A0A087Y751_POEFO Loading...

mRNA export factor GLE1

Required for the export of mRNAs containing poly(A) tails from the nucleus into the cytoplasm. May be involved in the terminal step of the mRNA transport through the nuclear pore complex (NPC).

AlphaFold DB , UniProt , Accession A0A087Y751, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 747 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	32.7	Very low	34.8	Very low	232 Å²	232	135.4 Å²	135.4	100%	1.143	76%	0.757	S	S	*	*				0	94.4	0	-176.2	177.7	-169	0	0	107
2	F	27.7	Very low	35.2	Very low	180 Å²	180	131.5 Å²	131.5	79%	0.789	74%	0.739	S	S	*	*			trans	59.2	163.1	-177.4	-75.3	-54.3	0	0	0	116.3	V4	F2-V4 HydrophobicContact CD1-CG2 3.36Å; F2-V4 HydrophobicContact CE1-CG2 3.72Å; F2-V4 HydrophobicContact CG-CG2 4.08Å
3	P	36.3	Very low	35.2	Very low	117 Å²	117	137.2 Å²	137.2	76%	0.76	74%	0.742	S	S	*	*			cis	-99.4	153.4	13.3	45.6	-38.5	0	0	0	112.6
4	V	33.6	Very low	35.2	Very low	118 Å²	118	140.4 Å²	140.4	72%	0.715	74%	0.738	S	S	*	*				46.9	117.9	65.9	-160.7	0	0	0	0	112.8	F2	F2-V4 HydrophobicContact CD1-CG2 3.36Å; F2-V4 HydrophobicContact CE1-CG2 3.72Å; F2-V4 HydrophobicContact CG-CG2 4.08Å
5	G	30.3	Very low	35.2	Very low	55 Å²	55	140.3 Å²	140.3	57%	0.567	74%	0.738	S	S	*	*			cis	173.6	97.2	-6	0	0	0	0	0	109.7	S7	G5-S7 VanDerWaalsContact C-N 3.29Å; G5-S7 PolarHBondContact O-N 2.75Å
6	L	33.4	Very low	35.1	Very low	191 Å²	191	140.2 Å²	140.2	100%	1	74%	0.737	S	S	*	*			trans	-73.8	82.7	174.7	-77.9	91.1	0	0	0	110
7	S	40.3	Very low	34.9	Very low	88 Å²	88	139.1 Å²	139.1	62%	0.615	73%	0.731	S	S	*	*			trans	-147.7	30.9	178	72.3	0	0	0	0	114.2	G5	G5-S7 VanDerWaalsContact C-N 3.29Å; G5-S7 PolarHBondContact O-N 2.75Å
8	F	36.2	Very low	34.8	Very low	175 Å²	175	140.1 Å²	140.1	77%	0.768	74%	0.736	S	S	*	*	S	Bend	trans	-128.1	-4.9	-178.9	-130.5	-94.2	0	0	0	116.4
9	C	38.4	Very low	34.8	Very low	120 Å²	120	137.1 Å²	137.1	81%	0.811	73%	0.733	S	S	*	*	S	Bend	trans	-94.8	-27.7	175.2	-73.1	0	0	0	0	114.6
10	E	36.1	Very low	34.8	Very low	141 Å²	141	136.3 Å²	136.3	66%	0.659	73%	0.734	S	S	*	*	H	α-helix	trans	-76.9	-32	178.7	-70.2	-165.3	94.3	0	0	113.4	V12 W13 R14	E10-V12 VanDerWaalsContact C-N 3.29Å; E10-V12 PolarHBondContact O-N 2.77Å; E10-W13 PolarHBondContact O-N 3.09Å; E10-R14 PolarHBondContact O-N 3.19Å
11	S	37.3	Very low	34.7	Very low	72 Å²	72	136.1 Å²	136.1	50%	0.503	73%	0.732	S	S	.	*	H	α-helix	trans	-68.1	-24.3	-173.7	-51.2	0	0	0	0	114
12	V	40.1	Very low	34.7	Very low	89 Å²	89	136 Å²	136	54%	0.539	72%	0.719	S	S	.	*	H	α-helix	trans	-83.7	-36.4	178	-176.1	0	0	0	0	111.3	E10 L15	E10-V12 VanDerWaalsContact C-N 3.29Å; E10-V12 PolarHBondContact O-N 2.77Å; V12-L15 PolarHBondContact O-N 2.93Å
13	W	34.6	Very low	34.7	Very low	206 Å²	206	137.5 Å²	137.5	78%	0.78	72%	0.72	S	S	*	*	H	α-helix	trans	-71.4	-30.7	178.7	-107.3	69.7	0	0	0	113.3	E10 L15 L17	E10-W13 PolarHBondContact O-N 3.09Å; W13-L15 VanDerWaalsContact C-N 3.3Å; W13-L15 PolarHBondContact O-N 3.44Å; W13-L17 HydrophobicContact CE3-CD1 4.4Å
14	R	35.7	Very low	34.4	Very low	182 Å²	182	140.7 Å²	140.7	69%	0.687	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-14.9	175.2	-70.3	-169.4	-179.5	-150.2	2.5	114.6	E10	E10-R14 PolarHBondContact O-N 3.19Å
15	L	35.6	Very low	34.2	Very low	139 Å²	139	143 Å²	143	73%	0.728	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-12.9	-179.6	-103.1	162.9	0	0	0	114.5	V12 W13	V12-L15 PolarHBondContact O-N 2.93Å; W13-L15 VanDerWaalsContact C-N 3.3Å; W13-L15 PolarHBondContact O-N 3.44Å
16	L	32.8	Very low	34.1	Very low	138 Å²	138	149.3 Å²	149.3	72%	0.723	74%	0.737	S	S	*	*	S	Bend	trans	-99.2	-8.9	176	-101.7	157.8	0	0	0	114
17	L	32.5	Very low	33.9	Very low	121 Å²	121	145.8 Å²	145.8	63%	0.634	72%	0.723	S	S	*	*	S	Bend	trans	-99.7	3.8	179.7	-102.9	158	0	0	0	114.3	W13	W13-L17 HydrophobicContact CE3-CD1 4.4Å
18	L	33	Very low	33.3	Very low	158 Å²	158	148.7 Å²	148.7	83%	0.827	73%	0.729	S	S	*	*	S	Bend	trans	-116.5	18	177.7	-78.1	167.2	0	0	0	113.2
19	A	34.6	Very low	33.3	Very low	82 Å²	82	145.6 Å²	145.6	68%	0.678	73%	0.727	S	S	*	*	S	Bend	trans	-114.1	8.6	-175.9	0	0	0	0	0	114.4
20	T	34.9	Very low	33.5	Very low	122 Å²	122	143.1 Å²	143.1	75%	0.748	71%	0.71	S	S	*	*	S	Bend	trans	-123.5	3.1	-175.3	44.2	0	0	0	0	115.1
21	D	33.7	Very low	33.8	Very low	132 Å²	132	143 Å²	143	71%	0.706	71%	0.71	S	S	*	*			trans	-111.6	72.3	177.1	-151.9	6.9	0	0	0	113.1
22	R	31.3	Very low	34	Very low	231 Å²	231	145.5 Å²	145.5	87%	0.872	72%	0.717	S	S	*	*			trans	-135.7	79.2	156.9	-79.2	-164.6	177.8	-168.3	0.8	109.3	F24	R22-F24 PolarHBondContact O-N 3.39Å; R22-F24 VanDerWaalsContact O-N 3.12Å
23	R	28.9	Very low	34.2	Very low	211 Å²	211	146 Å²	146	80%	0.796	72%	0.717	S	S	*	*			trans	-64.7	109.2	168.7	-58.3	-175.5	-164.8	-165.2	2.8	109.1	H25	R23-H25 PolarHBondContact O-N 3.27Å
24	F	28.9	Very low	34.9	Very low	184 Å²	184	145 Å²	145	81%	0.807	71%	0.713	S	S	*	*			trans	-67.3	110.6	163.7	-94	-93.9	0	0	0	108.6	R22 F26	R22-F24 PolarHBondContact O-N 3.39Å; R22-F24 VanDerWaalsContact O-N 3.12Å; F24-F26 PolarHBondContact O-N 3.02Å
25	H	30.3	Very low	35.7	Very low	165 Å²	165	145 Å²	145	76%	0.764	71%	0.713	S	S	*	*			trans	-69.2	97.2	168.6	-98.7	-87.9	0	0	0	109.5	R23	R23-H25 PolarHBondContact O-N 3.27Å
26	F	28	Very low	36.5	Very low	189 Å²	189	144.2 Å²	144.2	83%	0.829	71%	0.705	S	S	*	*			trans	-110.7	85.4	161.3	-119.2	-81.9	0	0	0	108.2	F24 M28	F24-F26 PolarHBondContact O-N 3.02Å; F26-M28 PolarHBondContact O-N 3.46Å; F26-M28 VanDerWaalsContact O-N 3.16Å
27	T	29.2	Very low	37.8	Very low	117 Å²	117	141.5 Å²	141.5	72%	0.718	70%	0.695	S	S	*	*			trans	-72.3	103	178.1	47.1	0	0	0	0	110.1
28	M	28.1	Very low	38.8	Very low	148 Å²	148	140.5 Å²	140.5	73%	0.729	69%	0.689	S	S	*	*			trans	-73.5	140.6	164.3	-81.8	-157.5	154.8	0	0	110.2	F26 S30	F26-M28 PolarHBondContact O-N 3.46Å; F26-M28 VanDerWaalsContact O-N 3.16Å; M28-S30 PolarHBondContact O-N 3.1Å
29	P	35	Very low	40.3	Very low	111 Å²	111	137.5 Å²	137.5	72%	0.721	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	1	-175.3	-21.8	34.3	0	0	0	116.3
30	S	43.3	Very low	41.7	Very low	67 Å²	67	136.7 Å²	136.7	47%	0.469	66%	0.664	S	S	.	*	H	α-helix	trans	-85.4	-14.5	-162.7	48.1	0	0	0	0	115.9	M28	M28-S30 PolarHBondContact O-N 3.1Å
31	E	42	Very low	42.5	Very low	140 Å²	140	136 Å²	136	65%	0.654	66%	0.655	S	S	*	*	H	α-helix	trans	-82.8	-39.1	-175.7	-62.3	-161.6	131.9	0	0	113.4	L33 R34	E31-L33 PolarHBondContact O-N 3.38Å; E31-R34 WeakPolarHBondContact O-CB 3.16Å; E31-R34 PolarHBondContact O-N 3.22Å
32	N	42.6	Very low	43.8	Very low	123 Å²	123	135.9 Å²	135.9	66%	0.658	65%	0.649	S	S	*	*	H	α-helix	trans	-63.1	-43.5	177.9	-69.2	2	0	0	0	111.7	R34 W35 E36	N32-R34 PolarHBondContact O-N 2.99Å; N32-R34 VanDerWaalsContact O-N 3.15Å; N32-W35 PolarHBondContact O-N 2.83Å; N32-E36 PolarHBondContact O-N 2.87Å; N32-E36 VanDerWaalsContact O-N 3.17Å
33	L	44.3	Very low	45.1	Very low	100 Å²	100	129.6 Å²	129.6	52%	0.524	63%	0.632	S	S	.	*	H	α-helix	trans	-58.2	-28.3	178.4	-69.7	168	0	0	0	113.2	E31 T37	E31-L33 PolarHBondContact O-N 3.38Å; L33-T37 VanDerWaalsContact O-CB 3.31Å; L33-T37 WeakPolarHBondContact O-CB 3.41Å; L33-T37 PolarHBondContact O-N 3.14Å; L33-T37 PolarHBondContact O-OG1 2.85Å
34	R	48.9	Very low	46.9	Very low	184 Å²	184	121.2 Å²	121.2	69%	0.694	61%	0.606	S	S	*	*	H	α-helix	trans	-68.3	-41.8	174.9	-84	-178.7	161	179.6	-5	112.3	E31 N32 T37 L38	E31-R34 WeakPolarHBondContact O-CB 3.16Å; E31-R34 PolarHBondContact O-N 3.22Å; N32-R34 PolarHBondContact O-N 2.99Å; N32-R34 VanDerWaalsContact O-N 3.15Å; R34-T37 PolarHBondContact O-N 3.25Å; R34-L38 WeakPolarHBondContact O-CG 3.33Å; R34-L38 PolarHBondContact O-N 2.96Å
