 I689 L693	V558-I612 HydrophobicContact CG1-CB 4.35Å; V558-I612 HydrophobicContact CG1-CD1 3.55Å; V558-I612 HydrophobicContact CG1-CG1 3.73Å; F559-I612 PolarHBondContact O-N 3.3Å; I560-I612 WeakPolarHBondContact CA-O 3.5Å; I560-I612 HydrophobicContact CG1-CB 4.29Å; S561-I612 PolarHBondContact N-O 2.82Å; L574-I612 HydrophobicContact CD1-CG2 4.11Å; L578-I612 HydrophobicContact CD1-CD1 3.67Å; I612-V648 WeakPolarHBondContact CA-O 3.34Å; I612-V648 HydrophobicContact CG1-CB 4.45Å; I612-V650 HydrophobicContact CG2-CG2 3.88Å; I612-I689 HydrophobicContact CD1-CG2 4.01Å; I612-L693 HydrophobicContact CD1-CD1 4.38Å; I612-L693 HydrophobicContact CD1-CD2 4.19Å; I612-L693 HydrophobicContact CG1-CD2 4.14Å
613	L	94.8	Very high	89.5	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	111.7	175.4	-178.9	63.8	0	0	0	109.8	F611 M615 V633 I637 V648 P649 V650 I669	F611-L613 HydrophobicContact CD1-CB 4.48Å; F611-L613 HydrophobicContact CE1-CB 4.05Å; F611-L613 HydrophobicContact CE1-CD1 4.37Å; L613-M615 HydrophobicContact CD2-CG 4.1Å; L613-M615 HydrophobicContact CD2-SD 4.19Å; L613-M615 HydrophobicContact CG-CG 3.98Å; L613-M615 PolarHBondContact O-N 3.25Å; L613-V633 HydrophobicContact CD1-CG1 4.17Å; L613-I637 HydrophobicContact CD1-CD1 4.01Å; L613-I637 HydrophobicContact CD1-CG1 4.09Å; L613-I637 HydrophobicContact CD2-CD1 3.81Å; L613-I637 HydrophobicContact CD2-CG1 4.11Å; L613-V648 PolarHBondContact N-O 3.26Å; L613-V648 VanDerWaalsContact N-O 3.11Å; L613-P649 CarbonylContact O-C 3.31Å; L613-P649 WeakPolarHBondContact O-CA 3.49Å; L613-V650 PolarHBondContact O-N 2.98Å; L613-I669 HydrophobicContact CD2-CD1 3.82Å; L613-I669 HydrophobicContact CD2-CG1 3.65Å
614	V	94.5	Very high	89.8	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	109.2	174.4	-180	0	0	0	0	109.2	I560 S561 L570 A571 L574 S616	I560-V614 HydrophobicContact CG2-CG2 3.79Å; S561-V614 PolarHBondContact O-N 3.2Å; L570-V614 HydrophobicContact CB-CG1 4.11Å; L570-V614 HydrophobicContact CD2-CG1 3.82Å; L570-V614 HydrophobicContact CG-CG1 4.01Å; A571-V614 HydrophobicContact CB-CG2 4.12Å; L574-V614 HydrophobicContact CD1-CG2 3.79Å; V614-S616 PolarHBondContact O-N 3.4Å
615	M	91.4	Very high	89.7	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	82	177	-57.8	-167.7	-59.9	0	0	108.5	L613 P649 V650 T651 D652 F654 W656	L613-M615 HydrophobicContact CD2-CG 4.1Å; L613-M615 HydrophobicContact CD2-SD 4.19Å; L613-M615 HydrophobicContact CG-CG 3.98Å; L613-M615 PolarHBondContact O-N 3.25Å; M615-P649 HydrophobicContact CE-CB 3.24Å; M615-P649 HydrophobicContact CE-CG 4.4Å; M615-P649 HydrophobicContact SD-CB 3.91Å; M615-V650 PolarHBondContact N-O 3.02Å; M615-T651 HydrophobicContact CB-CG2 4.19Å; M615-T651 HydrophobicContact CE-CG2 3.2Å; M615-T651 WeakPolarHBondContact O-CA 3.4Å; M615-D652 PolarHBondContact O-N 3.25Å; M615-F654 HydrophobicContact CB-CB 4.17Å; M615-F654 HydrophobicContact CB-CD1 3.78Å; M615-F654 HydrophobicContact CB-CD2 4.21Å; M615-F654 HydrophobicContact CB-CE1 4.15Å; M615-F654 HydrophobicContact CB-CG 3.8Å; M615-F654 HydrophobicContact CE-CD1 4.31Å; M615-F654 HydrophobicContact CE-CE1 4.35Å; M615-F654 WeakPolarHBondContact O-CB 3.26Å; M615-F654 HydrophobicContact SD-CD1 4.26Å; M615-F654 HydrophobicContact SD-CE1 3.86Å; M615-F654 HydrophobicContact SD-CZ 4.41Å; M615-W656 HydrophobicContact CE-CH2 3.21Å; M615-W656 HydrophobicContact CE-CZ2 3.51Å; M615-W656 HydrophobicContact CE-CZ3 3.83Å; M615-W656 HydrophobicContact SD-CH2 3.83Å; M615-W656 HydrophobicContact SD-CZ3 3.84Å
616	S	89.8	Confident	89.8	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.014	22%	0.217	C	C	.	.			trans	-82.1	171.5	169.7	53.4	0	0	0	0	111.1	T566 G567 V614 N618 A619 D652 F654	T566-S616 WeakPolarHBondContact O-CB 3.37Å; T566-S616 PolarHBondContact OG1-OG 3.02Å; G567-S616 WeakPolarHBondContact CA-OG 3.43Å; G567-S616 PolarHBondContact N-OG 3.29Å; V614-S616 PolarHBondContact O-N 3.4Å; S616-N618 PolarHBondContact O-N 2.86Å; S616-A619 WeakPolarHBondContact O-CB 3.39Å; S616-A619 PolarHBondContact O-N 3.2Å; S616-D652 CarbonylContact C-O 3.58Å; S616-D652 WeakPolarHBondContact CA-O 3.48Å; S616-F654 WeakPolarHBondContact O-CD2 3.44Å
617	A	87.5	Confident	89.7	Confident	37 Å²	37	43.8 Å²	43.8	31%	0.306	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.1	130.2	171.3	0	0	0	0	0	111.3	T566 A619 D652	T566-A617 WeakPolarHBondContact CB-O 3.21Å; T566-A617 WeakPolarHBondContact CG2-O 3.46Å; T566-A617 PolarHBondContact OG1-O 3.06Å; A617-A619 PolarHBondContact O-N 2.8Å; A617-A619 VanDerWaalsContact O-N 3.16Å; A617-D652 PolarHBondContact N-O 3.5Å
618	N	88	Confident	89.5	Confident	101 Å²	101	42.5 Å²	42.5	54%	0.54	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	22.2	178.1	-56.7	53	0	0	0	114.3	S616 L620 D621	S616-N618 PolarHBondContact O-N 2.86Å; N618-L620 VanDerWaalsContact C-N 3.28Å; N618-L620 PolarHBondContact O-N 2.89Å; N618-D621 WeakPolarHBondContact CA-OD1 3.49Å; N618-D621 HydrophobicContact CB-CB 4.43Å; N618-D621 VanDerWaalsContact CB-OD2 3.26Å; N618-D621 WeakPolarHBondContact CB-OD2 3.49Å; N618-D621 VanDerWaalsContact CG-OD2 3.3Å; N618-D621 PolarHBondContact ND2-OD2 3.22Å; N618-D621 PolarHBondContact O-N 3.19Å
619	A	88	Confident	89.2	Confident	4 Å²	4	45.3 Å²	45.3	3%	0.033	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-33.6	-176.1	0	0	0	0	0	113.6	R563 S616 A617 F654	R563-A619 HydrophobicContact CB-CB 4.22Å; R563-A619 PolarHBondContact NE-O 3.25Å; R563-A619 PolarHBondContact NH2-O 3.15Å; S616-A619 WeakPolarHBondContact O-CB 3.39Å; S616-A619 PolarHBondContact O-N 3.2Å; A617-A619 PolarHBondContact O-N 2.8Å; A617-A619 VanDerWaalsContact O-N 3.16Å; A619-F654 HydrophobicContact CB-CD2 4.39Å; A619-F654 HydrophobicContact CB-CE2 4.29Å
620	L	90.3	Very high	89	Confident	1 Å²	1	45 Å²	45	1%	0.005	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-1.6	-177.2	-60.8	-173.3	0	0	0	114.3	N618 K622 C623 M624 I637 F654 P657 L662 M666	N618-L620 VanDerWaalsContact C-N 3.28Å; N618-L620 PolarHBondContact O-N 2.89Å; L620-K622 VanDerWaalsContact C-N 3.29Å; L620-K622 PolarHBondContact O-N 2.91Å; L620-C623 WeakPolarHBondContact O-CA 3.43Å; L620-C623 WeakPolarHBondContact O-CB 3.35Å; L620-C623 PolarHBondContact O-N 3.24Å; L620-M624 PolarHBondContact O-N 3.42Å; L620-I637 HydrophobicContact CD2-CD1 4.06Å; L620-F654 HydrophobicContact CD1-CZ 3.82Å; L620-F654 HydrophobicContact CG-CE2 4.19Å; L620-F654 HydrophobicContact CG-CZ 3.94Å; L620-P657 HydrophobicContact CD1-CG 4.15Å; L620-L662 HydrophobicContact CB-CD2 4.45Å; L620-L662 HydrophobicContact CD1-CD1 4.22Å; L620-M666 HydrophobicContact CD2-CE 4.12Å
621	D	89.6	Confident	88.6	Confident	72 Å²	72	45.4 Å²	45.4	39%	0.385	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-56	-41.9	-174.4	-70.9	20.2	0	0	0	112.8	N618 C623 M624	N618-D621 WeakPolarHBondContact CA-OD1 3.49Å; N618-D621 HydrophobicContact CB-CB 4.43Å; N618-D621 VanDerWaalsContact CB-OD2 3.26Å; N618-D621 WeakPolarHBondContact CB-OD2 3.49Å; N618-D621 VanDerWaalsContact CG-OD2 3.3Å; N618-D621 PolarHBondContact ND2-OD2 3.22Å; N618-D621 PolarHBondContact O-N 3.19Å; D621-C623 VanDerWaalsContact C-N 3.26Å; D621-C623 PolarHBondContact O-N 2.97Å; D621-M624 WeakPolarHBondContact O-CB 3.38Å; D621-M624 PolarHBondContact O-N 2.78Å
622	K	87.8	Confident	88.2	Confident	138 Å²	138	49.3 Å²	49.3	60%	0.6	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-74.1	-15.7	177.8	-66.1	-173.7	179.5	-178.1	0	114	L620	L620-K622 VanDerWaalsContact C-N 3.29Å; L620-K622 PolarHBondContact O-N 2.91Å