35	W	52.6	Low	47.9	Very low	183 Å²	183	117.9 Å²	117.9	69%	0.693	60%	0.603	S	S	*	*	H	α-helix	trans	-69.9	-43.5	179.6	-68	105.7	0	0	0	111.4	N32 T37 L38 E39	N32-W35 PolarHBondContact O-N 2.83Å; W35-T37 VanDerWaalsContact C-N 3.31Å; W35-T37 PolarHBondContact O-N 3.14Å; W35-L38 HydrophobicContact CE3-CD1 4.37Å; W35-L38 PolarHBondContact O-N 3.07Å; W35-L38 VanDerWaalsContact O-N 3.17Å; W35-E39 PolarHBondContact O-N 3.36Å
36	E	52.6	Low	49.2	Very low	122 Å²	122	119 Å²	119	57%	0.57	61%	0.606	S	S	*	*	H	α-helix	trans	-58.8	-41.7	173.2	-66.8	172.8	168.2	0	0	111.8	N32 E39 A40	N32-E36 PolarHBondContact O-N 2.87Å; N32-E36 VanDerWaalsContact O-N 3.17Å; E36-E39 PolarHBondContact O-N 3.12Å; E36-A40 VanDerWaalsContact O-CB 3.28Å; E36-A40 WeakPolarHBondContact O-CB 3.39Å; E36-A40 PolarHBondContact O-N 2.81Å
37	T	58.4	Low	50.2	Low	82 Å²	82	112 Å²	112	50%	0.503	59%	0.587	S	S	.	*	H	α-helix	trans	-65.1	-38.7	176.2	-57.5	0	0	0	0	112.2	L33 R34 W35 A40 L41	L33-T37 VanDerWaalsContact O-CB 3.31Å; L33-T37 WeakPolarHBondContact O-CB 3.41Å; L33-T37 PolarHBondContact O-N 3.14Å; L33-T37 PolarHBondContact O-OG1 2.85Å; R34-T37 PolarHBondContact O-N 3.25Å; W35-T37 VanDerWaalsContact C-N 3.31Å; W35-T37 PolarHBondContact O-N 3.14Å; T37-A40 PolarHBondContact O-N 3.06Å; T37-L41 HydrophobicContact CG2-CD1 4.13Å; T37-L41 WeakPolarHBondContact O-CB 3.42Å; T37-L41 VanDerWaalsContact O-CG 3.27Å; T37-L41 WeakPolarHBondContact O-CG 3.42Å; T37-L41 PolarHBondContact O-N 3.28Å
38	L	54.5	Low	51.2	Low	99 Å²	99	112.8 Å²	112.8	52%	0.518	58%	0.583	S	S	.	*	H	α-helix	trans	-69.9	-40.9	177.1	-74	167.9	0	0	0	112.2	R34 W35 A40 L41 K42	R34-L38 WeakPolarHBondContact O-CG 3.33Å; R34-L38 PolarHBondContact O-N 2.96Å; W35-L38 HydrophobicContact CE3-CD1 4.37Å; W35-L38 PolarHBondContact O-N 3.07Å; W35-L38 VanDerWaalsContact O-N 3.17Å; L38-A40 VanDerWaalsContact C-N 3.34Å; L38-L41 PolarHBondContact O-N 2.67Å; L38-K42 WeakPolarHBondContact O-CB 3.49Å; L38-K42 PolarHBondContact O-N 3.3Å
39	E	64.9	Low	52.4	Low	96 Å²	96	111.1 Å²	111.1	45%	0.449	58%	0.581	S	S	.	*	H	α-helix	trans	-64.2	-40.1	174	-152.4	79.9	-112.1	0	0	110.8	W35 E36 K42 N43	W35-E39 PolarHBondContact O-N 3.36Å; E36-E39 PolarHBondContact O-N 3.12Å; E39-K42 PolarHBondContact O-N 2.72Å; E39-K42 IonicContact OE1-NZ 2.75Å; E39-K42 PolarHBondContact OE1-NZ 2.99Å; E39-N43 WeakPolarHBondContact O-CB 3.33Å; E39-N43 PolarHBondContact O-N 2.9Å; E39-N43 PolarHBondContact O-ND2 2.82Å
40	A	63.3	Low	52.8	Low	64 Å²	64	112.2 Å²	112.2	53%	0.529	59%	0.586	S	S	.	*	H	α-helix	trans	-66.7	-37.4	175.6	0	0	0	0	0	112.9	E36 T37 L38 S44	E36-A40 VanDerWaalsContact O-CB 3.28Å; E36-A40 WeakPolarHBondContact O-CB 3.39Å; E36-A40 PolarHBondContact O-N 2.81Å; T37-A40 PolarHBondContact O-N 3.06Å; L38-A40 VanDerWaalsContact C-N 3.34Å; A40-S44 PolarHBondContact O-N 3.2Å; A40-S44 VanDerWaalsContact O-N 3.07Å
41	L	52.4	Low	52.9	Low	107 Å²	107	116.6 Å²	116.6	56%	0.56	60%	0.596	S	S	*	*	H	α-helix	trans	-68.6	-38.4	174.7	-77.6	168.4	0	0	0	112.3	T37 L38 S44	T37-L41 HydrophobicContact CG2-CD1 4.13Å; T37-L41 WeakPolarHBondContact O-CB 3.42Å; T37-L41 VanDerWaalsContact O-CG 3.27Å; T37-L41 WeakPolarHBondContact O-CG 3.42Å; T37-L41 PolarHBondContact O-N 3.28Å; L38-L41 PolarHBondContact O-N 2.67Å; L41-S44 VanDerWaalsContact O-CB 3.26Å; L41-S44 WeakPolarHBondContact O-CB 3.48Å; L41-S44 PolarHBondContact O-N 3.32Å
42	K	61.3	Low	53.4	Low	131 Å²	131	112.9 Å²	112.9	57%	0.57	58%	0.581	S	S	*	*	H	α-helix	trans	-66.4	-36.6	175.3	178.6	-176.9	162.6	-155.1	0	112.5	L38 E39 S44	L38-K42 WeakPolarHBondContact O-CB 3.49Å; L38-K42 PolarHBondContact O-N 3.3Å; E39-K42 PolarHBondContact O-N 2.72Å; E39-K42 IonicContact OE1-NZ 2.75Å; E39-K42 PolarHBondContact OE1-NZ 2.99Å; K42-S44 VanDerWaalsContact C-N 3.35Å
43	N	58.3	Low	53.9	Low	98 Å²	98	111.2 Å²	111.2	52%	0.524	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.1	1.6	177.2	-65.3	-39.5	0	0	0	114	E39	E39-N43 WeakPolarHBondContact O-CB 3.33Å; E39-N43 PolarHBondContact O-N 2.9Å; E39-N43 PolarHBondContact O-ND2 2.82Å
44	S	65.6	Low	54	Low	36 Å²	36	113.1 Å²	113.1	25%	0.252	58%	0.578	S	S	.	*	S	Bend	trans	-70.9	149.4	173.4	177.1	0	0	0	0	111.4	A40 L41 K42 K46 G47 Q48	A40-S44 PolarHBondContact O-N 3.2Å; A40-S44 VanDerWaalsContact O-N 3.07Å; L41-S44 VanDerWaalsContact O-CB 3.26Å; L41-S44 WeakPolarHBondContact O-CB 3.48Å; L41-S44 PolarHBondContact O-N 3.32Å; K42-S44 VanDerWaalsContact C-N 3.35Å; S44-K46 PolarHBondContact O-N 3Å; S44-K46 PolarHBondContact OG-N 2.74Å; S44-G47 WeakPolarHBondContact O-CA 3.24Å; S44-G47 PolarHBondContact O-N 2.8Å; S44-Q48 PolarHBondContact O-N 2.82Å; S44-Q48 VanDerWaalsContact O-N 3.12Å
45	P	50.3	Low	54.4	Low	114 Å²	114	108.6 Å²	108.6	74%	0.74	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-16.5	169.7	24.7	-35	0	0	0	113.7
46	K	56.9	Low	54.1	Low	188 Å²	188	103.8 Å²	103.8	82%	0.817	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-15.1	169.8	-66	-168.7	176.7	-173.8	0	114.2	S44	S44-K46 PolarHBondContact O-N 3Å; S44-K46 PolarHBondContact OG-N 2.74Å
47	G	49.7	Very low	54.4	Low	43 Å²	43	105.6 Å²	105.6	44%	0.443	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.7	-24.2	173.7	0	0	0	0	0	113.5	S44 V49	S44-G47 WeakPolarHBondContact O-CA 3.24Å; S44-G47 PolarHBondContact O-N 2.8Å; G47-V49 PolarHBondContact O-N 3.02Å
48	Q	49.8	Very low	54.6	Low	132 Å²	132	108 Å²	108	62%	0.617	56%	0.564	S	S	*	*			trans	-83.3	20.3	179.8	-66.3	-173.6	-12.1	0	0	114.7	S44 T50	S44-Q48 PolarHBondContact O-N 2.82Å; S44-Q48 VanDerWaalsContact O-N 3.12Å; Q48-T50 PolarHBondContact O-N 2.99Å; Q48-T50 VanDerWaalsContact O-N 3.14Å
49	V	53.2	Low	54.4	Low	114 Å²	114	106.8 Å²	106.8	69%	0.691	58%	0.575	S	S	*	*			trans	-74.1	105.1	176.8	-177.4	0	0	0	0	109.5	G47 F51	G47-V49 PolarHBondContact O-N 3.02Å; V49-F51 PolarHBondContact O-N 3.41Å; V49-F51 VanDerWaalsContact O-N 3.14Å
50	T	45	Very low	53.8	Low	134 Å²	134	107.1 Å²	107.1	82%	0.822	58%	0.577	S	S	*	*			trans	-69.7	105.8	177.6	50.2	0	0	0	0	111.1	Q48 D52	Q48-T50 PolarHBondContact O-N 2.99Å; Q48-T50 VanDerWaalsContact O-N 3.14Å; T50-D52 PolarHBondContact O-N 2.97Å
51	F	45.3	Very low	53.3	Low	158 Å²	158	110.8 Å²	110.8	69%	0.693	58%	0.582	S	S	*	*			trans	-76.7	103.3	174.3	-175.3	-93.7	0	0	0	110.6	V49 P53 W55	V49-F51 PolarHBondContact O-N 3.41Å; V49-F51 VanDerWaalsContact O-N 3.14Å; F51-P53 WeakPolarHBondContact O-CD 3.37Å; F51-W55 AromaticContact CE2-NE1 3.79Å; F51-W55 AromaticContact CZ-NE1 3.87Å
52	D	52.2	Low	53.4	Low	62 Å²	62	111.5 Å²	111.5	33%	0.332	59%	0.585	S	S	.	*			trans	-75.2	115.6	166.5	170.5	12.1	0	0	0	109.2	T50 Y54 W55 R58	T50-D52 PolarHBondContact O-N 2.97Å; D52-Y54 PolarHBondContact O-N 2.91Å; D52-Y54 VanDerWaalsContact O-N 3.1Å; D52-Y54 PolarHBondContact OD1-N 3.36Å; D52-W55 VanDerWaalsContact O-CD1 3.28Å; D52-W55 PolarHBondContact O-N 3.36Å; D52-R58 IonicContact OD2-CZ 3.14Å; D52-R58 VanDerWaalsContact OD2-CZ 3.22Å; D52-R58 IonicContact OD2-NH1 2.66Å; D52-R58 PolarHBondContact OD2-NH1 2.94Å; D52-R58 IonicContact OD2-NH2 2.71Å; D52-R58 PolarHBondContact OD2-NH2 3.5Å
53	P	51.7	Low	52.8	Low	89 Å²	89	110.5 Å²	110.5	58%	0.578	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-22	-177.3	-24.2	35.5	0	0	0	114.9	F51	F51-P53 WeakPolarHBondContact O-CD 3.37Å
54	Y	47.6	Very low	52.5	Low	139 Å²	139	109.6 Å²	109.6	55%	0.545	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.4	9.2	-170.2	-55.7	-82.6	0	0	0	114	D52 S56 E57	D52-Y54 PolarHBondContact O-N 2.91Å; D52-Y54 VanDerWaalsContact O-N 3.1Å; D52-Y54 PolarHBondContact OD1-N 3.36Å; Y54-S56 PolarHBondContact O-N 3.23Å; Y54-E57 PolarHBondContact O-N 3.26Å; Y54-E57 VanDerWaalsContact O-N 3.09Å
55	W	56.9	Low	51.7	Low	89 Å²	89	111.1 Å²	111.1	34%	0.337	61%	0.613	S	S	.	*	G	3₁₀ helix	trans	-55.3	-37.1	-179.2	73.4	-95.5	0	0	0	113	F51 D52 E57 R58 I62	F51-W55 AromaticContact CE2-NE1 3.79Å; F51-W55 AromaticContact CZ-NE1 3.87Å; D52-W55 VanDerWaalsContact O-CD1 3.28Å; D52-W55 PolarHBondContact O-N 3.36Å; W55-E57 VanDerWaalsContact C-N 3.3Å; W55-E57 PolarHBondContact O-N 3.4Å; W55-R58 PolarHBondContact O-N 3.1Å; W55-I62 HydrophobicContact CD2-CG1 4.28Å; W55-I62 HydrophobicContact CE3-CG1 3.86Å; W55-I62 HydrophobicContact CH2-CD1 3.56Å; W55-I62 HydrophobicContact CH2-CG1 3.52Å; W55-I62 HydrophobicContact CZ2-CD1 3.84Å; W55-I62 HydrophobicContact CZ2-CG1 3.93Å; W55-I62 HydrophobicContact CZ3-CD1 4.06Å; W55-I62 HydrophobicContact CZ3-CG1 3.47Å; W55-I62 VanDerWaalsContact CZ3-CG1 3.47Å
56	S	47	Very low	51.3	Low	82 Å²	82	110.1 Å²	110.1	57%	0.573	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-68.8	-25.3	-178.7	-172.7	0	0	0	0	113.4	Y54	Y54-S56 PolarHBondContact O-N 3.23Å
57	E	57.3	Low	50.8	Low	160 Å²	160	111.3 Å²	111.3	75%	0.748	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-81.9	-17.9	-176.5	-61.7	-174.1	162.1	0	0	112.4	Y54 W55	Y54-E57 PolarHBondContact O-N 3.26Å; Y54-E57 VanDerWaalsContact O-N 3.09Å; W55-E57 VanDerWaalsContact C-N 3.3Å; W55-E57 PolarHBondContact O-N 3.4Å
58	R	63.2	Low	50.5	Low	134 Å²	134	117.6 Å²	117.6	51%	0.506	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.7	-6	178.2	-59.2	-168.3	-60.6	-95	4.8	114	D52 W55 E60	D52-R58 IonicContact OD2-CZ 3.14Å; D52-R58 VanDerWaalsContact OD2-CZ 3.22Å; D52-R58 IonicContact OD2-NH1 2.66Å; D52-R58 PolarHBondContact OD2-NH1 2.94Å; D52-R58 IonicContact OD2-NH2 2.71Å; D52-R58 PolarHBondContact OD2-NH2 3.5Å; W55-R58 PolarHBondContact O-N 3.1Å; R58-E60 VanDerWaalsContact C-N 3.26Å; R58-E60 HydrophobicContact CB-CG 4.14Å; R58-E60 IonicContact CZ-OE2 3.64Å; R58-E60 IonicContact NE-OE2 3.61Å; R58-E60 PolarHBondContact NE-OE2 3.4Å; R58-E60 IonicContact NH2-OE2 2.73Å; R58-E60 PolarHBondContact O-N 2.92Å
59	G	50.9	Low	49.9	Very low	73 Å²	73	117.6 Å²	117.6	75%	0.753	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.9	15	179.7	0	0	0	0	0	114.8
60	E	52.1	Low	49.2	Very low	103 Å²	103	118.6 Å²	118.6	48%	0.481	65%	0.649	S	S	.	*			trans	-85.1	140.3	-177.6	-61.6	178.3	122.5	0	0	111.2	R58	R58-E60 VanDerWaalsContact C-N 3.26Å; R58-E60 HydrophobicContact CB-CG 4.14Å; R58-E60 IonicContact CZ-OE2 3.64Å; R58-E60 IonicContact NE-OE2 3.61Å; R58-E60 PolarHBondContact NE-OE2 3.4Å; R58-E60 IonicContact NH2-OE2 2.73Å; R58-E60 PolarHBondContact O-N 2.92Å
61	H	53.4	Low	49.2	Very low	140 Å²	140	117.5 Å²	117.5	65%	0.648	65%	0.647	S	S	*	*			trans	-72.1	138.3	176.6	-175.2	-106.7	0	0	0	110.6	L63 A64	H61-L63 PolarHBondContact O-N 2.91Å; H61-A64 WeakPolarHBondContact O-CB 3.26Å; H61-A64 PolarHBondContact O-N 3.21Å
62	I	53.5	Low	49	Very low	122 Å²	122	116.5 Å²	116.5	63%	0.626	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.2	-26.3	-172.4	-60.2	173.3	0	0	0	114.1	W55	W55-I62 HydrophobicContact CD2-CG1 4.28Å; W55-I62 HydrophobicContact CE3-CG1 3.86Å; W55-I62 HydrophobicContact CH2-CD1 3.56Å; W55-I62 HydrophobicContact CH2-CG1 3.52Å; W55-I62 HydrophobicContact CZ2-CD1 3.84Å; W55-I62 HydrophobicContact CZ2-CG1 3.93Å; W55-I62 HydrophobicContact CZ3-CD1 4.06Å; W55-I62 HydrophobicContact CZ3-CG1 3.47Å; W55-I62 VanDerWaalsContact CZ3-CG1 3.47Å
63	L	49.2	Very low	48.7	Very low	110 Å²	110	117.3 Å²	117.3	58%	0.576	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	9.2	-178.4	-56.9	177.2	0	0	0	114.4	H61 G65 C66	H61-L63 PolarHBondContact O-N 2.91Å; L63-G65 VanDerWaalsContact C-N 3.27Å; L63-G65 PolarHBondContact O-N 3.12Å; L63-C66 PolarHBondContact O-N 3.37Å
64	A	50.9	Low	48.4	Very low	79 Å²	79	118.2 Å²	118.2	65%	0.653	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	76.9	-179.9	0	0	0	0	0	112	H61	H61-A64 WeakPolarHBondContact O-CB 3.26Å; H61-A64 PolarHBondContact O-N 3.21Å
65	G	49.3	Very low	48.3	Very low	68 Å²	68	118.6 Å²	118.6	70%	0.701	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	163	-24	-177.6	0	0	0	0	0	113.1	L63 K67	L63-G65 VanDerWaalsContact C-N 3.27Å; L63-G65 PolarHBondContact O-N 3.12Å; G65-K67 PolarHBondContact O-N 2.79Å
66	C	42.5	Very low	47.7	Very low	94 Å²	94	116 Å²	116	64%	0.635	67%	0.669	S	S	*	*			trans	-69.5	95.5	177.2	-64.3	0	0	0	0	111.4	L63 E68	L63-C66 PolarHBondContact O-N 3.37Å; C66-E68 VanDerWaalsContact C-N 3.34Å
67	K	45.6	Very low	47.3	Very low	213 Å²	213	115.1 Å²	115.1	93%	0.926	67%	0.667	S	S	*	*			trans	-87	7.1	176.7	-82	-171.9	173.7	-178.4	0	115.2	G65	G65-K67 PolarHBondContact O-N 2.79Å
68	E	43.4	Very low	46.7	Very low	175 Å²	175	111.1 Å²	111.1	82%	0.818	65%	0.653	S	S	*	*	S	Bend	trans	-118.5	130.7	178.6	-64.6	-173	165.3	0	0	111.4	C66	C66-E68 VanDerWaalsContact C-N 3.34Å
69	T	37.6	Very low	45.6	Very low	132 Å²	132	110.3 Å²	110.3	81%	0.81	66%	0.658	S	S	*	*			trans	-70.3	127.6	173.7	48.6	0	0	0	0	110.1	S71	T69-S71 PolarHBondContact O-N 3.45Å
70	P	39.1	Very low	45	Very low	134 Å²	134	111.5 Å²	111.5	87%	0.87	65%	0.646	S	S	*	*			trans	-71.9	98.9	-174.9	28.7	-35	0	0	0	111.6
71	S	43.7	Very low	44.5	Very low	112 Å²	112	113.9 Å²	113.9	78%	0.783	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-75.6	138.1	167.3	52.9	0	0	0	0	110.8	T69	T69-S71 PolarHBondContact O-N 3.45Å
72	L	41.7	Very low	43.8	Very low	137 Å²	137	116.6 Å²	116.6	72%	0.717	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-74.7	148.9	167.7	-68.6	172.9	0	0	0	109.4
73	S	46.2	Very low	43.2	Very low	79 Å²	79	116 Å²	116	55%	0.552	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-72.4	154.7	173.9	77.5	0	0	0	0	110.3	H75 S76	S73-H75 PolarHBondContact O-N 3.09Å; S73-S76 WeakPolarHBondContact O-CB 3.43Å; S73-S76 PolarHBondContact O-N 2.95Å; S73-S76 PolarHBondContact O-OG 3.43Å
74	S	46.4	Very low	42.6	Very low	108 Å²	108	117.1 Å²	117.1	76%	0.755	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-16.5	-177.8	52.5	0	0	0	0	114.4
75	H	43.5	Very low	41.9	Very low	146 Å²	146	117.8 Å²	117.8	68%	0.676	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-13.3	173.3	-86	51.3	0	0	0	114.3	S73	S73-H75 PolarHBondContact O-N 3.09Å
76	S	44.4	Very low	41.2	Very low	35 Å²	35	125.5 Å²	125.5	25%	0.245	67%	0.673	C	S	.	*	S	Bend	trans	-69.5	-33	-179.6	-57.7	0	0	0	0	113.2	S73 V78 I79	S73-S76 WeakPolarHBondContact O-CB 3.43Å; S73-S76 PolarHBondContact O-N 2.95Å; S73-S76 PolarHBondContact O-OG 3.43Å; S76-V78 PolarHBondContact O-N 2.95Å; S76-I79 PolarHBondContact O-N 3.4Å
77	A	39.8	Very low	40.7	Very low	63 Å²	63	125.9 Å²	125.9	52%	0.521	68%	0.677	S	S	.	*	H	α-helix	trans	-62.6	-42.7	-178.3	0	0	0	0	0	112.8	I79 L80 E81	A77-I79 PolarHBondContact O-N 3.28Å; A77-I79 VanDerWaalsContact O-N 3.11Å; A77-L80 PolarHBondContact O-N 3.35Å; A77-L80 VanDerWaalsContact O-N 3.14Å; A77-E81 PolarHBondContact O-N 3Å
78	V	43.4	Very low	39.9	Very low	77 Å²	77	123.8 Å²	123.8	47%	0.467	68%	0.675	S	S	.	*	H	α-helix	trans	-63.7	-19.7	-176.5	-175	0	0	0	0	112.9	S76	S76-V78 PolarHBondContact O-N 2.95Å