623	C	87.9	Confident	87.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-85.7	-18.9	175.2	-51.2	0	0	0	0	111.6	R563 L620 D621 G625 D626 D631 H634 L662 P663 M666	R563-C623 PolarHBondContact NH2-SG 3.23Å; L620-C623 WeakPolarHBondContact O-CA 3.43Å; L620-C623 WeakPolarHBondContact O-CB 3.35Å; L620-C623 PolarHBondContact O-N 3.24Å; D621-C623 VanDerWaalsContact C-N 3.26Å; D621-C623 PolarHBondContact O-N 2.97Å; C623-G625 PolarHBondContact O-N 3.44Å; C623-D626 WeakPolarHBondContact O-CB 3.47Å; C623-D626 PolarHBondContact O-N 2.67Å; C623-D631 PolarHBondContact SG-OD1 3.05Å; C623-H634 HydrophobicContact CB-CB 4.28Å; C623-L662 HydrophobicContact CB-CD2 4.47Å; C623-P663 VanDerWaalsContact O-CD 3.23Å; C623-P663 WeakPolarHBondContact O-CD 3.34Å; C623-M666 HydrophobicContact CB-CE 3.77Å; C623-M666 HydrophobicContact CB-SD 3.67Å
624	M	87.6	Confident	87.7	Confident	73 Å²	73	49.6 Å²	49.6	36%	0.36	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	124	179.6	-58.9	-171.9	-164.9	0	0	110.1	L620 D621 D626 P657 S661 L662	L620-M624 PolarHBondContact O-N 3.42Å; D621-M624 WeakPolarHBondContact O-CB 3.38Å; D621-M624 PolarHBondContact O-N 2.78Å; M624-D626 PolarHBondContact O-N 3.06Å; M624-P657 HydrophobicContact CE-CB 3.47Å; M624-P657 VanDerWaalsContact CE-CB 3.47Å; M624-P657 HydrophobicContact CE-CG 4.25Å; M624-S661 CarbonylContact C-O 3.55Å; M624-S661 WeakPolarHBondContact CA-O 3.46Å; M624-L662 HydrophobicContact CG-CD2 4.18Å
625	G	83.6	Confident	87.4	Confident	57 Å²	57	51 Å²	51	59%	0.588	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	8.4	-176.8	0	0	0	0	0	116	C623 T627 S661	C623-G625 PolarHBondContact O-N 3.44Å; G625-T627 PolarHBondContact O-N 2.92Å; G625-S661 PolarHBondContact N-O 3.34Å
626	D	88.8	Confident	87.4	Confident	20 Å²	20	51.5 Å²	51.5	11%	0.107	28%	0.284	C	S	.	.			trans	-78.6	63.6	-179.3	-177	36.7	0	0	0	112.9	C623 M624 A628 M629 K630 D631 H634	C623-D626 WeakPolarHBondContact O-CB 3.47Å; C623-D626 PolarHBondContact O-N 2.67Å; M624-D626 PolarHBondContact O-N 3.06Å; D626-A628 PolarHBondContact O-N 3.44Å; D626-M629 PolarHBondContact O-N 3.49Å; D626-M629 PolarHBondContact OD1-N 3.08Å; D626-M629 WeakPolarHBondContact OD2-CA 2.99Å; D626-K630 VanDerWaalsContact CG-N 3.34Å; D626-K630 PolarHBondContact OD1-N 3.28Å; D626-K630 PolarHBondContact OD2-N 3.07Å; D626-D631 PolarHBondContact OD2-N 3.19Å; D626-H634 PolarHBondContact O-CE1 3.04Å; D626-H634 PolarHBondContact O-ND1 3.48Å; D626-H634 VanDerWaalsContact O-ND1 3.15Å; D626-H634 IonicContact OD2-CG 3.7Å; D626-H634 IonicContact OD2-ND1 3.89Å; D626-H634 PolarHBondContact OD2-ND1 3.05Å
627	T	84.5	Confident	87.5	Confident	131 Å²	131	51.4 Å²	51.4	80%	0.804	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-20.3	178.6	51.2	0	0	0	0	113.8	G625 M629	G625-T627 PolarHBondContact O-N 2.92Å; T627-M629 VanDerWaalsContact C-N 3.29Å
628	A	81.8	Confident	87.7	Confident	66 Å²	66	50.2 Å²	50.2	55%	0.545	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	2.1	177.6	0	0	0	0	0	113.2	D626 K630	D626-A628 PolarHBondContact O-N 3.44Å; A628-K630 VanDerWaalsContact C-N 3.28Å; A628-K630 HydrophobicContact CB-CD 4.35Å; A628-K630 HydrophobicContact CB-CG 4.06Å; A628-K630 PolarHBondContact O-N 2.8Å
629	M	84	Confident	87.9	Confident	60 Å²	60	46.3 Å²	46.3	30%	0.296	25%	0.253	S	S	.	.			trans	52.8	43.7	177.9	-152.8	-166.7	-161.8	0	0	112.4	D626 T627 K635 A638	D626-M629 PolarHBondContact O-N 3.49Å; D626-M629 PolarHBondContact OD1-N 3.08Å; D626-M629 WeakPolarHBondContact OD2-CA 2.99Å; T627-M629 VanDerWaalsContact C-N 3.29Å; M629-K635 HydrophobicContact CE-CB 4.31Å; M629-K635 HydrophobicContact CE-CG 4.18Å; M629-K635 HydrophobicContact CG-CG 3.68Å; M629-K635 WeakPolarHBondContact O-CE 3.45Å; M629-K635 HydrophobicContact SD-CG 3.99Å; M629-A638 HydrophobicContact CE-CB 3.28Å
630	K	84.6	Confident	88	Confident	165 Å²	165	46.1 Å²	46.1	72%	0.717	25%	0.252	S	S	*	.			trans	-83.3	-28	-178.5	-70.1	-178.6	179.6	177.7	0	112.3	D626 A628	D626-K630 VanDerWaalsContact CG-N 3.34Å; D626-K630 PolarHBondContact OD1-N 3.28Å; D626-K630 PolarHBondContact OD2-N 3.07Å; A628-K630 VanDerWaalsContact C-N 3.28Å; A628-K630 HydrophobicContact CB-CD 4.35Å; A628-K630 HydrophobicContact CB-CG 4.06Å; A628-K630 PolarHBondContact O-N 2.8Å
631	D	86.1	Confident	88.1	Confident	22 Å²	22	47.8 Å²	47.8	12%	0.118	26%	0.26	C	S	.	.	S	Bend	trans	-77.5	134.5	-178.4	-172	-105.1	0	0	0	111.4	R563 C623 D626 V633 H634 K635	R563-D631 IonicContact CZ-OD1 3.23Å; R563-D631 IonicContact CZ-OD2 2.69Å; R563-D631 VanDerWaalsContact NH1-CG 3.3Å; R563-D631 IonicContact NH1-OD1 3.88Å; R563-D631 PolarHBondContact NH1-OD1 3.02Å; R563-D631 IonicContact NH1-OD2 2.89Å; R563-D631 PolarHBondContact NH1-OD2 3Å; R563-D631 IonicContact NH2-OD1 3.28Å; R563-D631 PolarHBondContact NH2-OD1 3.05Å; R563-D631 IonicContact NH2-OD2 2.55Å; C623-D631 PolarHBondContact SG-OD1 3.05Å; D626-D631 PolarHBondContact OD2-N 3.19Å; D631-V633 PolarHBondContact O-N 2.89Å; D631-V633 WeakPolarHBondContact OD1-CB 3.35Å; D631-V633 PolarHBondContact OD1-N 3Å; D631-V633 VanDerWaalsContact OD1-N 3.15Å; D631-H634 HydrophobicContact CB-CB 3.97Å; D631-H634 WeakPolarHBondContact O-CB 3.16Å; D631-H634 PolarHBondContact O-N 2.77Å; D631-H634 PolarHBondContact OD1-N 3.33Å; D631-K635 PolarHBondContact O-N 3.46Å
632	W	85.9	Confident	88.2	Confident	83 Å²	83	49.4 Å²	49.4	31%	0.314	28%	0.277	S	S	.	.	H	α-helix	trans	-65.4	-39.9	-178.3	-68.8	104	0	0	0	112.8	F597 E598 L601 H634 K635 E636	F597-W632 AromaticContact CD1-CH2 3.61Å; F597-W632 HydrophobicContact CD1-CH2 3.61Å; F597-W632 AromaticContact CD1-CZ2 4Å; F597-W632 HydrophobicContact CD1-CZ2 4Å; F597-W632 AromaticContact CD1-CZ3 3.89Å; F597-W632 HydrophobicContact CD1-CZ3 3.89Å; F597-W632 HydrophobicContact CE1-CD2 4.36Å; F597-W632 HydrophobicContact CE1-CE3 4.13Å; F597-W632 AromaticContact CE1-CH2 4Å; F597-W632 HydrophobicContact CE1-CH2 4Å; F597-W632 HydrophobicContact CE1-CZ2 4.21Å; F597-W632 AromaticContact CE1-CZ3 3.94Å; F597-W632 HydrophobicContact CE1-CZ3 3.94Å; E598-W632 HydrophobicContact CB-CH2 4.14Å; E598-W632 HydrophobicContact CB-CZ3 4.24Å; E598-W632 HydrophobicContact CG-CH2 4.47Å; E598-W632 HydrophobicContact CG-CZ3 4.26Å; L601-W632 HydrophobicContact CD2-CE3 3.64Å; L601-W632 HydrophobicContact CD2-CZ3 4.03Å; W632-H634 VanDerWaalsContact C-N 3.28Å; W632-H634 PolarHBondContact O-N 3.23Å; W632-K635 HydrophobicContact CE3-CD 4.21Å; W632-K635 HydrophobicContact CZ3-CD 4.3Å; W632-K635 WeakPolarHBondContact O-CB 3.48Å; W632-K635 PolarHBondContact O-N 2.83Å; W632-E636 VanDerWaalsContact O-CG 3.27Å; W632-E636 WeakPolarHBondContact O-CG 3.44Å; W632-E636 PolarHBondContact O-N 3.14Å
633	V	89.3	Confident	88.2	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-66.8	-37	178.7	177.1	0	0	0	0	109.7	R563 L613 D631 E636 I637	R563-V633 VanDerWaalsContact CZ-CG2 3.49Å; L613-V633 HydrophobicContact CD1-CG1 4.17Å; D631-V633 PolarHBondContact O-N 2.89Å; D631-V633 WeakPolarHBondContact OD1-CB 3.35Å; D631-V633 PolarHBondContact OD1-N 3Å; D631-V633 VanDerWaalsContact OD1-N 3.15Å; V633-E636 PolarHBondContact O-N 3.24Å; V633-I637 HydrophobicContact CG1-CD1 3.76Å; V633-I637 HydrophobicContact CG1-CG1 4.38Å; V633-I637 WeakPolarHBondContact O-CB 3.33Å; V633-I637 WeakPolarHBondContact O-CD1 3.21Å; V633-I637 WeakPolarHBondContact O-CG1 3.41Å; V633-I637 PolarHBondContact O-N 3.03Å