79	I	40	Very low	39.2	Very low	116 Å²	116	123.1 Å²	123.1	60%	0.595	68%	0.677	S	S	*	*	H	α-helix	trans	-86.6	-37.9	177.8	-61.6	178.7	0	0	0	111.1	S76 A77 I83	S76-I79 PolarHBondContact O-N 3.4Å; A77-I79 PolarHBondContact O-N 3.28Å; A77-I79 VanDerWaalsContact O-N 3.11Å; I79-I83 HydrophobicContact CG2-CD1 4.41Å; I79-I83 WeakPolarHBondContact O-CG1 3.48Å
80	L	38.5	Very low	38.8	Very low	98 Å²	98	125.9 Å²	125.9	51%	0.513	68%	0.678	S	S	.	*	H	α-helix	trans	-69	-44.7	179.1	-69.7	165.7	0	0	0	111.6	A77 R82 I83 D84	A77-L80 PolarHBondContact O-N 3.35Å; A77-L80 VanDerWaalsContact O-N 3.14Å; L80-R82 PolarHBondContact O-N 2.9Å; L80-I83 PolarHBondContact O-N 2.95Å; L80-D84 PolarHBondContact O-N 2.78Å
81	E	41.9	Very low	38.1	Very low	153 Å²	153	125.4 Å²	125.4	72%	0.715	68%	0.678	S	S	*	*	H	α-helix	trans	-61.3	-21.4	-179.8	-160.2	171	-131.5	0	0	113.3	A77 S85	A77-E81 PolarHBondContact O-N 3Å; E81-S85 PolarHBondContact O-OG 3.46Å
82	R	39.5	Very low	37.3	Very low	198 Å²	198	124.8 Å²	124.8	75%	0.747	67%	0.674	S	S	*	*	H	α-helix	trans	-87.6	-6.5	174.6	-74.9	-176.9	171.9	-174.7	-0.9	114.9	L80	L80-R82 PolarHBondContact O-N 2.9Å
83	I	40	Very low	36.4	Very low	110 Å²	110	127.4 Å²	127.4	56%	0.564	68%	0.679	S	S	*	*	H	α-helix	trans	-97.9	-47.3	179.4	-67.7	168.9	0	0	0	110	I79 L80 S85	I79-I83 HydrophobicContact CG2-CD1 4.41Å; I79-I83 WeakPolarHBondContact O-CG1 3.48Å; L80-I83 PolarHBondContact O-N 2.95Å; I83-S85 VanDerWaalsContact C-N 3.27Å; I83-S85 PolarHBondContact O-N 2.86Å
84	D	37.5	Very low	35.4	Very low	133 Å²	133	131 Å²	131	71%	0.711	69%	0.692	S	S	*	*	H	α-helix	trans	-71.4	-20.1	-175.1	-64	-34	0	0	0	113.8	L80 R86	L80-D84 PolarHBondContact O-N 2.78Å; D84-R86 VanDerWaalsContact C-N 3.26Å; D84-R86 PolarHBondContact O-N 2.94Å
85	S	35.4	Very low	34.3	Very low	93 Å²	93	132.8 Å²	132.8	65%	0.65	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	4.1	-177.5	43.5	0	0	0	0	115.1	E81 I83	E81-S85 PolarHBondContact O-OG 3.46Å; I83-S85 VanDerWaalsContact C-N 3.27Å; I83-S85 PolarHBondContact O-N 2.86Å
86	R	35.9	Very low	33.4	Very low	229 Å²	229	130.6 Å²	130.6	86%	0.864	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.7	12.4	-171.9	-132.2	-177.5	-170.8	-161.8	2.1	119.4	D84	D84-R86 VanDerWaalsContact C-N 3.26Å; D84-R86 PolarHBondContact O-N 2.94Å
87	S	31.5	Very low	32.5	Very low	103 Å²	103	134 Å²	134	72%	0.72	72%	0.717	S	S	*	*			trans	-166.3	107.8	156.8	55.8	0	0	0	0	113.5
88	L	29.3	Very low	31.7	Very low	168 Å²	168	135.5 Å²	135.5	88%	0.88	72%	0.724	S	S	*	*			trans	-167.4	96.5	151.2	-112.5	162.9	0	0	0	111.5
89	N	28.4	Very low	31	Very low	161 Å²	161	138.9 Å²	138.9	86%	0.861	74%	0.738	S	S	*	*			trans	-124.8	89.6	165.9	-136.6	-14.4	0	0	0	108.7
90	K	29.5	Very low	30.3	Very low	191 Å²	191	139.6 Å²	139.6	83%	0.83	74%	0.743	S	S	*	*			trans	37.5	112.2	168.9	-66.7	-179.5	176.6	178.3	0	119.2
91	S	24.3	Very low	29.7	Very low	123 Å²	123	143.3 Å²	143.3	86%	0.86	76%	0.756	S	S	*	*				-141	149.9	112.5	64.7	0	0	0	0	109.7
92	S	25.1	Very low	29	Very low	100 Å²	100	144 Å²	144	70%	0.699	76%	0.759	S	S	*	*			trans	-120	150.7	-170.1	53.4	0	0	0	0	111
93	F	23.1	Very low	28.3	Very low	191 Å²	191	143.3 Å²	143.3	84%	0.838	76%	0.764	S	S	*	*			trans	-166.1	119.5	135.2	-103.9	-67.3	0	0	0	112.5
94	L	26.5	Very low	27.5	Very low	156 Å²	156	147.1 Å²	147.1	82%	0.817	78%	0.777	S	S	*	*			trans	28.5	135.2	151.2	-62	172.2	0	0	0	122.4
95	D	22.6	Very low	27.5	Very low	144 Å²	144	146.1 Å²	146.1	77%	0.77	78%	0.777	S	S	*	*				-156.3	146.4	98.2	-152.1	-31.3	0	0	0	111.9
96	S	24.8	Very low	26.9	Very low	101 Å²	101	145.9 Å²	145.9	71%	0.706	78%	0.781	S	S	*	*			trans	53	147.3	161.3	-67.4	0	0	0	0	119.9
97	S	24.7	Very low	26.4	Very low	105 Å²	105	139.8 Å²	139.8	73%	0.734	77%	0.774	S	S	*	*			cis	-178.2	160.8	-1.1	46.4	0	0	0	0	107
98	S	24.3	Very low	26.2	Very low	96 Å²	96	141 Å²	141	67%	0.671	78%	0.776	S	S	*	*			cis	-176.9	-179	-6.5	46.5	0	0	0	0	108.3
99	I	28.1	Very low	25.9	Very low	148 Å²	148	137.7 Å²	137.7	76%	0.759	77%	0.768	S	S	*	*			trans	73.3	134.8	168.8	-57.7	167.6	0	0	0	115.1
100	D	25.1	Very low	25.7	Very low	131 Å²	131	134.8 Å²	134.8	70%	0.701	76%	0.76	S	S	*	*			cis	-164.9	177.7	-25.4	-102.6	-36.5	0	0	0	110.5
101	F	26.7	Very low	25.6	Very low	175 Å²	175	129.9 Å²	129.9	77%	0.768	75%	0.749	S	S	*	*			trans	85.2	119.1	166.2	-71.1	-82.7	0	0	0	120.9
102	E	26.1	Very low	25.5	Very low	169 Å²	169	132.6 Å²	132.6	79%	0.79	75%	0.748	S	S	*	*			trans	37.1	144.6	137.1	-64.5	173.5	153.9	0	0	121.3
103	E	25.1	Very low	25.5	Very low	183 Å²	183	131.8 Å²	131.8	86%	0.855	74%	0.743	S	S	*	*			cis	-145.2	-167.6	17.9	-144.7	179	177.9	0	0	112.6
104	K	23.1	Very low	25.6	Very low	189 Å²	189	129.3 Å²	129.3	82%	0.822	74%	0.743	S	S	*	*			trans	-140.3	174.1	-174.7	-113.5	-176.4	-175.6	174.7	0	109.3
105	P	37.3	Very low	25.6	Very low	112 Å²	112	126.7 Å²	126.7	73%	0.727	74%	0.744	S	S	*	*			cis	-136.5	-158	1	39.8	-18.7	0	0	0	114.4
106	A	23.9	Very low	25.6	Very low	89 Å²	89	126.7 Å²	126.7	74%	0.736	75%	0.745	S	S	*	*			trans	78.9	153.7	153.7	0	0	0	0	0	119.5
107	S	25	Very low	25.8	Very low	101 Å²	101	128.5 Å²	128.5	71%	0.706	75%	0.746	S	S	*	*			cis	-172.9	178.9	-30	56.9	0	0	0	0	109.5
108	V	26.3	Very low	25.7	Very low	127 Å²	127	130.9 Å²	130.9	77%	0.77	75%	0.75	S	S	*	*			trans	65.9	94	164.1	-179.8	0	0	0	0	114.9
109	S	24.6	Very low	25.8	Very low	100 Å²	100	130.6 Å²	130.6	70%	0.699	75%	0.748	S	S	*	*				87.4	152.2	74	78.3	0	0	0	0	116.2
110	S	24.6	Very low	25.7	Very low	100 Å²	100	132.1 Å²	132.1	70%	0.699	75%	0.749	S	S	*	*			trans	-7.7	154	160.5	61.3	0	0	0	0	120
111	S	25.7	Very low	25.8	Very low	87 Å²	87	133 Å²	133	61%	0.608	75%	0.752	S	S	*	*			cis	-160.5	169.6	41.1	-52.9	0	0	0	0	114.2
112	E	23.1	Very low	25.7	Very low	180 Å²	180	130.1 Å²	130.1	84%	0.841	75%	0.754	S	S	*	*			trans	38.5	156.3	132.8	-67	167.9	148.9	0	0	123.1
113	S	25	Very low	25.7	Very low	83 Å²	83	126 Å²	126	58%	0.58	75%	0.749	S	S	*	*			cis	-178.5	167.5	-24.7	61.2	0	0	0	0	110.3
114	T	24.1	Very low	25.7	Very low	139 Å²	139	125.1 Å²	125.1	85%	0.853	75%	0.749	S	S	*	*			trans	67.8	160.6	167.4	74.6	0	0	0	0	116.6
115	A	26.8	Very low	25.7	Very low	101 Å²	101	121 Å²	121	84%	0.835	74%	0.744	S	S	*	*			cis	-137.2	167.7	7.1	0	0	0	0	0	112.7
116	D	23.5	Very low	25.1	Very low	145 Å²	145	120.8 Å²	120.8	78%	0.775	75%	0.745	S	S	*	*			trans	-111.3	155.5	-164.7	-130.2	-29	0	0	0	114.8
117	L	27.8	Very low	25.1	Very low	139 Å²	139	121.1 Å²	121.1	73%	0.728	75%	0.748	S	S	*	*			trans	20.8	129.2	154	-71.4	159.5	0	0	0	122
118	N	24.6	Very low	25.4	Very low	154 Å²	154	122.8 Å²	122.8	82%	0.824	76%	0.756	S	S	*	*				162.1	140.9	117.5	-89.6	-67.8	0	0	0	109.9
119	S	26.3	Very low	25.2	Very low	90 Å²	90	121.6 Å²	121.6	63%	0.629	75%	0.754	S	S	*	*			cis	-159.7	-158.4	-0.6	51.6	0	0	0	0	107.6
120	K	25.7	Very low	25.2	Very low	180 Å²	180	124.2 Å²	124.2	78%	0.783	76%	0.759	S	S	*	*			cis	-162.9	112.6	13.5	-147.5	167.7	-168.7	172.5	0	113.2
121	I	26.7	Very low	25.2	Very low	149 Å²	149	128.3 Å²	128.3	76%	0.764	76%	0.764	S	S	*	*			trans	32.5	122.5	136	-58.8	171.5	0	0	0	120.3
122	S	24.5	Very low	25.1	Very low	116 Å²	116	130.8 Å²	130.8	81%	0.811	77%	0.771	S	S	*	*			trans	73	150	151.2	-72.1	0	0	0	0	120.4
123	A	25.2	Very low	25.1	Very low	82 Å²	82	130.8 Å²	130.8	68%	0.678	77%	0.771	S	S	*	*			cis	-164.7	163.4	-9.2	0	0	0	0	0	114.2
124	L	25.8	Very low	25.7	Very low	164 Å²	164	131.3 Å²	131.3	86%	0.859	77%	0.772	S	S	*	*			trans	71	134.2	152.8	-101.9	79.2	0	0	0	123.4
125	S	23.1	Very low	25.8	Very low	102 Å²	102	133 Å²	133	71%	0.713	77%	0.768	S	S	*	*			trans	103.1	97.7	136.5	72	0	0	0	0	121.8
126	S	25.1	Very low	25.7	Very low	109 Å²	109	133.6 Å²	133.6	76%	0.762	76%	0.757	S	S	*	*				38.8	120.4	127.8	59.8	0	0	0	0	123.1
127	A	24.6	Very low	25.7	Very low	95 Å²	95	133 Å²	133	79%	0.785	76%	0.758	S	S	*	*			trans	57.8	141.1	133.9	0	0	0	0	0	120.4
128	P	29.7	Very low	25.6	Very low	136 Å²	136	131.8 Å²	131.8	88%	0.883	76%	0.761	S	S	*	*				-141.9	-172.5	94.7	39.8	-26.3	0	0	0	114
129	S	21.8	Very low	25.7	Very low	103 Å²	103	127.4 Å²	127.4	72%	0.72	75%	0.752	S	S	*	*			trans	-135.1	145.4	-178.6	-171.6	0	0	0	0	112.7
130	L	25.6	Very low	25.7	Very low	155 Å²	155	129.2 Å²	129.2	81%	0.812	77%	0.765	S	S	*	*			trans	36.9	114.6	157.2	-70.3	166.3	0	0	0	120
131	K	25	Very low	25.9	Very low	186 Å²	186	128.3 Å²	128.3	81%	0.809	77%	0.768	S	S	*	*				-179.3	145.6	106.4	-98.4	169.5	-176.9	176.5	0	115.9
132	N	24	Very low	26.4	Very low	138 Å²	138	127.1 Å²	127.1	74%	0.738	77%	0.77	S	S	*	*			trans	55.2	106.6	144.8	-57.6	3.8	0	0	0	122.3
133	Q	23.4	Very low	26.6	Very low	181 Å²	181	130.1 Å²	130.1	85%	0.846	77%	0.768	S	S	*	*				20.4	159.6	109.5	-82.1	-161.4	39.8	0	0	121.5
134	P	36.4	Very low	26.8	Very low	93 Å²	93	133.7 Å²	133.7	60%	0.604	78%	0.775	S	S	*	*			cis	-141.1	-165	-12.1	31.8	-7.5	0	0	0	114.9
135	K	25.8	Very low	26.9	Very low	175 Å²	175	130.2 Å²	130.2	76%	0.761	77%	0.765	S	S	*	*			trans	77.1	154.9	159.1	-65.8	-175.4	154.1	-120.7	0	118.5
136	D	24.8	Very low	27.1	Very low	113 Å²	113	132 Å²	132	60%	0.604	77%	0.766	S	S	*	*			cis	-159.3	150.2	-15.9	-107	-24.8	0	0	0	110.3
137	V	24.5	Very low	27.5	Very low	132 Å²	132	134.6 Å²	134.6	80%	0.8	77%	0.766	S	S	*	*			trans	67	137.8	145.7	172.8	0	0	0	0	122.9
138	S	25.1	Very low	27.8	Very low	115 Å²	115	135.9 Å²	135.9	80%	0.804	76%	0.764	S	S	*	*			trans	71.2	141.8	166	-144.9	0	0	0	0	118.3
139	G	26.5	Very low	27.8	Very low	61 Å²	61	140.9 Å²	140.9	63%	0.629	77%	0.765	S	S	*	*			cis	123.8	101.6	-9.2	0	0	0	0	0	114.6
140	S	25.9	Very low	28.1	Very low	129 Å²	129	139.4 Å²	139.4	90%	0.902	77%	0.766	S	S	*	*			trans	-179.3	149.9	156.1	-83.2	0	0	0	0	111.7
141	L	31	Very low	28.4	Very low	161 Å²	161	139.9 Å²	139.9	84%	0.843	77%	0.765	S	S	*	*			trans	-105.4	159.7	169.5	-130.4	87.3	0	0	0	109.5
142	P	36.5	Very low	28.8	Very low	123 Å²	123	135.6 Å²	135.6	80%	0.799	76%	0.758	S	S	*	*				-154.1	141.3	107.6	36.1	-17.2	0	0	0	118.6
143	K	28.1	Very low	29.7	Very low	179 Å²	179	134.9 Å²	134.9	78%	0.778	76%	0.761	S	S	*	*			trans	35	133.2	135.8	-73.3	-169.8	169	-171.7	0	124.6
144	L	29.3	Very low	30.1	Very low	157 Å²	157	135.4 Å²	135.4	82%	0.822	76%	0.763	S	S	*	*			trans	65.2	151.8	138.9	-88.1	71.2	0	0	0	119
145	S	28.2	Very low	29.8	Very low	92 Å²	92	135.8 Å²	135.8	64%	0.643	77%	0.774	S	S	*	*			cis	-142.1	-153.9	-2.4	48.8	0	0	0	0	109.4
146	D	28.5	Very low	30	Very low	138 Å²	138	134.5 Å²	134.5	74%	0.738	78%	0.776	S	S	*	*			cis	-160	-175.7	10.9	-137.8	-61.8	0	0	0	112.1
147	E	32.2	Very low	30.5	Very low	165 Å²	165	135.6 Å²	135.6	77%	0.771	79%	0.786	S	S	*	*			trans	-97.6	177.2	-173.9	-47.8	-172.6	137	0	0	115.2
148	T	31.7	Very low	30.8	Very low	121 Å²	121	133.9 Å²	133.9	74%	0.742	78%	0.78	S	S	*	*				-178.2	155.2	83	28.2	0	0	0	0	115
149	R	29.3	Very low	31.1	Very low	241 Å²	241	136.7 Å²	136.7	91%	0.909	78%	0.781	S	S	*	*			trans	66.1	148.6	166.5	-70.2	177.7	162.2	-168	-8.8	117.2
150	G	27.6	Very low	31.6	Very low	72 Å²	72	140 Å²	140	74%	0.742	79%	0.788	S	S	*	*			cis	154.9	157.2	0.8	0	0	0	0	0	109.1
151	E	32.4	Very low	31.8	Very low	165 Å²	165	139.5 Å²	139.5	77%	0.771	78%	0.782	S	S	*	*			cis	-168.5	165.2	6.3	-155.9	-175.6	-110.2	0	0	110.4
152	S	33.3	Very low	32.1	Very low	96 Å²	96	135 Å²	135	67%	0.671	77%	0.768	S	S	*	*			trans	74.6	151.3	150.6	-72.7	0	0	0	0	121.9
153	P	43.9	Very low	32.3	Very low	124 Å²	124	134.8 Å²	134.8	81%	0.805	77%	0.767	S	S	*	*			cis	-133.5	173.1	-24.2	37.5	-20.2	0	0	0	114.8
154	E	31.5	Very low	32.8	Very low	191 Å²	191	131.7 Å²	131.7	89%	0.893	77%	0.765	S	S	*	*			trans	-82.7	160.3	-179.7	-57.8	-177.8	140.4	0	0	114.6
155	A	30.2	Very low	33.4	Very low	101 Å²	101	129 Å²	129	84%	0.835	76%	0.76	S	S	*	*			trans	-152.8	105.9	149.1	0	0	0	0	0	110
156	D	30.5	Very low	34	Very low	149 Å²	149	130.1 Å²	130.1	80%	0.797	76%	0.764	S	S	*	*			trans	-81.8	127.2	175.1	172.6	23.2	0	0	0	111.2	S158	D156-S158 PolarHBondContact OD1-N 2.9Å; D156-S158 VanDerWaalsContact OD1-N 3.17Å
157	V	34.4	Very low	34.8	Very low	135 Å²	135	128.7 Å²	128.7	82%	0.818	76%	0.763	S	S	*	*			trans	-142.7	83.4	161.2	-170.8	0	0	0	0	110.9
158	S	31.1	Very low	35	Very low	96 Å²	96	125 Å²	125	67%	0.671	76%	0.76	S	S	*	*				65.6	171.1	128.9	-153.2	0	0	0	0	120.8	D156	D156-S158 PolarHBondContact OD1-N 2.9Å; D156-S158 VanDerWaalsContact OD1-N 3.17Å
159	E	31.8	Very low	35.7	Very low	174 Å²	174	126.1 Å²	126.1	81%	0.813	76%	0.76	S	S	*	*			trans	57.7	72.1	170.8	-56.9	-151.9	144.9	0	0	117.4	P161	E159-P161 VanDerWaalsContact O-CD 3.26Å; E159-P161 WeakPolarHBondContact O-CD 3.38Å
160	V	35.8	Very low	36.6	Very low	130 Å²	130	118.7 Å²	118.7	79%	0.788	75%	0.745	S	S	*	*			trans	-35.6	115.9	141.3	171.4	0	0	0	0	111.3	A162	V160-A162 PolarHBondContact O-N 3.17Å
161	P	31.6	Very low	37.7	Very low	119 Å²	119	122.4 Å²	122.4	77%	0.773	75%	0.747	S	S	*	*			trans	-70.3	114	149.7	-1	19.3	0	0	0	105.9	E159	E159-P161 VanDerWaalsContact O-CD 3.26Å; E159-P161 WeakPolarHBondContact O-CD 3.38Å
162	A	35.4	Very low	38.6	Very low	66 Å²	66	119.5 Å²	119.5	55%	0.545	74%	0.737	S	S	.	*	P	Polyproline II helix	trans	-55.3	153.1	168.5	0	0	0	0	0	109.2	V160	V160-A162 PolarHBondContact O-N 3.17Å
163	P	42.7	Very low	39.9	Very low	120 Å²	120	118.1 Å²	118.1	78%	0.779	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-51.2	123.3	163.7	24.2	-33.4	0	0	0	107.1	S165	P163-S165 PolarHBondContact O-N 3.02Å
164	P	38.5	Very low	41.2	Very low	114 Å²	114	117 Å²	117	74%	0.74	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-56.9	139.4	-172.2	21.4	-32.6	0	0	0	109
165	S	41.8	Very low	43.1	Very low	101 Å²	101	117.2 Å²	117.2	71%	0.706	71%	0.712	S	S	*	*	S	Bend	trans	-47.4	134	174.4	43.7	0	0	0	0	109	P163 P167	P163-S165 PolarHBondContact O-N 3.02Å; S165-P167 WeakPolarHBondContact O-CA 3.42Å
166	P	40.9	Very low	45.1	Very low	114 Å²	114	114.1 Å²	114.1	74%	0.74	69%	0.687	S	S	*	*	S	Bend	trans	-51.4	120	-161.8	19.6	-33.4	0	0	0	109.2	A168	P166-A168 VanDerWaalsContact O-CA 3.31Å; P166-A168 WeakPolarHBondContact O-CA 3.36Å; P166-A168 PolarHBondContact O-N 3.39Å
167	P	43.4	Very low	47.2	Very low	109 Å²	109	112.5 Å²	112.5	71%	0.708	68%	0.676	S	S	*	*			trans	-52.8	104.7	-150.5	15.8	-31.7	0	0	0	110.4	S165 I169	S165-P167 WeakPolarHBondContact O-CA 3.42Å; P167-I169 WeakPolarHBondContact O-CA 3.38Å; P167-I169 PolarHBondContact O-N 3.45Å
168	A	37.2	Very low	49.3	Very low	87 Å²	87	111.3 Å²	111.3	72%	0.719	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.4	105.9	-155	0	0	0	0	0	110.9	P166 S170	P166-A168 VanDerWaalsContact O-CA 3.31Å; P166-A168 WeakPolarHBondContact O-CA 3.36Å; P166-A168 PolarHBondContact O-N 3.39Å; A168-S170 VanDerWaalsContact C-N 3.26Å; A168-S170 PolarHBondContact O-N 3.04Å
169	I	47.3	Very low	51.7	Low	144 Å²	144	110.3 Å²	110.3	74%	0.738	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-36.5	91.8	-142.9	-57.1	178.7	0	0	0	111.6	P167 L171	P167-I169 WeakPolarHBondContact O-CA 3.38Å; P167-I169 PolarHBondContact O-N 3.45Å; I169-L171 VanDerWaalsContact C-N 3.25Å; I169-L171 HydrophobicContact CG2-CD2 3.96Å; I169-L171 HydrophobicContact CG2-CG 4.28Å; I169-L171 PolarHBondContact O-N 2.85Å