634	H	90.6	Very high	88.3	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-60.2	-49.8	171.5	-178.1	-164.6	0	0	0	111.4	C623 D626 D631 W632 E636 I637 A638 D665 M666	C623-H634 HydrophobicContact CB-CB 4.28Å; D626-H634 PolarHBondContact O-CE1 3.04Å; D626-H634 PolarHBondContact O-ND1 3.48Å; D626-H634 VanDerWaalsContact O-ND1 3.15Å; D626-H634 IonicContact OD2-CG 3.7Å; D626-H634 IonicContact OD2-ND1 3.89Å; D626-H634 PolarHBondContact OD2-ND1 3.05Å; D631-H634 HydrophobicContact CB-CB 3.97Å; D631-H634 WeakPolarHBondContact O-CB 3.16Å; D631-H634 PolarHBondContact O-N 2.77Å; D631-H634 PolarHBondContact OD1-N 3.33Å; W632-H634 VanDerWaalsContact C-N 3.28Å; W632-H634 PolarHBondContact O-N 3.23Å; H634-E636 VanDerWaalsContact C-N 3.33Å; H634-E636 PolarHBondContact O-N 3.09Å; H634-I637 PolarHBondContact O-N 3.21Å; H634-A638 WeakPolarHBondContact O-CB 3.49Å; H634-A638 PolarHBondContact O-N 3.35Å; H634-D665 IonicContact CE1-OD1 2.68Å; H634-D665 IonicContact CE1-OD2 2.98Å; H634-D665 IonicContact NE2-OD1 2.65Å; H634-D665 PolarHBondContact NE2-OD1 3.45Å; H634-D665 VanDerWaalsContact NE2-OD1 3.15Å; H634-D665 IonicContact NE2-OD2 2.64Å; H634-D665 PolarHBondContact NE2-OD2 3.23Å; H634-M666 HydrophobicContact CB-SD 4.4Å; H634-M666 PolarHBondContact CD2-SD 3.42Å
635	K	88.9	Confident	88.5	Confident	32 Å²	32	52.4 Å²	52.4	14%	0.139	30%	0.3	C	S	.	.	H	α-helix	trans	-55.8	-45.5	176.6	-73.8	-175.3	-177.5	-167.8	0	113.1	E598 M629 D631 W632 T639	E598-K635 VanDerWaalsContact CD-NZ 3.31Å; E598-K635 IonicContact OE1-NZ 3.67Å; E598-K635 PolarHBondContact OE1-NZ 3.23Å; E598-K635 IonicContact OE2-NZ 3.74Å; M629-K635 HydrophobicContact CE-CB 4.31Å; M629-K635 HydrophobicContact CE-CG 4.18Å; M629-K635 HydrophobicContact CG-CG 3.68Å; M629-K635 WeakPolarHBondContact O-CE 3.45Å; M629-K635 HydrophobicContact SD-CG 3.99Å; D631-K635 PolarHBondContact O-N 3.46Å; W632-K635 HydrophobicContact CE3-CD 4.21Å; W632-K635 HydrophobicContact CZ3-CD 4.3Å; W632-K635 WeakPolarHBondContact O-CB 3.48Å; W632-K635 PolarHBondContact O-N 2.83Å; K635-T639 WeakPolarHBondContact O-CB 3.45Å; K635-T639 PolarHBondContact O-N 2.96Å; K635-T639 PolarHBondContact O-OG1 3.23Å
636	E	91.2	Very high	88.9	Confident	10 Å²	10	52.7 Å²	52.7	5%	0.047	29%	0.287	C	S	.	.	H	α-helix	trans	-63.7	-46.1	179.7	-71.3	169.7	163.6	0	0	111.9	F559 S561 L601 V605 F611 W632 V633 H634 T639 A640	F559-E636 HydrophobicContact CE1-CG 4.21Å; F559-E636 HydrophobicContact CZ-CG 4.27Å; S561-E636 VanDerWaalsContact CB-OE2 3.25Å; S561-E636 WeakPolarHBondContact CB-OE2 3.47Å; S561-E636 PolarHBondContact OG-OE2 3.43Å; L601-E636 HydrophobicContact CD2-CG 4.23Å; V605-E636 HydrophobicContact CG2-CG 4.4Å; F611-E636 HydrophobicContact CE2-CB 4.15Å; F611-E636 HydrophobicContact CZ-CB 4.04Å; W632-E636 VanDerWaalsContact O-CG 3.27Å; W632-E636 WeakPolarHBondContact O-CG 3.44Å; W632-E636 PolarHBondContact O-N 3.14Å; V633-E636 PolarHBondContact O-N 3.24Å; H634-E636 VanDerWaalsContact C-N 3.33Å; H634-E636 PolarHBondContact O-N 3.09Å; E636-T639 PolarHBondContact O-N 3.16Å; E636-A640 WeakPolarHBondContact O-CB 3.47Å; E636-A640 PolarHBondContact O-N 3.16Å
637	I	92.4	Very high	89.2	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.5	-49.5	179.1	-69.5	166.7	0	0	0	110.7	F611 L613 L620 V633 H634 T639 A640 L641 M666 I669	F611-I637 HydrophobicContact CE1-CG1 4.44Å; F611-I637 HydrophobicContact CZ-CG1 4.49Å; L613-I637 HydrophobicContact CD1-CD1 4.01Å; L613-I637 HydrophobicContact CD1-CG1 4.09Å; L613-I637 HydrophobicContact CD2-CD1 3.81Å; L613-I637 HydrophobicContact CD2-CG1 4.11Å; L620-I637 HydrophobicContact CD2-CD1 4.06Å; V633-I637 HydrophobicContact CG1-CD1 3.76Å; V633-I637 HydrophobicContact CG1-CG1 4.38Å; V633-I637 WeakPolarHBondContact O-CB 3.33Å; V633-I637 WeakPolarHBondContact O-CD1 3.21Å; V633-I637 WeakPolarHBondContact O-CG1 3.41Å; V633-I637 PolarHBondContact O-N 3.03Å; H634-I637 PolarHBondContact O-N 3.21Å; I637-T639 VanDerWaalsContact C-N 3.28Å; I637-T639 PolarHBondContact O-N 2.83Å; I637-A640 PolarHBondContact O-N 3.17Å; I637-L641 HydrophobicContact CG2-CD1 3.82Å; I637-L641 HydrophobicContact CG2-CG 4.4Å; I637-L641 WeakPolarHBondContact O-CG 3.32Å; I637-L641 PolarHBondContact O-N 3.13Å; I637-M666 HydrophobicContact CD1-CE 3.69Å; I637-M666 HydrophobicContact CG2-CB 3.84Å; I637-I669 HydrophobicContact CG2-CB 4.28Å; I637-I669 HydrophobicContact CG2-CD1 4.42Å; I637-I669 HydrophobicContact CG2-CG1 4.4Å
638	A	91.8	Very high	89.7	Confident	12 Å²	12	45.9 Å²	45.9	10%	0.099	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-39	179.2	0	0	0	0	0	111.7	M629 H634 L641 S642	M629-A638 HydrophobicContact CE-CB 3.28Å; H634-A638 WeakPolarHBondContact O-CB 3.49Å; H634-A638 PolarHBondContact O-N 3.35Å; A638-L641 PolarHBondContact O-N 3.33Å; A638-S642 VanDerWaalsContact O-CB 3.29Å; A638-S642 WeakPolarHBondContact O-CB 3.32Å; A638-S642 PolarHBondContact O-N 3.44Å
639	T	90.4	Very high	90.3	Very high	19 Å²	19	42.7 Å²	42.7	12%	0.117	22%	0.22	C	C	.	.	H	α-helix	trans	-64.6	-43.3	174.9	-57.7	0	0	0	0	111.6	I602 V605 Q606 K635 E636 I637 S642 G643	I602-T639 HydrophobicContact CG2-CG2 4Å; V605-T639 HydrophobicContact CB-CG2 4.08Å; V605-T639 HydrophobicContact CG1-CG2 3.77Å; Q606-T639 HydrophobicContact CG-CG2 4.02Å; K635-T639 WeakPolarHBondContact O-CB 3.45Å; K635-T639 PolarHBondContact O-N 2.96Å; K635-T639 PolarHBondContact O-OG1 3.23Å; E636-T639 PolarHBondContact O-N 3.16Å; I637-T639 VanDerWaalsContact C-N 3.28Å; I637-T639 PolarHBondContact O-N 2.83Å; T639-S642 PolarHBondContact O-N 2.93Å; T639-G643 PolarHBondContact O-N 2.88Å
640	A	91.9	Very high	90.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-39.7	178.2	0	0	0	0	0	112.3	V605 F611 E636 I637 G643 K644 K645 I647	V605-A640 HydrophobicContact CG1-CB 4.19Å; F611-A640 HydrophobicContact CB-CB 4.22Å; F611-A640 HydrophobicContact CD1-CB 3.93Å; F611-A640 HydrophobicContact CD2-CB 3.66Å; F611-A640 HydrophobicContact CE1-CB 4.15Å; F611-A640 HydrophobicContact CE2-CB 3.89Å; F611-A640 HydrophobicContact CG-CB 3.67Å; F611-A640 HydrophobicContact CZ-CB 4.12Å; E636-A640 WeakPolarHBondContact O-CB 3.47Å; E636-A640 PolarHBondContact O-N 3.16Å; I637-A640 PolarHBondContact O-N 3.17Å; A640-G643 CarbonylContact O-C 3.53Å; A640-K644 PolarHBondContact O-N 3.3Å; A640-K645 HydrophobicContact CB-CB 4.31Å; A640-K645 HydrophobicContact CB-CG 4.31Å; A640-K645 WeakPolarHBondContact O-CG 3.23Å; A640-K645 PolarHBondContact O-N 3.19Å; A640-I647 HydrophobicContact CB-CD1 4.05Å; A640-I647 HydrophobicContact CB-CG1 4.24Å
641	L	92.4	Very high	91.1	Very high	35 Å²	35	33 Å²	33	18%	0.183	18%	0.178	C	C	.	.	H	α-helix	trans	-66.7	-47.4	175.7	-72.4	169.4	0	0	0	111.7	I637 A638 G643 K644 I647 D665 A668 F672	I637-L641 HydrophobicContact CG2-CD1 3.82Å; I637-L641 HydrophobicContact CG2-CG 4.4Å; I637-L641 WeakPolarHBondContact O-CG 3.32Å; I637-L641 PolarHBondContact O-N 3.13Å; A638-L641 PolarHBondContact O-N 3.33Å; L641-G643 VanDerWaalsContact C-N 3.3Å; L641-G643 PolarHBondContact O-N 3.09Å; L641-K644 PolarHBondContact O-N 3.42Å; L641-I647 HydrophobicContact CD2-CD1 3.58Å; L641-I647 HydrophobicContact CG-CD1 3.92Å; L641-D665 VanDerWaalsContact CD1-O 3.24Å; L641-D665 WeakPolarHBondContact CD1-O 3.2Å; L641-A668 HydrophobicContact CD1-CB 4.26Å; L641-A668 HydrophobicContact CD2-CB 4.06Å; L641-F672 HydrophobicContact CD2-CE2 3.77Å; L641-F672 HydrophobicContact CD2-CZ 3.99Å
642	S	91.1	Very high	91.3	Very high	106 Å²	106	33.3 Å²	33.3	74%	0.741	18%	0.179	S	C	*	.	H	α-helix	trans	-59.4	-42	175.7	-178	0	0	0	0	111.7	A638 T639 K644	A638-S642 VanDerWaalsContact O-CB 3.29Å; A638-S642 WeakPolarHBondContact O-CB 3.32Å; A638-S642 PolarHBondContact O-N 3.44Å; T639-S642 PolarHBondContact O-N 2.93Å; S642-K644 PolarHBondContact O-N 3.24Å