170	S	47.9	Very low	54	Low	86 Å²	86	104 Å²	104	60%	0.601	63%	0.629	S	S	*	*			trans	-70	94.8	177.1	-77.2	0	0	0	0	106.5	A168 L172	A168-S170 VanDerWaalsContact C-N 3.26Å; A168-S170 PolarHBondContact O-N 3.04Å; S170-L172 PolarHBondContact O-N 2.93Å
171	L	50.1	Low	56.3	Low	149 Å²	149	99.1 Å²	99.1	78%	0.78	61%	0.605	S	S	*	*			trans	-67.7	60.9	165.6	-63.4	175.3	0	0	0	108.9	I169 S173	I169-L171 VanDerWaalsContact C-N 3.25Å; I169-L171 HydrophobicContact CG2-CD2 3.96Å; I169-L171 HydrophobicContact CG2-CG 4.28Å; I169-L171 PolarHBondContact O-N 2.85Å; L171-S173 PolarHBondContact O-N 3.33Å
172	L	52.2	Low	58.8	Low	105 Å²	105	99 Å²	99	55%	0.55	59%	0.594	S	S	.	*			trans	-33.7	112.5	137.1	-71.3	179.2	0	0	0	105.7	S170 A176	S170-L172 PolarHBondContact O-N 2.93Å; L172-A176 HydrophobicContact CB-CB 3.97Å; L172-A176 HydrophobicContact CD2-CB 4.32Å
173	S	60.8	Low	61.3	Low	67 Å²	67	100.1 Å²	100.1	47%	0.469	59%	0.59	S	S	.	*			trans	-48	151.7	-176.5	68	0	0	0	0	109.9	L171 R175 A176 M177	L171-S173 PolarHBondContact O-N 3.33Å; S173-R175 CarbonylContact O-C 3.48Å; S173-R175 PolarHBondContact O-N 3.46Å; S173-A176 WeakPolarHBondContact O-CA 3.31Å; S173-A176 WeakPolarHBondContact O-CB 3.19Å; S173-A176 PolarHBondContact O-N 3.1Å; S173-M177 PolarHBondContact O-N 3.16Å
174	P	71.1	Confident	63.4	Low	101 Å²	101	99.6 Å²	99.6	66%	0.656	58%	0.579	S	S	*	*	H	α-helix	trans	-44.5	-41.4	-174.6	-32.4	36.1	0	0	0	113.2	A176 M177 E178	P174-A176 PolarHBondContact O-N 3.44Å; P174-M177 PolarHBondContact O-N 3.18Å; P174-E178 WeakPolarHBondContact O-CB 3.32Å; P174-E178 VanDerWaalsContact O-CG 3.24Å; P174-E178 WeakPolarHBondContact O-CG 3.42Å; P174-E178 PolarHBondContact O-N 3.43Å
175	R	71.4	Confident	65.8	Low	194 Å²	194	101.2 Å²	101.2	73%	0.732	57%	0.571	S	S	*	*	H	α-helix	trans	-51.5	-39.5	172.6	-147.3	177.1	-165.3	-178.2	3.8	116	S173 E178 T179	S173-R175 CarbonylContact O-C 3.48Å; S173-R175 PolarHBondContact O-N 3.46Å; R175-E178 WeakPolarHBondContact CA-OE2 3.28Å; R175-T179 WeakPolarHBondContact O-CB 3.36Å; R175-T179 PolarHBondContact O-N 3.17Å; R175-T179 PolarHBondContact O-OG1 2.87Å
176	A	71.3	Confident	68	Low	36 Å²	36	102.4 Å²	102.4	30%	0.298	56%	0.563	S	S	.	*	H	α-helix	trans	-80.1	-36.4	178.9	0	0	0	0	0	112.3	L172 S173 P174 T179 A180	L172-A176 HydrophobicContact CB-CB 3.97Å; L172-A176 HydrophobicContact CD2-CB 4.32Å; S173-A176 WeakPolarHBondContact O-CA 3.31Å; S173-A176 WeakPolarHBondContact O-CB 3.19Å; S173-A176 PolarHBondContact O-N 3.1Å; P174-A176 PolarHBondContact O-N 3.44Å; A176-T179 PolarHBondContact O-N 3.26Å; A176-A180 PolarHBondContact O-N 2.92Å
177	M	75.4	Confident	70.4	Confident	116 Å²	116	102.2 Å²	102.2	57%	0.571	55%	0.552	S	S	*	*	H	α-helix	trans	-67.5	-42	171.8	-170.9	178.3	-68.8	0	0	111.3	S173 P174 A180 G181	S173-M177 PolarHBondContact O-N 3.16Å; P174-M177 PolarHBondContact O-N 3.18Å; M177-A180 PolarHBondContact O-N 3.43Å; M177-G181 PolarHBondContact O-N 3.47Å
178	E	78.4	Confident	72.7	Confident	110 Å²	110	103.2 Å²	103.2	51%	0.514	55%	0.545	S	S	.	.	H	α-helix	trans	-54.2	-51.4	168.1	-75.1	165	-177.6	0	0	111	P174 R175 A180 G181 H182	P174-E178 WeakPolarHBondContact O-CB 3.32Å; P174-E178 VanDerWaalsContact O-CG 3.24Å; P174-E178 WeakPolarHBondContact O-CG 3.42Å; P174-E178 PolarHBondContact O-N 3.43Å; R175-E178 WeakPolarHBondContact CA-OE2 3.28Å; E178-A180 PolarHBondContact O-N 2.83Å; E178-G181 CarbonylContact O-C 3.59Å; E178-G181 WeakPolarHBondContact O-CA 3.27Å; E178-G181 PolarHBondContact O-N 3.36Å; E178-G181 VanDerWaalsContact O-N 3.09Å; E178-H182 PolarHBondContact O-CD2 3.21Å; E178-H182 PolarHBondContact O-N 3.47Å
179	T	80.8	Confident	75.3	Confident	74 Å²	74	105.7 Å²	105.7	45%	0.454	54%	0.54	S	S	.	.	H	α-helix	trans	-58.5	-45.7	179.9	-62.4	0	0	0	0	111.7	R175 A176 G181 H182 I183	R175-T179 WeakPolarHBondContact O-CB 3.36Å; R175-T179 PolarHBondContact O-N 3.17Å; R175-T179 PolarHBondContact O-OG1 2.87Å; A176-T179 PolarHBondContact O-N 3.26Å; T179-G181 VanDerWaalsContact C-N 3.34Å; T179-G181 PolarHBondContact O-N 3.17Å; T179-H182 WeakPolarHBondContact O-CB 3.27Å; T179-H182 PolarHBondContact O-N 3.04Å; T179-H182 VanDerWaalsContact O-N 3.12Å; T179-I183 HydrophobicContact CG2-CD1 4.11Å; T179-I183 WeakPolarHBondContact O-CG1 3.37Å; T179-I183 PolarHBondContact O-N 3.45Å
180	A	80.6	Confident	77.3	Confident	42 Å²	42	102.8 Å²	102.8	35%	0.347	52%	0.523	S	S	.	.	H	α-helix	trans	-59.8	-43.9	173.7	0	0	0	0	0	111.8	A176 M177 E178 H182 I183 I184	A176-A180 PolarHBondContact O-N 2.92Å; M177-A180 PolarHBondContact O-N 3.43Å; E178-A180 PolarHBondContact O-N 2.83Å; A180-H182 VanDerWaalsContact C-N 3.29Å; A180-H182 PolarHBondContact O-N 3.15Å; A180-I183 PolarHBondContact O-N 2.91Å; A180-I184 WeakPolarHBondContact O-CG1 3.4Å; A180-I184 PolarHBondContact O-N 3.39Å
181	G	83.1	Confident	79.4	Confident	27 Å²	27	104.8 Å²	104.8	28%	0.278	52%	0.523	S	S	.	.	H	α-helix	trans	-63.4	-29.4	173.8	0	0	0	0	0	114	M177 E178 T179 R185	M177-G181 PolarHBondContact O-N 3.47Å; E178-G181 CarbonylContact O-C 3.59Å; E178-G181 WeakPolarHBondContact O-CA 3.27Å; E178-G181 PolarHBondContact O-N 3.36Å; E178-G181 VanDerWaalsContact O-N 3.09Å; T179-G181 VanDerWaalsContact C-N 3.34Å; T179-G181 PolarHBondContact O-N 3.17Å; G181-R185 WeakPolarHBondContact O-CB 3.44Å; G181-R185 VanDerWaalsContact O-CG 3.27Å; G181-R185 WeakPolarHBondContact O-CG 3.41Å; G181-R185 PolarHBondContact O-N 3.25Å; G181-R185 PolarHBondContact O-NE 3.36Å
182	H	85.4	Confident	81.5	Confident	116 Å²	116	103.4 Å²	103.4	54%	0.537	51%	0.513	S	S	.	.	H	α-helix	trans	-72.8	-42.5	170.9	-80	-76.7	0	0	0	111.9	E178 T179 A180 R185 F186	E178-H182 PolarHBondContact O-CD2 3.21Å; E178-H182 PolarHBondContact O-N 3.47Å; T179-H182 WeakPolarHBondContact O-CB 3.27Å; T179-H182 PolarHBondContact O-N 3.04Å; T179-H182 VanDerWaalsContact O-N 3.12Å; A180-H182 VanDerWaalsContact C-N 3.29Å; A180-H182 PolarHBondContact O-N 3.15Å; H182-R185 PolarHBondContact CD2-NH2 3.49Å; H182-R185 PolarHBondContact CE1-NH2 3.47Å; H182-R185 VanDerWaalsContact CE1-NH2 3.26Å; H182-R185 PolarHBondContact ND1-NH2 2.94Å; H182-R185 PolarHBondContact NE2-NH2 2.93Å; H182-R185 PolarHBondContact O-N 2.68Å; H182-F186 WeakPolarHBondContact O-CB 3.49Å; H182-F186 PolarHBondContact O-N 3.43Å
183	I	86.9	Confident	83.4	Confident	91 Å²	91	104.4 Å²	104.4	47%	0.467	51%	0.513	S	S	.	.	H	α-helix	trans	-60.6	-48.7	176.2	-67.7	166.1	0	0	0	110.8	T179 A180 R185 F186 Q187	T179-I183 HydrophobicContact CG2-CD1 4.11Å; T179-I183 WeakPolarHBondContact O-CG1 3.37Å; T179-I183 PolarHBondContact O-N 3.45Å; A180-I183 PolarHBondContact O-N 2.91Å; I183-R185 PolarHBondContact O-N 2.88Å; I183-F186 PolarHBondContact O-N 3.11Å; I183-Q187 HydrophobicContact CG2-CG 4.32Å; I183-Q187 WeakPolarHBondContact O-CB 3.31Å; I183-Q187 WeakPolarHBondContact O-CG 3.37Å; I183-Q187 PolarHBondContact O-N 3.07Å
184	I	87.9	Confident	84.9	Confident	108 Å²	108	104.1 Å²	104.1	55%	0.554	52%	0.515	S	S	*	.	H	α-helix	trans	-62.3	-43.1	179.5	-66.3	165.4	0	0	0	111.1	A180 F186 Q187 K188	A180-I184 WeakPolarHBondContact O-CG1 3.4Å; A180-I184 PolarHBondContact O-N 3.39Å; I184-F186 VanDerWaalsContact C-N 3.34Å; I184-F186 PolarHBondContact O-N 3.2Å; I184-Q187 PolarHBondContact O-N 3.4Å; I184-K188 WeakPolarHBondContact O-CB 3.42Å; I184-K188 PolarHBondContact O-N 2.79Å
185	R	87.4	Confident	86	Confident	149 Å²	149	106.1 Å²	106.1	56%	0.562	51%	0.513	S	S	*	.	H	α-helix	trans	-63	-38.2	175.3	-77.5	178.9	-70.4	179	0.3	112.2	G181 H182 I183 K189	G181-R185 WeakPolarHBondContact O-CB 3.44Å; G181-R185 VanDerWaalsContact O-CG 3.27Å; G181-R185 WeakPolarHBondContact O-CG 3.41Å; G181-R185 PolarHBondContact O-N 3.25Å; G181-R185 PolarHBondContact O-NE 3.36Å; H182-R185 PolarHBondContact CD2-NH2 3.49Å; H182-R185 PolarHBondContact CE1-NH2 3.47Å; H182-R185 VanDerWaalsContact CE1-NH2 3.26Å; H182-R185 PolarHBondContact ND1-NH2 2.94Å; H182-R185 PolarHBondContact NE2-NH2 2.93Å; H182-R185 PolarHBondContact O-N 2.68Å; I183-R185 PolarHBondContact O-N 2.88Å; R185-K189 WeakPolarHBondContact O-CB 3.41Å; R185-K189 PolarHBondContact O-N 3.31Å; R185-K189 VanDerWaalsContact O-N 3.1Å
186	F	88.9	Confident	87.1	Confident	126 Å²	126	100.1 Å²	100.1	55%	0.553	50%	0.498	S	S	*	.	H	α-helix	trans	-68.4	-48.3	175.5	-175.8	-96.8	0	0	0	111.8	H182 I183 I184 K188 K189 Q190	H182-F186 WeakPolarHBondContact O-CB 3.49Å; H182-F186 PolarHBondContact O-N 3.43Å; I183-F186 PolarHBondContact O-N 3.11Å; I184-F186 VanDerWaalsContact C-N 3.34Å; I184-F186 PolarHBondContact O-N 3.2Å; F186-K188 PolarHBondContact O-N 3.14Å; F186-K189 PolarHBondContact O-N 2.9Å; F186-Q190 HydrophobicContact CD1-CG 4.09Å; F186-Q190 HydrophobicContact CE1-CG 3.84Å; F186-Q190 HydrophobicContact CZ-CG 4.14Å; F186-Q190 WeakPolarHBondContact O-CG 3.46Å; F186-Q190 PolarHBondContact O-N 3.08Å
187	Q	91.1	Very high	88.2	Confident	109 Å²	109	101 Å²	101	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-57.3	-46.9	176.6	-75.4	176.6	-20.6	0	0	111.6	I183 I184 K189 Q190 Q191	I183-Q187 HydrophobicContact CG2-CG 4.32Å; I183-Q187 WeakPolarHBondContact O-CB 3.31Å; I183-Q187 WeakPolarHBondContact O-CG 3.37Å; I183-Q187 PolarHBondContact O-N 3.07Å; I184-Q187 PolarHBondContact O-N 3.4Å; Q187-K189 PolarHBondContact O-N 2.87Å; Q187-Q190 PolarHBondContact O-N 3.26Å; Q187-Q190 VanDerWaalsContact O-N 3.16Å; Q187-Q191 WeakPolarHBondContact O-CG 3.37Å; Q187-Q191 PolarHBondContact O-N 3.3Å
188	K	91.6	Very high	89	Confident	130 Å²	130	100.3 Å²	100.3	57%	0.565	50%	0.503	S	S	*	.	H	α-helix	trans	-59.6	-45.2	175.8	-170.3	174.7	-179.2	-179.9	0	111.6	I184 F186 Q190 Q191 E192	I184-K188 WeakPolarHBondContact O-CB 3.42Å; I184-K188 PolarHBondContact O-N 2.79Å; F186-K188 PolarHBondContact O-N 3.14Å; K188-Q190 VanDerWaalsContact C-N 3.28Å; K188-Q190 PolarHBondContact O-N 3.06Å; K188-Q191 PolarHBondContact O-N 2.81Å; K188-E192 WeakPolarHBondContact O-CB 3.42Å; K188-E192 PolarHBondContact O-N 3.1Å
189	K	92.4	Very high	89.8	Confident	139 Å²	139	100.8 Å²	100.8	60%	0.604	51%	0.505	S	S	*	.	H	α-helix	trans	-62	-32.3	176.4	-172	171.5	-175.8	173.1	0	113.1	R185 F186 Q187 K193	R185-K189 WeakPolarHBondContact O-CB 3.41Å; R185-K189 PolarHBondContact O-N 3.31Å; R185-K189 VanDerWaalsContact O-N 3.1Å; F186-K189 PolarHBondContact O-N 2.9Å; Q187-K189 PolarHBondContact O-N 2.87Å; K189-K193 WeakPolarHBondContact O-CG 3.47Å; K189-K193 PolarHBondContact O-N 3.03Å
190	Q	88.9	Confident	90.5	Very high	83 Å²	83	102.9 Å²	102.9	39%	0.388	51%	0.509	S	S	.	.	H	α-helix	trans	-78.2	-38.4	174.8	-62.6	-68.5	22.7	0	0	112.5	F186 Q187 K188 E192 K193 A194	F186-Q190 HydrophobicContact CD1-CG 4.09Å; F186-Q190 HydrophobicContact CE1-CG 3.84Å; F186-Q190 HydrophobicContact CZ-CG 4.14Å; F186-Q190 WeakPolarHBondContact O-CG 3.46Å; F186-Q190 PolarHBondContact O-N 3.08Å; Q187-Q190 PolarHBondContact O-N 3.26Å; Q187-Q190 VanDerWaalsContact O-N 3.16Å; K188-Q190 VanDerWaalsContact C-N 3.28Å; K188-Q190 PolarHBondContact O-N 3.06Å; Q190-E192 VanDerWaalsContact C-N 3.31Å; Q190-E192 PolarHBondContact O-N 3.32Å; Q190-K193 PolarHBondContact O-N 3.48Å; Q190-A194 WeakPolarHBondContact O-CB 3.26Å; Q190-A194 PolarHBondContact O-N 2.92Å
191	Q	91.8	Very high	91.1	Very high	128 Å²	128	110 Å²	110	60%	0.598	53%	0.527	S	S	*	.	H	α-helix	trans	-61.2	-40.4	172.1	-73.9	178.1	-10.4	0	0	111.8	Q187 K188 A194 K195	Q187-Q191 WeakPolarHBondContact O-CG 3.37Å; Q187-Q191 PolarHBondContact O-N 3.3Å; K188-Q191 PolarHBondContact O-N 2.81Å; Q191-A194 PolarHBondContact O-N 3.26Å; Q191-K195 WeakPolarHBondContact O-CG 3.35Å; Q191-K195 PolarHBondContact O-N 3.46Å
192	E	93.3	Very high	91.6	Very high	120 Å²	120	113.4 Å²	113.4	56%	0.561	54%	0.536	S	S	*	.	H	α-helix	trans	-67.1	-44.1	178.8	-157.5	136.3	-121.5	0	0	111.2	K188 Q190 A194 K195 V196	K188-E192 WeakPolarHBondContact O-CB 3.42Å; K188-E192 PolarHBondContact O-N 3.1Å; Q190-E192 VanDerWaalsContact C-N 3.31Å; Q190-E192 PolarHBondContact O-N 3.32Å; E192-A194 PolarHBondContact O-N 3.39Å; E192-K195 PolarHBondContact O-N 3.32Å; E192-V196 WeakPolarHBondContact O-CG2 3.4Å; E192-V196 PolarHBondContact O-N 3.13Å
193	K	93.1	Very high	92.2	Very high	127 Å²	127	111.2 Å²	111.2	55%	0.552	53%	0.531	S	S	*	.	H	α-helix	trans	-57.4	-44.5	168.8	-79.9	179.1	165.2	-160.9	0	113.1	K189 Q190 K195 V196 A197	K189-K193 WeakPolarHBondContact O-CG 3.47Å; K189-K193 PolarHBondContact O-N 3.03Å; Q190-K193 PolarHBondContact O-N 3.48Å; K193-K195 VanDerWaalsContact C-N 3.33Å; K193-K195 PolarHBondContact O-N 2.87Å; K193-V196 PolarHBondContact O-N 3.11Å; K193-A197 WeakPolarHBondContact O-CB 3.46Å; K193-A197 PolarHBondContact O-N 2.95Å
194	A	91.7	Very high	92.6	Very high	61 Å²	61	112.7 Å²	112.7	50%	0.504	54%	0.539	S	S	.	.	H	α-helix	trans	-65.6	-36.3	-179.9	0	0	0	0	0	112.1	Q190 Q191 E192 L198	Q190-A194 WeakPolarHBondContact O-CB 3.26Å; Q190-A194 PolarHBondContact O-N 2.92Å; Q191-A194 PolarHBondContact O-N 3.26Å; E192-A194 PolarHBondContact O-N 3.39Å; A194-L198 VanDerWaalsContact O-CB 3.28Å; A194-L198 WeakPolarHBondContact O-CB 3.47Å; A194-L198 PolarHBondContact O-N 3.25Å
195	K	94.8	Very high	92.8	Very high	143 Å²	143	113.6 Å²	113.6	62%	0.622	54%	0.541	S	S	*	.	H	α-helix	trans	-63.8	-48	172.5	-76.4	179.1	176	-174.9	0	112	Q191 E192 K193 L198 Q199	Q191-K195 WeakPolarHBondContact O-CG 3.35Å; Q191-K195 PolarHBondContact O-N 3.46Å; E192-K195 PolarHBondContact O-N 3.32Å; K193-K195 VanDerWaalsContact C-N 3.33Å; K193-K195 PolarHBondContact O-N 2.87Å; K195-L198 PolarHBondContact O-N 3.02Å; K195-Q199 WeakPolarHBondContact O-CG 3.49Å; K195-Q199 PolarHBondContact O-N 3.25Å
196	V	94.8	Very high	93.2	Very high	68 Å²	68	112.5 Å²	112.5	41%	0.412	54%	0.542	S	S	.	.	H	α-helix	trans	-60.6	-49.4	177.7	173.1	0	0	0	0	110.8	E192 K193 L198 Q199 E200	E192-V196 WeakPolarHBondContact O-CG2 3.4Å; E192-V196 PolarHBondContact O-N 3.13Å; K193-V196 PolarHBondContact O-N 3.11Å; V196-L198 VanDerWaalsContact C-N 3.25Å; V196-L198 PolarHBondContact O-N 2.86Å; V196-Q199 PolarHBondContact O-N 3.14Å; V196-Q199 VanDerWaalsContact O-N 3.11Å; V196-E200 HydrophobicContact CG1-CG 4.37Å; V196-E200 WeakPolarHBondContact O-CG 3.48Å; V196-E200 PolarHBondContact O-N 3.4Å
197	A	93	Very high	93.5	Very high	53 Å²	53	112.8 Å²	112.8	44%	0.438	54%	0.543	S	S	.	.	H	α-helix	trans	-62.3	-30.7	178.3	0	0	0	0	0	113.2	K193 R201	K193-A197 WeakPolarHBondContact O-CB 3.46Å; K193-A197 PolarHBondContact O-N 2.95Å; A197-R201 WeakPolarHBondContact O-CB 3.35Å; A197-R201 PolarHBondContact O-N 3.36Å; A197-R201 VanDerWaalsContact O-N 3.13Å
198	L	94.1	Very high	93.8	Very high	103 Å²	103	112.8 Å²	112.8	54%	0.539	55%	0.546	S	S	.	.	H	α-helix	trans	-72.9	-40.3	173.9	-175.5	139.9	0	0	0	111.8	A194 K195 V196 R201 Q202	A194-L198 VanDerWaalsContact O-CB 3.28Å; A194-L198 WeakPolarHBondContact O-CB 3.47Å; A194-L198 PolarHBondContact O-N 3.25Å; K195-L198 PolarHBondContact O-N 3.02Å; V196-L198 VanDerWaalsContact C-N 3.25Å; V196-L198 PolarHBondContact O-N 2.86Å; L198-R201 PolarHBondContact O-N 3.06Å; L198-Q202 HydrophobicContact CD2-CG 4.39Å; L198-Q202 WeakPolarHBondContact O-CG 3.29Å; L198-Q202 PolarHBondContact O-N 3.29Å