643	G	87.1	Confident	91.2	Very high	39 Å²	39	35.8 Å²	35.8	40%	0.402	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	3.8	175.7	0	0	0	0	0	115.3	T639 A640 L641 K645	T639-G643 PolarHBondContact O-N 2.88Å; A640-G643 CarbonylContact O-C 3.53Å; L641-G643 VanDerWaalsContact C-N 3.3Å; L641-G643 PolarHBondContact O-N 3.09Å; G643-K645 PolarHBondContact O-N 3.37Å; G643-K645 VanDerWaalsContact O-N 3.17Å
644	K	90.4	Very high	91.1	Very high	192 Å²	192	36.7 Å²	36.7	84%	0.835	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.8	43.4	-177.1	-62.5	-177	-179.3	178.4	0	113.2	A640 L641 S642	A640-K644 PolarHBondContact O-N 3.3Å; L641-K644 PolarHBondContact O-N 3.42Å; S642-K644 PolarHBondContact O-N 3.24Å
645	K	91.6	Very high	90.8	Very high	44 Å²	44	44.4 Å²	44.4	19%	0.191	24%	0.24	C	C	.	.			trans	-69.4	156.2	179.5	-58.8	-56.5	-176.3	174.2	0	111.3	V605 Q606 A608 F611 A640 G643 I647	V605-K645 VanDerWaalsContact O-CE 3.3Å; V605-K645 WeakPolarHBondContact O-CE 3.25Å; Q606-K645 WeakPolarHBondContact O-CE 3.26Å; Q606-K645 PolarHBondContact O-NZ 2.98Å; A608-K645 WeakPolarHBondContact O-CD 3.4Å; A608-K645 VanDerWaalsContact O-CE 3.3Å; A608-K645 WeakPolarHBondContact O-CE 3.4Å; A608-K645 PolarHBondContact O-NZ 3.22Å; F611-K645 HydrophobicContact CB-CB 4.14Å; A640-K645 HydrophobicContact CB-CB 4.31Å; A640-K645 HydrophobicContact CB-CG 4.31Å; A640-K645 WeakPolarHBondContact O-CG 3.23Å; A640-K645 PolarHBondContact O-N 3.19Å; G643-K645 PolarHBondContact O-N 3.37Å; G643-K645 VanDerWaalsContact O-N 3.17Å; K645-I647 PolarHBondContact O-N 3.17Å; K645-I647 VanDerWaalsContact O-N 3.09Å
646	N	92.9	Very high	90.6	Very high	62 Å²	62	48.5 Å²	48.5	33%	0.332	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	98.7	168.5	-178.2	28.3	0	0	0	109	N610 F611 F692	N610-N646 WeakPolarHBondContact OD1-CB 3.36Å; N610-N646 PolarHBondContact OD1-ND2 3.25Å; F611-N646 PolarHBondContact N-O 3.38Å; N646-F692 PolarHBondContact ND2-O 2.94Å
647	I	94	Very high	90.4	Very high	7 Å²	7	49 Å²	49	4%	0.036	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	122.5	-176.7	-60.5	169.2	0	0	0	110	F611 A640 L641 K645 P649 I669 F672	F611-I647 HydrophobicContact CB-CG1 4.2Å; F611-I647 HydrophobicContact CD1-CG1 4.08Å; F611-I647 HydrophobicContact CD1-CG2 4.07Å; F611-I647 HydrophobicContact CG-CG1 4.47Å; F611-I647 CarbonylContact O-C 3.48Å; F611-I647 VanDerWaalsContact O-CA 3.29Å; F611-I647 WeakPolarHBondContact O-CA 3.5Å; A640-I647 HydrophobicContact CB-CD1 4.05Å; A640-I647 HydrophobicContact CB-CG1 4.24Å; L641-I647 HydrophobicContact CD2-CD1 3.58Å; L641-I647 HydrophobicContact CG-CD1 3.92Å; K645-I647 PolarHBondContact O-N 3.17Å; K645-I647 VanDerWaalsContact O-N 3.09Å; I647-P649 HydrophobicContact CG2-CG 4.39Å; I647-I669 HydrophobicContact CD1-CD1 4.38Å; I647-I669 HydrophobicContact CG2-CD1 3.49Å; I647-I669 VanDerWaalsContact CG2-CD1 3.49Å; I647-F672 HydrophobicContact CB-CD1 3.88Å; I647-F672 HydrophobicContact CB-CE1 3.8Å; I647-F672 HydrophobicContact CB-CG 4.43Å; I647-F672 HydrophobicContact CB-CZ 4.26Å; I647-F672 HydrophobicContact CD1-CE1 4.36Å; I647-F672 HydrophobicContact CD1-CE2 4.34Å; I647-F672 HydrophobicContact CD1-CZ 3.98Å; I647-F672 HydrophobicContact CG1-CE1 4.42Å; I647-F672 HydrophobicContact CG2-CD1 4.4Å; I647-F672 HydrophobicContact CG2-CG 4.5Å; I647-F672 WeakPolarHBondContact O-CD1 3.45Å
648	V	94.8	Very high	90.1	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	98.5	178.2	-175.4	0	0	0	0	109.2	F611 I612 L613 I675 F692 L693	F611-V648 PolarHBondContact O-N 3.45Å; I612-V648 WeakPolarHBondContact CA-O 3.34Å; I612-V648 HydrophobicContact CG1-CB 4.45Å; L613-V648 PolarHBondContact N-O 3.26Å; L613-V648 VanDerWaalsContact N-O 3.11Å; V648-I675 HydrophobicContact CG1-CD1 3.79Å; V648-F692 HydrophobicContact CG1-CB 4.16Å; V648-F692 HydrophobicContact CG1-CD1 4.34Å; V648-F692 HydrophobicContact CG2-CB 3.97Å; V648-L693 HydrophobicContact CG2-CD2 4.26Å
649	P	93.9	Very high	89.8	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	134.1	175.3	-13.8	28.8	0	0	0	111.4	L613 M615 I647 F672 G674 I675	L613-P649 CarbonylContact O-C 3.31Å; L613-P649 WeakPolarHBondContact O-CA 3.49Å; M615-P649 HydrophobicContact CE-CB 3.24Å; M615-P649 HydrophobicContact CE-CG 4.4Å; M615-P649 HydrophobicContact SD-CB 3.91Å; I647-P649 HydrophobicContact CG2-CG 4.39Å; P649-F672 HydrophobicContact CG-CB 3.71Å; P649-G674 CarbonylContact O-C 3.58Å; P649-G674 WeakPolarHBondContact O-CA 3.34Å; P649-I675 PolarHBondContact O-N 3.48Å
650	V	94.5	Very high	89.6	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	115.7	175.2	-178.3	0	0	0	0	108.6	L570 L574 I612 L613 M615 I675 W677 I689	L570-V650 HydrophobicContact CD2-CG1 4.2Å; L574-V650 HydrophobicContact CD1-CB 4.46Å; L574-V650 HydrophobicContact CD1-CG1 4.41Å; L574-V650 HydrophobicContact CD1-CG2 4.34Å; I612-V650 HydrophobicContact CG2-CG2 3.88Å; L613-V650 PolarHBondContact O-N 2.98Å; M615-V650 PolarHBondContact N-O 3.02Å; V650-I675 CarbonylContact C-O 3.59Å; V650-I675 VanDerWaalsContact CA-O 3.3Å; V650-I675 WeakPolarHBondContact CA-O 3.27Å; V650-W677 HydrophobicContact CG1-CB 4.16Å; V650-I689 HydrophobicContact CG2-CD1 3.92Å; V650-I689 HydrophobicContact CG2-CG1 4.34Å
651	T	91.8	Very high	89.4	Confident	22 Å²	22	62.2 Å²	62.2	14%	0.135	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.9	-176.7	49.7	0	0	0	0	112.5	M615 F654 W656 I675 K676 W677	M615-T651 HydrophobicContact CB-CG2 4.19Å; M615-T651 HydrophobicContact CE-CG2 3.2Å; M615-T651 WeakPolarHBondContact O-CA 3.4Å; T651-F654 HydrophobicContact CG2-CB 4.48Å; T651-F654 HydrophobicContact CG2-CD1 4.16Å; T651-W656 HydrophobicContact CG2-CZ2 4.28Å; T651-I675 PolarHBondContact N-O 3.19Å; T651-I675 PolarHBondContact OG1-O 2.99Å; T651-K676 WeakPolarHBondContact OG1-CA 3.45Å; T651-W677 WeakPolarHBondContact O-CB 3.48Å; T651-W677 PolarHBondContact O-N 3.19Å
652	D	90	Very high	89.2	Confident	27 Å²	27	60.7 Å²	60.7	14%	0.144	33%	0.33	C	S	.	.	S	Bend	trans	-135.1	109.5	170.2	179.7	22.5	0	0	0	109.7	L570 M615 S616 A617 F654 W677 H679	L570-D652 HydrophobicContact CD2-CB 3.6Å; M615-D652 PolarHBondContact O-N 3.25Å; S616-D652 CarbonylContact C-O 3.58Å; S616-D652 WeakPolarHBondContact CA-O 3.48Å; A617-D652 PolarHBondContact N-O 3.5Å; D652-F654 PolarHBondContact O-N 3.4Å; D652-W677 HydrophobicContact CB-CB 4.31Å; D652-H679 IonicContact OD1-NE2 3.08Å; D652-H679 IonicContact OD2-NE2 3.96Å
653	N	83.5	Confident	89.2	Confident	136 Å²	136	56.3 Å²	56.3	73%	0.727	30%	0.299	S	S	*	.	S	Bend	trans	47.6	34.1	-176.4	-61	-42.7	0	0	0	114.3
654	F	88.4	Confident	89.3	Confident	25 Å²	25	62 Å²	62	11%	0.11	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-99.2	136	-176	176.2	-104.7	0	0	0	112.9	M615 S616 A619 L620 T651 D652 W656	M615-F654 HydrophobicContact CB-CB 4.17Å; M615-F654 HydrophobicContact CB-CD1 3.78Å; M615-F654 HydrophobicContact CB-CD2 4.21Å; M615-F654 HydrophobicContact CB-CE1 4.15Å; M615-F654 HydrophobicContact CB-CG 3.8Å; M615-F654 HydrophobicContact CE-CD1 4.31Å; M615-F654 HydrophobicContact CE-CE1 4.35Å; M615-F654 WeakPolarHBondContact O-CB 3.26Å; M615-F654 HydrophobicContact SD-CD1 4.26Å; M615-F654 HydrophobicContact SD-CE1 3.86Å; M615-F654 HydrophobicContact SD-CZ 4.41Å; S616-F654 WeakPolarHBondContact O-CD2 3.44Å; A619-F654 HydrophobicContact CB-CD2 4.39Å; A619-F654 HydrophobicContact CB-CE2 4.29Å; L620-F654 HydrophobicContact CD1-CZ 3.82Å; L620-F654 HydrophobicContact CG-CE2 4.19Å; L620-F654 HydrophobicContact CG-CZ 3.94Å; T651-F654 HydrophobicContact CG2-CB 4.48Å; T651-F654 HydrophobicContact CG2-CD1 4.16Å; D652-F654 PolarHBondContact O-N 3.4Å; F654-W656 HydrophobicContact CD1-CD2 4.37Å; F654-W656 AromaticContact CE1-CD2 3.89Å; F654-W656 HydrophobicContact CE1-CD2 3.89Å; F654-W656 AromaticContact CE1-CE3 3.72Å; F654-W656 HydrophobicContact CE1-CE3 3.72Å; F654-W656 HydrophobicContact CE1-CG 4.33Å; F654-W656 HydrophobicContact CE1-CZ3 4.22Å
655	M	84.8	Confident	89.2	Confident	163 Å²	163	56.7 Å²	56.7	80%	0.803	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-101.7	126.1	174.3	-71.1	-81.6	-71.1	0	0	109.1
656	W	84.8	Confident	89.1	Confident	118 Å²	118	54.6 Å²	54.6	45%	0.447	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-67.1	126.8	177.6	-68.6	101.8	0	0	0	110.7	M615 T651 F654 L670	M615-W656 HydrophobicContact CE-CH2 3.21Å; M615-W656 HydrophobicContact CE-CZ2 3.51Å; M615-W656 HydrophobicContact CE-CZ3 3.83Å; M615-W656 HydrophobicContact SD-CH2 3.83Å; M615-W656 HydrophobicContact SD-CZ3 3.84Å; T651-W656 HydrophobicContact CG2-CZ2 4.28Å; F654-W656 HydrophobicContact CD1-CD2 4.37Å; F654-W656 AromaticContact CE1-CD2 3.89Å; F654-W656 HydrophobicContact CE1-CD2 3.89Å; F654-W656 AromaticContact CE1-CE3 3.72Å; F654-W656 HydrophobicContact CE1-CE3 3.72Å; F654-W656 HydrophobicContact CE1-CG 4.33Å; F654-W656 HydrophobicContact CE1-CZ3 4.22Å; W656-L670 HydrophobicContact CE3-CD2 3.45Å; W656-L670 VanDerWaalsContact CE3-CD2 3.45Å; W656-L670 HydrophobicContact CZ3-CD2 3.7Å
657	P	86.6	Confident	88.9	Confident	21 Å²	21	55.5 Å²	55.5	14%	0.136	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-78.1	165.8	179.1	33.7	-36.6	0	0	0	111.8	L620 M624 L662 L670	L620-P657 HydrophobicContact CD1-CG 4.15Å; M624-P657 HydrophobicContact CE-CB 3.47Å; M624-P657 VanDerWaalsContact CE-CB 3.47Å; M624-P657 HydrophobicContact CE-CG 4.25Å; P657-L662 HydrophobicContact CG-CD1 4.04Å; P657-L662 HydrophobicContact CG-CG 4.34Å; P657-L670 HydrophobicContact CG-CD2 4.44Å
658	D	86.1	Confident	88.6	Confident	93 Å²	93	57.2 Å²	57.2	50%	0.497	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-64.8	134.1	173.6	-175.2	68.6	0	0	0	111.2	T660 S661	D658-T660 PolarHBondContact O-N 2.94Å; D658-T660 VanDerWaalsContact O-N 3.08Å; D658-T660 VanDerWaalsContact OD2-CB 3.3Å; D658-T660 WeakPolarHBondContact OD2-CB 3.21Å; D658-T660 PolarHBondContact OD2-N 2.94Å; D658-T660 PolarHBondContact OD2-OG1 3.15Å; D658-S661 PolarHBondContact O-N 3.31Å; D658-S661 VanDerWaalsContact O-N 3.09Å; D658-S661 PolarHBondContact O-OG 3.49Å
659	P	85.9	Confident	88.3	Confident	60 Å²	60	57.1 Å²	57.1	39%	0.39	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-26.4	-178.2	-25.7	33.8	0	0	0	114.7	S661 R667 L670	P659-S661 VanDerWaalsContact C-N 3.34Å; P659-R667 HydrophobicContact CB-CG 4.36Å; P659-R667 WeakPolarHBondContact O-CD 3.35Å; P659-R667 PolarHBondContact O-NE 3.39Å; P659-L670 HydrophobicContact CB-CD1 3.85Å; P659-L670 HydrophobicContact CG-CD1 3.82Å
660	T	85.5	Confident	88	Confident	119 Å²	119	59 Å²	59	73%	0.73	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-18.5	-178.4	71.9	0	0	0	0	113.1	D658 L662	D658-T660 PolarHBondContact O-N 2.94Å; D658-T660 VanDerWaalsContact O-N 3.08Å; D658-T660 VanDerWaalsContact OD2-CB 3.3Å; D658-T660 WeakPolarHBondContact OD2-CB 3.21Å; D658-T660 PolarHBondContact OD2-N 2.94Å; D658-T660 PolarHBondContact OD2-OG1 3.15Å; T660-L662 VanDerWaalsContact C-N 3.31Å
661	S	87.6	Confident	87.6	Confident	37 Å²	37	65.6 Å²	65.6	26%	0.259	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-18.7	176.8	74.1	0	0	0	0	113	M624 G625 D658 P659	M624-S661 CarbonylContact C-O 3.55Å; M624-S661 WeakPolarHBondContact CA-O 3.46Å; G625-S661 PolarHBondContact N-O 3.34Å; D658-S661 PolarHBondContact O-N 3.31Å; D658-S661 VanDerWaalsContact O-N 3.09Å; D658-S661 PolarHBondContact O-OG 3.49Å; P659-S661 VanDerWaalsContact C-N 3.34Å
662	L	88.8	Confident	87.4	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.016	35%	0.353	C	S	.	.	S	Bend	trans	-91.8	141.2	178.7	-64.9	179.3	0	0	0	112.3	L620 C623 M624 P657 T660 M666 R667 L670	L620-L662 HydrophobicContact CB-CD2 4.45Å; L620-L662 HydrophobicContact CD1-CD1 4.22Å; C623-L662 HydrophobicContact CB-CD2 4.47Å; M624-L662 HydrophobicContact CG-CD2 4.18Å; P657-L662 HydrophobicContact CG-CD1 4.04Å; P657-L662 HydrophobicContact CG-CG 4.34Å; T660-L662 VanDerWaalsContact C-N 3.31Å; L662-M666 HydrophobicContact CB-CG 4.32Å; L662-M666 HydrophobicContact CD2-CE 4.2Å; L662-M666 HydrophobicContact CD2-SD 4.17Å; L662-R667 PolarHBondContact O-NH2 3.42Å; L662-L670 HydrophobicContact CD1-CD1 4.13Å; L662-L670 HydrophobicContact CD1-CD2 4.08Å; L662-L670 HydrophobicContact CD1-CG 4.16Å
663	P	90.6	Very high	87.2	Confident	13 Å²	13	72.6 Å²	72.6	8%	0.084	38%	0.379	C	S	.	.			trans	-52.1	150.2	168.4	-28.3	36.6	0	0	0	113.6	C623 D665 M666 R667	C623-P663 VanDerWaalsContact O-CD 3.23Å; C623-P663 WeakPolarHBondContact O-CD 3.34Å; P663-D665 VanDerWaalsContact C-N 3.33Å; P663-D665 WeakPolarHBondContact CB-OD1 3.42Å; P663-D665 PolarHBondContact O-N 2.68Å; P663-M666 HydrophobicContact CB-CG 4.22Å; P663-M666 HydrophobicContact CG-CG 4.5Å; P663-M666 HydrophobicContact CG-SD 4.33Å; P663-M666 PolarHBondContact O-N 2.98Å; P663-R667 PolarHBondContact O-N 3.44Å; P663-R667 VanDerWaalsContact O-N 3.09Å
664	E	87.9	Confident	87.4	Confident	160 Å²	160	67.8 Å²	67.8	75%	0.748	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-34.6	-171.7	-58.7	-164.5	146.9	0	0	113.7	M666	E664-M666 VanDerWaalsContact C-N 3.34Å; E664-M666 PolarHBondContact O-N 3.5Å
665	D	89.4	Confident	87.6	Confident	79 Å²	79	66.6 Å²	66.6	42%	0.422	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-24	-179.5	55.1	-12	0	0	0	113.8	H634 L641 P663	H634-D665 IonicContact CE1-OD1 2.68Å; H634-D665 IonicContact CE1-OD2 2.98Å; H634-D665 IonicContact NE2-OD1 2.65Å; H634-D665 PolarHBondContact NE2-OD1 3.45Å; H634-D665 VanDerWaalsContact NE2-OD1 3.15Å; H634-D665 IonicContact NE2-OD2 2.64Å; H634-D665 PolarHBondContact NE2-OD2 3.23Å; L641-D665 VanDerWaalsContact CD1-O 3.24Å; L641-D665 WeakPolarHBondContact CD1-O 3.2Å; P663-D665 VanDerWaalsContact C-N 3.33Å; P663-D665 WeakPolarHBondContact CB-OD1 3.42Å; P663-D665 PolarHBondContact O-N 2.68Å
666	M	89.5	Confident	88	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-13.6	176.1	72.3	175.5	-61.4	0	0	114.8	L620 C623 H634 I637 L662 P663 E664 A668 I669	L620-M666 HydrophobicContact CD2-CE 4.12Å; C623-M666 HydrophobicContact CB-CE 3.77Å; C623-M666 HydrophobicContact CB-SD 3.67Å; H634-M666 HydrophobicContact CB-SD 4.4Å; H634-M666 PolarHBondContact CD2-SD 3.42Å; I637-M666 HydrophobicContact CD1-CE 3.69Å; I637-M666 HydrophobicContact CG2-CB 3.84Å; L662-M666 HydrophobicContact CB-CG 4.32Å; L662-M666 HydrophobicContact CD2-CE 4.2Å; L662-M666 HydrophobicContact CD2-SD 4.17Å; P663-M666 HydrophobicContact CB-CG 4.22Å; P663-M666 HydrophobicContact CG-CG 4.5Å; P663-M666 HydrophobicContact CG-SD 4.33Å; P663-M666 PolarHBondContact O-N 2.98Å; E664-M666 VanDerWaalsContact C-N 3.34Å; E664-M666 PolarHBondContact O-N 3.5Å; M666-A668 PolarHBondContact O-N 3.09Å; M666-I669 WeakPolarHBondContact O-CB 3.34Å; M666-I669 WeakPolarHBondContact O-CG2 3.36Å; M666-I669 PolarHBondContact O-N 3.09Å
667	R	87.8	Confident	88.3	Confident	82 Å²	82	61.5 Å²	61.5	31%	0.309	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-53.9	-29.9	-174.9	-169.2	178.6	-64.4	134.9	7.4	113.9	P659 L662 P663 I669 L670	P659-R667 HydrophobicContact CB-CG 4.36Å; P659-R667 WeakPolarHBondContact O-CD 3.35Å; P659-R667 PolarHBondContact O-NE 3.39Å; L662-R667 PolarHBondContact O-NH2 3.42Å; P663-R667 PolarHBondContact O-N 3.44Å; P663-R667 VanDerWaalsContact O-N 3.09Å; R667-I669 PolarHBondContact O-N 2.89Å; R667-I669 VanDerWaalsContact O-N 3.1Å; R667-L670 PolarHBondContact O-N 2.84Å
668	A	88.8	Confident	88.4	Confident	42 Å²	42	62.2 Å²	62.2	35%	0.347	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-59.1	-20.3	177.8	0	0	0	0	0	113.8	L641 M666 L670 N671 F672	L641-A668 HydrophobicContact CD1-CB 4.26Å; L641-A668 HydrophobicContact CD2-CB 4.06Å; M666-A668 PolarHBondContact O-N 3.09Å; A668-L670 PolarHBondContact O-N 3.01Å; A668-N671 WeakPolarHBondContact O-CB 3.39Å; A668-N671 PolarHBondContact O-N 3.18Å; A668-N671 VanDerWaalsContact O-N 3.12Å; A668-F672 VanDerWaalsContact O-CD2 3.28Å; A668-F672 WeakPolarHBondContact O-CD2 3.4Å; A668-F672 WeakPolarHBondContact O-CE2 3.26Å
669	I	88.6	Confident	88.3	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-59.2	-29.6	178.9	-162.8	61	0	0	0	113.1	L613 I637 I647 M666 R667 N671 F672	L613-I669 HydrophobicContact CD2-CD1 3.82Å; L613-I669 HydrophobicContact CD2-CG1 3.65Å; I637-I669 HydrophobicContact CG2-CB 4.28Å; I637-I669 HydrophobicContact CG2-CD1 4.42Å; I637-I669 HydrophobicContact CG2-CG1 4.4Å; I647-I669 HydrophobicContact CD1-CD1 4.38Å; I647-I669 HydrophobicContact CG2-CD1 3.49Å; I647-I669 VanDerWaalsContact CG2-CD1 3.49Å; M666-I669 WeakPolarHBondContact O-CB 3.34Å; M666-I669 WeakPolarHBondContact O-CG2 3.36Å; M666-I669 PolarHBondContact O-N 3.09Å; R667-I669 PolarHBondContact O-N 2.89Å; R667-I669 VanDerWaalsContact O-N 3.1Å; I669-N671 PolarHBondContact O-N 3.26Å; I669-F672 HydrophobicContact CD1-CD2 4.31Å; I669-F672 PolarHBondContact O-N 3.39Å
670	L	86.4	Confident	88	Confident	38 Å²	38	66.5 Å²	66.5	20%	0.199	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-68.1	-17.4	-179.6	-58.6	179.3	0	0	0	113	W656 P657 P659 L662 R667 A668	W656-L670 HydrophobicContact CE3-CD2 3.45Å; W656-L670 VanDerWaalsContact CE3-CD2 3.45Å; W656-L670 HydrophobicContact CZ3-CD2 3.7Å; P657-L670 HydrophobicContact CG-CD2 4.44Å; P659-L670 HydrophobicContact CB-CD1 3.85Å; P659-L670 HydrophobicContact CG-CD1 3.82Å; L662-L670 HydrophobicContact CD1-CD1 4.13Å; L662-L670 HydrophobicContact CD1-CD2 4.08Å; L662-L670 HydrophobicContact CD1-CG 4.16Å; R667-L670 PolarHBondContact O-N 2.84Å; A668-L670 PolarHBondContact O-N 3.01Å
671	N	87.3	Confident	88	Confident	140 Å²	140	68.2 Å²	68.2	75%	0.749	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-89.3	-4.7	-178.8	-61.9	-29.3	0	0	0	113.1	A668 I669	A668-N671 WeakPolarHBondContact O-CB 3.39Å; A668-N671 PolarHBondContact O-N 3.18Å; A668-N671 VanDerWaalsContact O-N 3.12Å; I669-N671 PolarHBondContact O-N 3.26Å
672	F	87.1	Confident	88	Confident	68 Å²	68	67.4 Å²	67.4	30%	0.298	34%	0.336	S	S	.	.	S	Bend	trans	-84.9	143.2	-179.5	-71.7	-99	0	0	0	111.4	L641 I647 P649 A668 I669 G674	L641-F672 HydrophobicContact CD2-CE2 3.77Å; L641-F672 HydrophobicContact CD2-CZ 3.99Å; I647-F672 HydrophobicContact CB-CD1 3.88Å; I647-F672 HydrophobicContact CB-CE1 3.8Å; I647-F672 HydrophobicContact CB-CG 4.43Å; I647-F672 HydrophobicContact CB-CZ 4.26Å; I647-F672 HydrophobicContact CD1-CE1 4.36Å; I647-F672 HydrophobicContact CD1-CE2 4.34Å; I647-F672 HydrophobicContact CD1-CZ 3.98Å; I647-F672 HydrophobicContact CG1-CE1 4.42Å; I647-F672 HydrophobicContact CG2-CD1 4.4Å; I647-F672 HydrophobicContact CG2-CG 4.5Å; I647-F672 WeakPolarHBondContact O-CD1 3.45Å; P649-F672 HydrophobicContact CG-CB 3.71Å; A668-F672 VanDerWaalsContact O-CD2 3.28Å; A668-F672 WeakPolarHBondContact O-CD2 3.4Å; A668-F672 WeakPolarHBondContact O-CE2 3.26Å; I669-F672 HydrophobicContact CD1-CD2 4.31Å; I669-F672 PolarHBondContact O-N 3.39Å; F672-G674 PolarHBondContact O-N 2.98Å; F672-G674 VanDerWaalsContact O-N 3.11Å
673	N	86.1	Confident	87.9	Confident	128 Å²	128	71.3 Å²	71.3	68%	0.684	35%	0.354	S	S	*	.			trans	-70.5	106.9	178.2	-73.4	-32.9	0	0	0	110.9	F692	N673-F692 HydrophobicContact CB-CE1 4.11Å
674	G	87.2	Confident	87.8	Confident	34 Å²	34	73.4 Å²	73.4	35%	0.351	37%	0.372	S	S	.	.			trans	-74.9	146	175.3	0	0	0	0	0	113.7	P649 F672	P649-G674 CarbonylContact O-C 3.58Å; P649-G674 WeakPolarHBondContact O-CA 3.34Å; F672-G674 PolarHBondContact O-N 2.98Å; F672-G674 VanDerWaalsContact O-N 3.11Å
675	I	92.9	Very high	88	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	120.2	171.4	-62.1	172.8	0	0	0	108.4	V648 P649 V650 T651 W677 T685 K688 I689 F692	V648-I675 HydrophobicContact CG1-CD1 3.79Å; P649-I675 PolarHBondContact O-N 3.48Å; V650-I675 CarbonylContact C-O 3.59Å; V650-I675 VanDerWaalsContact CA-O 3.3Å; V650-I675 WeakPolarHBondContact CA-O 3.27Å; T651-I675 PolarHBondContact N-O 3.19Å; T651-I675 PolarHBondContact OG1-O 2.99Å; I675-W677 PolarHBondContact O-N 2.93Å; I675-T685 HydrophobicContact CG2-CG2 3.92Å; I675-K688 HydrophobicContact CD1-CG 4.23Å; I675-K688 HydrophobicContact CG2-CD 4.13Å; I675-I689 HydrophobicContact CD1-CB 4.32Å; I675-I689 HydrophobicContact CD1-CG1 3.66Å; I675-I689 HydrophobicContact CG2-CG1 4.2Å; I675-F692 HydrophobicContact CD1-CB 4.36Å; I675-F692 HydrophobicContact CD1-CD1 4.02Å; I675-F692 HydrophobicContact CD1-CD2 4.13Å; I675-F692 HydrophobicContact CD1-CE1 4.33Å; I675-F692 HydrophobicContact CD1-CE2 4.45Å; I675-F692 HydrophobicContact CD1-CG 3.92Å; I675-F692 HydrophobicContact CG1-CD1 4.48Å; I675-F692 HydrophobicContact CG1-CE1 4.36Å
676	K	92.1	Very high	88.2	Confident	166 Å²	166	62.6 Å²	62.6	72%	0.722	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	125.2	173.9	-173.1	177.2	178.8	-179.3	0	110.5	T651	T651-K676 WeakPolarHBondContact OG1-CA 3.45Å
677	W	92.5	Very high	88.3	Confident	8 Å²	8	67 Å²	67	3%	0.03	34%	0.34	C	S	.	.			trans	-71.4	141.3	172.7	-177.8	-109.5	0	0	0	111.1	L570 L573 L574 V650 T651 D652 I675 H679 Q682 T685 I686	L570-W677 HydrophobicContact CD1-CB 4.5Å; L570-W677 HydrophobicContact CD1-CD2 3.37Å; L570-W677 VanDerWaalsContact CD1-CE2 3.46Å; L570-W677 HydrophobicContact CD1-CE3 3.75Å; L570-W677 HydrophobicContact CD1-CG 3.7Å; L570-W677 HydrophobicContact CD1-CH2 4.27Å; L570-W677 HydrophobicContact CD1-CZ2 3.92Å; L570-W677 HydrophobicContact CD1-CZ3 4.19Å; L570-W677 HydrophobicContact CD2-CB 4.16Å; L570-W677 HydrophobicContact CD2-CG 4.1Å; L573-W677 HydrophobicContact CD1-CZ2 4.43Å; L574-W677 HydrophobicContact CD2-CE3 4.35Å; L574-W677 HydrophobicContact CD2-CZ3 3.91Å; V650-W677 HydrophobicContact CG1-CB 4.16Å; T651-W677 WeakPolarHBondContact O-CB 3.48Å; T651-W677 PolarHBondContact O-N 3.19Å; D652-W677 HydrophobicContact CB-CB 4.31Å; I675-W677 PolarHBondContact O-N 2.93Å; W677-H679 AromaticContact CD1-CD2 3.87Å; W677-H679 AromaticContact CD1-CE1 3.74Å; W677-H679 AromaticContact CD1-NE2 3.63Å; W677-H679 AromaticContact NE1-CE1 3.51Å; W677-H679 AromaticContact NE1-CG 3.78Å; W677-H679 AromaticContact NE1-ND1 3.44Å; W677-H679 PolarHBondContact NE1-ND1 3.21Å; W677-H679 AromaticContact NE1-NE2 3.85Å; W677-Q682 HydrophobicContact CH2-CB 3.92Å; W677-Q682 HydrophobicContact CH2-CG 4.09Å; W677-Q682 HydrophobicContact CZ2-CB 4.08Å; W677-Q682 HydrophobicContact CZ2-CG 3.71Å; W677-T685 HydrophobicContact CE3-CG2 3.66Å; W677-T685 HydrophobicContact CZ3-CG2 4.11Å; W677-I686 HydrophobicContact CH2-CD1 4.26Å; W677-I686 HydrophobicContact CH2-CG1 4.4Å; W677-I686 HydrophobicContact CZ3-CD1 3.87Å; W677-I686 HydrophobicContact CZ3-CG1 4.17Å
678	S	89.1	Confident	88.5	Confident	35 Å²	35	67.8 Å²	67.8	25%	0.245	35%	0.346	C	S	.	.			trans	-127	118.5	172.9	179.1	0	0	0	0	109.3	E680 Y681 Q682	S678-E680 VanDerWaalsContact C-N 3.26Å; S678-E680 PolarHBondContact O-N 3.2Å; S678-Y681 CarbonylContact O-C 3.48Å; S678-Y681 PolarHBondContact O-N 3.04Å; S678-Y681 WeakPolarHBondContact OG-CD2 3.33Å; S678-Y681 PolarHBondContact OG-N 3.16Å; S678-Y681 VanDerWaalsContact OG-N 3.12Å; S678-Q682 PolarHBondContact O-N 3.47Å
679	H	82.9	Confident	88.7	Confident	81 Å²	81	65.8 Å²	65.8	38%	0.375	33%	0.329	S	S	.	.	S	Bend	trans	-67.5	-26.9	177.2	-67.9	-84.7	0	0	0	112.9	D652 W677 Q682	D652-H679 IonicContact OD1-NE2 3.08Å; D652-H679 IonicContact OD2-NE2 3.96Å; W677-H679 AromaticContact CD1-CD2 3.87Å; W677-H679 AromaticContact CD1-CE1 3.74Å; W677-H679 AromaticContact CD1-NE2 3.63Å; W677-H679 AromaticContact NE1-CE1 3.51Å; W677-H679 AromaticContact NE1-CG 3.78Å; W677-H679 AromaticContact NE1-ND1 3.44Å; W677-H679 PolarHBondContact NE1-ND1 3.21Å; W677-H679 AromaticContact NE1-NE2 3.85Å; H679-Q682 VanDerWaalsContact O-CG 3.28Å; H679-Q682 WeakPolarHBondContact O-CG 3.42Å; H679-Q682 PolarHBondContact O-NE2 3.04Å; H679-Q682 VanDerWaalsContact O-NE2 3.17Å
680	E	80.3	Confident	88.9	Confident	163 Å²	163	66.9 Å²	66.9	76%	0.762	34%	0.335	S	S	*	.	S	Bend	trans	-81	-43.8	175.4	-65.3	175.1	-172.4	0	0	111.4	S678	S678-E680 VanDerWaalsContact C-N 3.26Å; S678-E680 PolarHBondContact O-N 3.2Å
681	Y	85.5	Confident	89.1	Confident	155 Å²	155	73.4 Å²	73.4	61%	0.608	36%	0.357	S	S	*	.	S	Bend	trans	-107.6	52	-175.2	-56.9	-81.7	0	0	0	112	S678 E683 T685	S678-Y681 CarbonylContact O-C 3.48Å; S678-Y681 PolarHBondContact O-N 3.04Å; S678-Y681 WeakPolarHBondContact OG-CD2 3.33Å; S678-Y681 PolarHBondContact OG-N 3.16Å; S678-Y681 VanDerWaalsContact OG-N 3.12Å; Y681-E683 PolarHBondContact O-N 2.81Å; Y681-T685 WeakPolarHBondContact O-CB 3.33Å; Y681-T685 PolarHBondContact O-N 2.84Å; Y681-T685 VanDerWaalsContact O-N 3.13Å; Y681-T685 PolarHBondContact O-OG1 2.88Å
682	Q	87.7	Confident	89.2	Confident	20 Å²	20	70.2 Å²	70.2	9%	0.093	34%	0.337	C	S	.	.	H	α-helix	trans	-58.9	-47.5	-176.7	-57.5	-175.4	-1.4	0	0	111.3	R214 W677 S678 H679 A684 T685 I686	R214-Q682 PolarHBondContact O-NE2 2.72Å; W677-Q682 HydrophobicContact CH2-CB 3.92Å; W677-Q682 HydrophobicContact CH2-CG 4.09Å; W677-Q682 HydrophobicContact CZ2-CB 4.08Å; W677-Q682 HydrophobicContact CZ2-CG 3.71Å; S678-Q682 PolarHBondContact O-N 3.47Å; H679-Q682 VanDerWaalsContact O-CG 3.28Å; H679-Q682 WeakPolarHBondContact O-CG 3.42Å; H679-Q682 PolarHBondContact O-NE2 3.04Å; H679-Q682 VanDerWaalsContact O-NE2 3.17Å; Q682-A684 PolarHBondContact O-N 3.04Å; Q682-T685 WeakPolarHBondContact O-CB 3.32Å; Q682-T685 PolarHBondContact O-N 3.36Å; Q682-T685 VanDerWaalsContact O-N 3.15Å; Q682-I686 VanDerWaalsContact O-CG1 3.31Å; Q682-I686 WeakPolarHBondContact O-CG1 3.41Å; Q682-I686 PolarHBondContact O-N 2.88Å
683	E	86	Confident	89.3	Confident	85 Å²	85	67.4 Å²	67.4	40%	0.397	33%	0.325	S	S	.	.	H	α-helix	trans	-60.5	-48.8	-175.7	-169.4	64.4	-165.4	0	0	112.6	R581 Y681 T685 I686 E687	R581-E683 IonicContact CZ-OE1 3.97Å; R581-E683 IonicContact CZ-OE2 3.4Å; R581-E683 IonicContact NH2-OE1 3.88Å; R581-E683 PolarHBondContact NH2-OE1 3.39Å; R581-E683 IonicContact NH2-OE2 3.15Å; R581-E683 PolarHBondContact NH2-OE2 3.46Å; Y681-E683 PolarHBondContact O-N 2.81Å; E683-T685 VanDerWaalsContact C-N 3.28Å; E683-T685 PolarHBondContact O-N 2.74Å; E683-I686 PolarHBondContact O-N 3.12Å; E683-E687 PolarHBondContact O-N 3.1Å
684	A	88.9	Confident	89.1	Confident	56 Å²	56	67 Å²	67	46%	0.463	32%	0.317	S	S	.	.	H	α-helix	trans	-63.4	-35.3	177	0	0	0	0	0	112.1	Q682 K688	Q682-A684 PolarHBondContact O-N 3.04Å; A684-K688 PolarHBondContact O-N 2.86Å; A684-K688 VanDerWaalsContact O-N 3.13Å
685	T	92.2	Very high	88	Confident	12 Å²	12	67.4 Å²	67.4	7%	0.074	32%	0.321	C	S	.	.	H	α-helix	trans	-66.6	-43.6	176.1	-54.2	0	0	0	0	111	I675 W677 Y681 Q682 E683 K688 I689	I675-T685 HydrophobicContact CG2-CG2 3.92Å; W677-T685 HydrophobicContact CE3-CG2 3.66Å; W677-T685 HydrophobicContact CZ3-CG2 4.11Å; Y681-T685 WeakPolarHBondContact O-CB 3.33Å; Y681-T685 PolarHBondContact O-N 2.84Å; Y681-T685 VanDerWaalsContact O-N 3.13Å; Y681-T685 PolarHBondContact O-OG1 2.88Å; Q682-T685 WeakPolarHBondContact O-CB 3.32Å; Q682-T685 PolarHBondContact O-N 3.36Å; Q682-T685 VanDerWaalsContact O-N 3.15Å; E683-T685 VanDerWaalsContact C-N 3.28Å; E683-T685 PolarHBondContact O-N 2.74Å; T685-K688 WeakPolarHBondContact O-CB 3.24Å; T685-K688 PolarHBondContact O-N 2.98Å; T685-I689 HydrophobicContact CG2-CD1 4.28Å; T685-I689 WeakPolarHBondContact O-CG1 3.49Å; T685-I689 PolarHBondContact O-N 3.27Å
686	I	92.9	Very high	85.7	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-63.1	-43.2	176.3	-67.2	-66.9	0	0	0	111.3	L574 H577 W677 Q682 E683 K688 I689 I690	L574-I686 HydrophobicContact CD2-CD1 3.63Å; H577-I686 HydrophobicContact CB-CD1 3.53Å; H577-I686 HydrophobicContact CB-CG1 3.81Å; H577-I686 HydrophobicContact CB-CG2 4.16Å; W677-I686 HydrophobicContact CH2-CD1 4.26Å; W677-I686 HydrophobicContact CH2-CG1 4.4Å; W677-I686 HydrophobicContact CZ3-CD1 3.87Å; W677-I686 HydrophobicContact CZ3-CG1 4.17Å; Q682-I686 VanDerWaalsContact O-CG1 3.31Å; Q682-I686 WeakPolarHBondContact O-CG1 3.41Å; Q682-I686 PolarHBondContact O-N 2.88Å; E683-I686 PolarHBondContact O-N 3.12Å; I686-K688 VanDerWaalsContact C-N 3.25Å; I686-K688 PolarHBondContact O-N 2.99Å; I686-I689 HydrophobicContact CD1-CD1 4.31Å; I686-I689 WeakPolarHBondContact O-CB 3.48Å; I686-I689 PolarHBondContact O-N 3.21Å; I686-I689 VanDerWaalsContact O-N 3.12Å; I686-I690 HydrophobicContact CG2-CD1 3.75Å; I686-I690 HydrophobicContact CG2-CG1 4.39Å; I686-I690 WeakPolarHBondContact O-CG1 3.25Å; I686-I690 PolarHBondContact O-N 3.42Å
687	E	91.5	Very high	83.4	Confident	92 Å²	92	78.7 Å²	78.7	43%	0.43	37%	0.366	S	S	.	.	H	α-helix	trans	-57.9	-40.4	174.7	-74.2	-173.8	-175.6	0	0	112.1	E683 I690 R691	E683-E687 PolarHBondContact O-N 3.1Å; E687-I690 PolarHBondContact O-N 2.99Å; E687-R691 WeakPolarHBondContact O-CG 3.35Å; E687-R691 PolarHBondContact O-N 3.43Å; E687-R691 VanDerWaalsContact O-N 3.09Å; E687-R691 IonicContact OE2-NH2 3.92Å
688	K	92.2	Very high	80.8	Confident	99 Å²	99	84.7 Å²	84.7	43%	0.43	40%	0.398	S	S	.	.	H	α-helix	trans	-64.2	-43.1	175.2	-171.7	178.3	176.8	-176.9	0	111.6	I675 A684 T685 I686 I690 R691 F692	I675-K688 HydrophobicContact CD1-CG 4.23Å; I675-K688 HydrophobicContact CG2-CD 4.13Å; A684-K688 PolarHBondContact O-N 2.86Å; A684-K688 VanDerWaalsContact O-N 3.13Å; T685-K688 WeakPolarHBondContact O-CB 3.24Å; T685-K688 PolarHBondContact O-N 2.98Å; I686-K688 VanDerWaalsContact C-N 3.25Å; I686-K688 PolarHBondContact O-N 2.99Å; K688-I690 VanDerWaalsContact C-N 3.35Å; K688-I690 PolarHBondContact O-N 3.16Å; K688-R691 PolarHBondContact O-N 3.12Å; K688-F692 HydrophobicContact CG-CE2 4.24Å; K688-F692 VanDerWaalsContact O-CD2 3.25Å; K688-F692 WeakPolarHBondContact O-CD2 3.36Å; K688-F692 PolarHBondContact O-N 3.3Å
689	I	93.6	Very high	78.2	Confident	0 Å²	0	89.1 Å²	89.1	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-59.7	-46.2	175.5	-68	166.4	0	0	0	110.3	L574 I612 V650 I675 T685 I686 R691 F692 L693	L574-I689 HydrophobicContact CD2-CD1 3.6Å; I612-I689 HydrophobicContact CD1-CG2 4.01Å; V650-I689 HydrophobicContact CG2-CD1 3.92Å; V650-I689 HydrophobicContact CG2-CG1 4.34Å; I675-I689 HydrophobicContact CD1-CB 4.32Å; I675-I689 HydrophobicContact CD1-CG1 3.66Å; I675-I689 HydrophobicContact CG2-CG1 4.2Å; T685-I689 HydrophobicContact CG2-CD1 4.28Å; T685-I689 WeakPolarHBondContact O-CG1 3.49Å; T685-I689 PolarHBondContact O-N 3.27Å; I686-I689 HydrophobicContact CD1-CD1 4.31Å; I686-I689 WeakPolarHBondContact O-CB 3.48Å; I686-I689 PolarHBondContact O-N 3.21Å; I686-I689 VanDerWaalsContact O-N 3.12Å; I689-R691 VanDerWaalsContact C-N 3.31Å; I689-R691 PolarHBondContact O-N 3.46Å; I689-F692 CarbonylContact O-C 3.55Å; I689-F692 WeakPolarHBondContact O-CA 3.49Å; I689-F692 WeakPolarHBondContact O-CB 3.38Å; I689-F692 PolarHBondContact O-N 3.21Å; I689-L693 HydrophobicContact CG2-CD1 4.05Å; I689-L693 HydrophobicContact CG2-CG 4.19Å; I689-L693 WeakPolarHBondContact O-CG 3.46Å; I689-L693 PolarHBondContact O-N 3.34Å
690	I	92.4	Very high	76	Confident	23 Å²	23	90.7 Å²	90.7	12%	0.118	44%	0.44	C	S	.	.	H	α-helix	trans	-60.7	-39.2	179.7	-70.3	165.2	0	0	0	112.1	L578 Y583 I686 E687 K688 F692 L693 K694	L578-I690 HydrophobicContact CD2-CG1 4Å; Y583-I690 HydrophobicContact CE2-CG1 4.24Å; Y583-I690 HydrophobicContact CE2-CG2 4.33Å; I686-I690 HydrophobicContact CG2-CD1 3.75Å; I686-I690 HydrophobicContact CG2-CG1 4.39Å; I686-I690 WeakPolarHBondContact O-CG1 3.25Å; I686-I690 PolarHBondContact O-N 3.42Å; E687-I690 PolarHBondContact O-N 2.99Å; K688-I690 VanDerWaalsContact C-N 3.35Å; K688-I690 PolarHBondContact O-N 3.16Å; I690-F692 PolarHBondContact O-N 3.4Å; I690-L693 PolarHBondContact O-N 3.48Å; I690-K694 HydrophobicContact CG2-CD 4.38Å; I690-K694 PolarHBondContact O-N 2.86Å
691	R	91.3	Very high	73.9	Confident	175 Å²	175	90.9 Å²	90.9	66%	0.66	45%	0.446	S	S	*	.	H	α-helix	trans	-60.7	-35.5	173.9	-69.7	174.3	-168.8	175.5	7.9	111.9	E687 K688 I689	E687-R691 WeakPolarHBondContact O-CG 3.35Å; E687-R691 PolarHBondContact O-N 3.43Å; E687-R691 VanDerWaalsContact O-N 3.09Å; E687-R691 IonicContact OE2-NH2 3.92Å; K688-R691 PolarHBondContact O-N 3.12Å; I689-R691 VanDerWaalsContact C-N 3.31Å; I689-R691 PolarHBondContact O-N 3.46Å
692	F	89.9	Confident	71.2	Confident	74 Å²	74	88 Å²	88	33%	0.325	45%	0.454	S	S	.	.	H	α-helix	trans	-74.7	-32.6	176.5	-81.7	-128.6	0	0	0	112	N646 V648 N673 I675 K688 I689 I690	N646-F692 PolarHBondContact ND2-O 2.94Å; V648-F692 HydrophobicContact CG1-CB 4.16Å; V648-F692 HydrophobicContact CG1-CD1 4.34Å; V648-F692 HydrophobicContact CG2-CB 3.97Å; N673-F692 HydrophobicContact CB-CE1 4.11Å; I675-F692 HydrophobicContact CD1-CB 4.36Å; I675-F692 HydrophobicContact CD1-CD1 4.02Å; I675-F692 HydrophobicContact CD1-CD2 4.13Å; I675-F692 HydrophobicContact CD1-CE1 4.33Å; I675-F692 HydrophobicContact CD1-CE2 4.45Å; I675-F692 HydrophobicContact CD1-CG 3.92Å; I675-F692 HydrophobicContact CG1-CD1 4.48Å; I675-F692 HydrophobicContact CG1-CE1 4.36Å; K688-F692 HydrophobicContact CG-CE2 4.24Å; K688-F692 VanDerWaalsContact O-CD2 3.25Å; K688-F692 WeakPolarHBondContact O-CD2 3.36Å; K688-F692 PolarHBondContact O-N 3.3Å; I689-F692 CarbonylContact O-C 3.55Å; I689-F692 WeakPolarHBondContact O-CA 3.49Å; I689-F692 WeakPolarHBondContact O-CB 3.38Å; I689-F692 PolarHBondContact O-N 3.21Å; I690-F692 PolarHBondContact O-N 3.4Å
693	L	88.9	Confident	68.6	Low	9 Å²	9	92.7 Å²	92.7	5%	0.047	49%	0.486	C	S	.	.	H	α-helix	trans	-70.8	-32.7	176.8	-65.1	176.2	0	0	0	113.4	V558 L578 N610 I612 V648 I689 I690 G695	V558-L693 HydrophobicContact CG2-CD1 3.98Å; V558-L693 HydrophobicContact CG2-CD2 4.28Å; L578-L693 HydrophobicContact CD1-CD1 4.4Å; L578-L693 HydrophobicContact CD2-CD1 3.71Å; N610-L693 HydrophobicContact CB-CD2 3.48Å; N610-L693 VanDerWaalsContact CB-CD2 3.48Å; N610-L693 PolarHBondContact OD1-O 3.11Å; N610-L693 VanDerWaalsContact OD1-O 3.13Å; I612-L693 HydrophobicContact CD1-CD1 4.38Å; I612-L693 HydrophobicContact CD1-CD2 4.19Å; I612-L693 HydrophobicContact CG1-CD2 4.14Å; V648-L693 HydrophobicContact CG2-CD2 4.26Å; I689-L693 HydrophobicContact CG2-CD1 4.05Å; I689-L693 HydrophobicContact CG2-CG 4.19Å; I689-L693 WeakPolarHBondContact O-CG 3.46Å; I689-L693 PolarHBondContact O-N 3.34Å; I690-L693 PolarHBondContact O-N 3.48Å; L693-G695 VanDerWaalsContact C-N 3.35Å
694	K	82	Confident	66	Low	119 Å²	119	94.7 Å²	94.7	52%	0.517	50%	0.5	S	S	.	.	H	α-helix	trans	-75	-22.2	178.9	-69.8	-177.1	177.8	-174	0	113.4	Y583 I690	Y583-K694 VanDerWaalsContact OH-CE 3.27Å; Y583-K694 WeakPolarHBondContact OH-CE 3.38Å; I690-K694 HydrophobicContact CG2-CD 4.38Å; I690-K694 PolarHBondContact O-N 2.86Å
695	G	62.8	Low	63.3	Low	43 Å²	43	101 Å²	101	44%	0.443	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	58.8	177.5	-175.8	0	0	0	0	0	113.2	L693 H697	L693-G695 VanDerWaalsContact C-N 3.35Å; G695-H697 PolarHBondContact O-N 3.12Å
696	R	45.7	Very low	60.5	Low	238 Å²	238	104.7 Å²	104.7	90%	0.898	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-75	7	-179.6	-86.7	-178.7	176.4	171.7	-1.2	114.7
697	H	42.4	Very low	57.7	Low	165 Å²	165	113.3 Å²	113.3	76%	0.764	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-92.5	-3.8	-164.9	-91.9	-70.3	0	0	0	116.6	G695	G695-H697 PolarHBondContact O-N 3.12Å
698	D	39.4	Very low	55	Low	134 Å²	134	114.5 Å²	114.5	72%	0.717	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-106.7	23.6	-178.5	-73.6	-14.7	0	0	0	114.6
699	T	33.4	Very low	52.3	Low	129 Å²	129	118.9 Å²	118.9	79%	0.791	62%	0.624	S	S	*	*	S	Bend	trans	-114.2	8.4	177.4	37.4	0	0	0	0	115.4
700	T	36.4	Very low	49.7	Very low	113 Å²	113	128.9 Å²	128.9	69%	0.693	67%	0.667	S	S	*	*	S	Bend	trans	-117.4	85.4	170	37.2	0	0	0	0	108.7
701	D	35.8	Very low	46.9	Very low	168 Å²	168	137.7 Å²	137.7	90%	0.898	71%	0.705	S	S	*	*			trans	179.8	75.2	141.8	-86	-19.2	0	0	0	109.7
702	A	28.7	Very low	44.2	Very low	93 Å²	93	143 Å²	143	77%	0.769	73%	0.733	S	S	*	*			trans	-150.4	108.4	152.2	0	0	0	0	0	107.4	D704	A702-D704 PolarHBondContact O-N 3.07Å
703	P	33.1	Very low	41.9	Very low	119 Å²	119	146.5 Å²	146.5	77%	0.773	75%	0.753	S	S	*	*			trans	-69.2	123.7	168.6	9.6	0.5	0	0	0	109	E705	P703-E705 VanDerWaalsContact C-N 3.3Å; P703-E705 PolarHBondContact O-N 3.1Å
704	D	31.4	Very low	39.4	Very low	127 Å²	127	153.7 Å²	153.7	68%	0.679	79%	0.79	S	S	*	*			trans	-70.4	79	176.1	-165.7	3.6	0	0	0	110.3	A702 S706	A702-D704 PolarHBondContact O-N 3.07Å; D704-S706 VanDerWaalsContact C-N 3.29Å; D704-S706 PolarHBondContact O-N 2.84Å; D704-S706 VanDerWaalsContact O-N 3.14Å; D704-S706 PolarHBondContact OD1-OG 2.85Å
705	E	33.8	Very low	37	Very low	189 Å²	189	155.7 Å²	155.7	88%	0.883	81%	0.805	S	S	*	*			trans	-79.9	71.4	167.8	-77.7	-165.4	161.6	0	0	110.6	P703	P703-E705 VanDerWaalsContact C-N 3.3Å; P703-E705 PolarHBondContact O-N 3.1Å
706	S	33.3	Very low	35.5	Very low	90 Å²	90	162.3 Å²	162.3	63%	0.629	83%	0.827	S	S	*	*			trans	-155.4	21.5	168.7	72.4	0	0	0	0	116.9	D704	D704-S706 VanDerWaalsContact C-N 3.29Å; D704-S706 PolarHBondContact O-N 2.84Å; D704-S706 VanDerWaalsContact O-N 3.14Å; D704-S706 PolarHBondContact OD1-OG 2.85Å
707	K	34.2	Very low	34.9	Very low	181 Å²	181	157.6 Å²	157.6	79%	0.787	82%	0.822	S	S	*	*	S	Bend	trans	-137.9	55.4	175.1	-72.6	-172.9	-178.8	167.4	0	114.9
708	S	33.1	Very low	34.4	Very low	116 Å²	116	157.1 Å²	157.1	81%	0.811	83%	0.826	S	S	*	*			trans	-147.9	59.6	169.7	-61.6	0	0	0	0	112.8
709	Q	35.7	Very low	34	Very low	191 Å²	191	158.7 Å²	158.7	89%	0.893	83%	0.834	S	S	*	*			trans	-169.2	88	157.7	-109.3	165.9	27.6	0	0	111.3
710	K	38.8	Very low	34.1	Very low	210 Å²	210	161 Å²	161	91%	0.913	84%	0.837	S	S	*	*			trans	-172.4	78.9	149	-106.5	173.7	-173.1	-179.2	0	108.9
711	K	34.2	Very low	33.9	Very low	208 Å²	208	165 Å²	165	90%	0.904	85%	0.849	S	S	*	*			trans	-170.9	82	153.9	-107.3	177.2	-175.3	-177.2	0	108.9
712	K	34.3	Very low	33.7	Very low	288 Å²	288	164.7 Å²	164.7	100%	1.252	85%	0.845	S	S	*	*			trans	-172	0	130.9	-102.6	177.7	-178.4	-177.1	0	108.4

Retrieved 712 of 712 residues in 385.2 ms (Link to these results)

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