199	Q	95.1	Very high	94	Very high	119 Å²	119	110.9 Å²	110.9	56%	0.556	55%	0.545	S	S	*	.	H	α-helix	trans	-65.1	-43.8	174.4	-72.2	174.5	-39.7	0	0	112	K195 V196 R201 Q202 V203	K195-Q199 WeakPolarHBondContact O-CG 3.49Å; K195-Q199 PolarHBondContact O-N 3.25Å; V196-Q199 PolarHBondContact O-N 3.14Å; V196-Q199 VanDerWaalsContact O-N 3.11Å; Q199-R201 VanDerWaalsContact C-N 3.28Å; Q199-R201 PolarHBondContact O-N 3.25Å; Q199-Q202 PolarHBondContact O-N 3.17Å; Q199-V203 WeakPolarHBondContact O-CG2 3.28Å; Q199-V203 PolarHBondContact O-N 3.22Å
200	E	94.4	Very high	94.2	Very high	118 Å²	118	111 Å²	111	55%	0.551	55%	0.548	S	S	*	.	H	α-helix	trans	-57.4	-42.8	173	-72	172.3	166.4	0	0	111.2	V196 V203 L204	V196-E200 HydrophobicContact CG1-CG 4.37Å; V196-E200 WeakPolarHBondContact O-CG 3.48Å; V196-E200 PolarHBondContact O-N 3.4Å; E200-V203 PolarHBondContact O-N 2.7Å; E200-L204 WeakPolarHBondContact O-CB 3.48Å; E200-L204 VanDerWaalsContact O-CG 3.29Å; E200-L204 WeakPolarHBondContact O-CG 3.21Å; E200-L204 PolarHBondContact O-N 3.05Å
201	R	93.6	Very high	94.5	Very high	192 Å²	192	109.5 Å²	109.5	73%	0.725	55%	0.547	S	S	*	.	H	α-helix	trans	-67	-37.8	177.3	-161.2	176.4	-161.8	171.8	5.7	112.8	A197 L198 Q199 Q205	A197-R201 WeakPolarHBondContact O-CB 3.35Å; A197-R201 PolarHBondContact O-N 3.36Å; A197-R201 VanDerWaalsContact O-N 3.13Å; L198-R201 PolarHBondContact O-N 3.06Å; Q199-R201 VanDerWaalsContact C-N 3.28Å; Q199-R201 PolarHBondContact O-N 3.25Å; R201-Q205 WeakPolarHBondContact O-CB 3.38Å; R201-Q205 PolarHBondContact O-N 3.13Å
202	Q	94.3	Very high	94.7	Very high	98 Å²	98	107 Å²	107	46%	0.458	54%	0.54	S	S	.	.	H	α-helix	trans	-63	-50.8	173.7	-75.9	174.6	-45.5	0	0	111.2	L198 Q199 L204 Q205 E206	L198-Q202 HydrophobicContact CD2-CG 4.39Å; L198-Q202 WeakPolarHBondContact O-CG 3.29Å; L198-Q202 PolarHBondContact O-N 3.29Å; Q199-Q202 PolarHBondContact O-N 3.17Å; Q202-L204 VanDerWaalsContact C-N 3.28Å; Q202-L204 PolarHBondContact O-N 3.48Å; Q202-Q205 PolarHBondContact O-N 3.32Å; Q202-E206 WeakPolarHBondContact O-CG 3.37Å; Q202-E206 PolarHBondContact O-N 2.78Å
203	V	96.4	Very high	94.8	Very high	70 Å²	70	104 Å²	104	42%	0.424	54%	0.536	S	S	.	.	H	α-helix	trans	-62	-34.7	179.3	172.6	0	0	0	0	112.3	Q199 E200 K207	Q199-V203 WeakPolarHBondContact O-CG2 3.28Å; Q199-V203 PolarHBondContact O-N 3.22Å; E200-V203 PolarHBondContact O-N 2.7Å; V203-K207 HydrophobicContact CG1-CD 4.41Å; V203-K207 WeakPolarHBondContact O-CG 3.39Å; V203-K207 PolarHBondContact O-N 3.39Å
204	L	95.4	Very high	94.9	Very high	123 Å²	123	101 Å²	101	64%	0.644	53%	0.531	S	S	*	.	H	α-helix	trans	-68.7	-38.7	172.8	-73.3	170.1	0	0	0	112.4	E200 Q202 L208	E200-L204 WeakPolarHBondContact O-CB 3.48Å; E200-L204 VanDerWaalsContact O-CG 3.29Å; E200-L204 WeakPolarHBondContact O-CG 3.21Å; E200-L204 PolarHBondContact O-N 3.05Å; Q202-L204 VanDerWaalsContact C-N 3.28Å; Q202-L204 PolarHBondContact O-N 3.48Å; L204-L208 WeakPolarHBondContact O-CB 3.4Å; L204-L208 PolarHBondContact O-N 2.87Å; L204-L208 VanDerWaalsContact O-N 3.09Å
205	Q	92.3	Very high	95	Very high	126 Å²	126	101.3 Å²	101.3	59%	0.589	53%	0.527	S	S	*	.	H	α-helix	trans	-70.6	-40	177.9	-174.6	171.1	-9	0	0	112.1	R201 Q202 L208 V209	R201-Q205 WeakPolarHBondContact O-CB 3.38Å; R201-Q205 PolarHBondContact O-N 3.13Å; Q202-Q205 PolarHBondContact O-N 3.32Å; Q205-L208 PolarHBondContact O-N 3.44Å; Q205-V209 WeakPolarHBondContact O-CG2 3.11Å; Q205-V209 PolarHBondContact O-N 2.96Å
206	E	95.8	Very high	95.1	Very high	127 Å²	127	100.3 Å²	100.3	59%	0.593	52%	0.524	S	S	*	.	H	α-helix	trans	-60.2	-48.6	174.3	-73.3	170.3	171.8	0	0	111.3	Q202 L208 V209 E210	Q202-E206 WeakPolarHBondContact O-CG 3.37Å; Q202-E206 PolarHBondContact O-N 2.78Å; E206-L208 VanDerWaalsContact C-N 3.3Å; E206-L208 PolarHBondContact O-N 3.11Å; E206-V209 PolarHBondContact O-N 3.39Å; E206-E210 WeakPolarHBondContact O-CB 3.35Å; E206-E210 PolarHBondContact O-N 3.42Å
207	K	96.4	Very high	95.2	Very high	131 Å²	131	101.3 Å²	101.3	57%	0.57	53%	0.527	S	S	*	.	H	α-helix	trans	-60.4	-37.3	175.2	-74.7	176.2	179.8	-178.6	0	113	V203 S211	V203-K207 HydrophobicContact CG1-CD 4.41Å; V203-K207 WeakPolarHBondContact O-CG 3.39Å; V203-K207 PolarHBondContact O-N 3.39Å; K207-S211 WeakPolarHBondContact O-CB 3.23Å; K207-S211 PolarHBondContact O-N 2.78Å; K207-S211 PolarHBondContact O-OG 3.12Å
208	L	96.1	Very high	95.3	Very high	109 Å²	109	103.2 Å²	103.2	57%	0.571	53%	0.527	S	S	*	.	H	α-helix	trans	-65.5	-46.8	175.6	-175.8	64	0	0	0	110.8	L204 Q205 E206 E210 S211 V212	L204-L208 WeakPolarHBondContact O-CB 3.4Å; L204-L208 PolarHBondContact O-N 2.87Å; L204-L208 VanDerWaalsContact O-N 3.09Å; Q205-L208 PolarHBondContact O-N 3.44Å; E206-L208 VanDerWaalsContact C-N 3.3Å; E206-L208 PolarHBondContact O-N 3.11Å; L208-E210 PolarHBondContact O-N 2.84Å; L208-S211 PolarHBondContact O-N 3.09Å; L208-S211 PolarHBondContact O-OG 3.45Å; L208-V212 WeakPolarHBondContact O-CG2 3.42Å; L208-V212 PolarHBondContact O-N 3.37Å
209	V	96.1	Very high	95.2	Very high	91 Å²	91	103.7 Å²	103.7	55%	0.552	53%	0.526	S	S	*	.	H	α-helix	trans	-61.2	-42.9	176.9	170.7	0	0	0	0	111.5	Q205 E206 V212 A213	Q205-V209 WeakPolarHBondContact O-CG2 3.11Å; Q205-V209 PolarHBondContact O-N 2.96Å; E206-V209 PolarHBondContact O-N 3.39Å; V209-V212 PolarHBondContact O-N 2.57Å; V209-A213 VanDerWaalsContact O-CB 3.29Å; V209-A213 WeakPolarHBondContact O-CB 3.08Å; V209-A213 PolarHBondContact O-N 3.24Å
210	E	96.5	Very high	95.3	Very high	140 Å²	140	102.3 Å²	102.3	65%	0.654	52%	0.522	S	S	*	.	H	α-helix	trans	-62.8	-40.9	175.5	-173.9	175.6	-146.3	0	0	112.1	E206 L208 S214	E206-E210 WeakPolarHBondContact O-CB 3.35Å; E206-E210 PolarHBondContact O-N 3.42Å; L208-E210 PolarHBondContact O-N 2.84Å; E210-S214 WeakPolarHBondContact O-CB 3.45Å; E210-S214 PolarHBondContact O-N 2.68Å; E210-S214 PolarHBondContact O-OG 3.34Å
211	S	95.4	Very high	95.5	Very high	53 Å²	53	101.8 Å²	101.8	37%	0.371	52%	0.518	S	S	.	.	H	α-helix	trans	-64.3	-42.2	175.5	74.2	0	0	0	0	112.3	K207 L208 S214 T215	K207-S211 WeakPolarHBondContact O-CB 3.23Å; K207-S211 PolarHBondContact O-N 2.78Å; K207-S211 PolarHBondContact O-OG 3.12Å; L208-S211 PolarHBondContact O-N 3.09Å; L208-S211 PolarHBondContact O-OG 3.45Å; S211-S214 PolarHBondContact O-OG 3.22Å; S211-T215 PolarHBondContact O-N 2.86Å; S211-T215 VanDerWaalsContact O-N 3.15Å; S211-T215 PolarHBondContact O-OG1 3.28Å
212	V	95.4	Very high	95.6	Very high	75 Å²	75	98.5 Å²	98.5	46%	0.455	51%	0.505	S	S	.	.	H	α-helix	trans	-67	-48.3	177	173.6	0	0	0	0	110.4	L208 V209 S214 T215 E216	L208-V212 WeakPolarHBondContact O-CG2 3.42Å; L208-V212 PolarHBondContact O-N 3.37Å; V209-V212 PolarHBondContact O-N 2.57Å; V212-S214 VanDerWaalsContact C-N 3.3Å; V212-S214 PolarHBondContact O-N 3.27Å; V212-T215 PolarHBondContact O-N 3.21Å; V212-T215 VanDerWaalsContact O-N 3.12Å; V212-T215 PolarHBondContact O-OG1 3.01Å; V212-E216 HydrophobicContact CG1-CG 4.39Å; V212-E216 PolarHBondContact O-N 3.14Å
213	A	95.5	Very high	95.6	Very high	58 Å²	58	99.7 Å²	99.7	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-59.7	-37.9	179.4	0	0	0	0	0	112.9	V209 L217	V209-A213 VanDerWaalsContact O-CB 3.29Å; V209-A213 WeakPolarHBondContact O-CB 3.08Å; V209-A213 PolarHBondContact O-N 3.24Å; A213-L217 WeakPolarHBondContact O-CB 3.33Å; A213-L217 PolarHBondContact O-N 3.36Å
214	S	95.3	Very high	95.6	Very high	64 Å²	64	101.6 Å²	101.6	45%	0.448	51%	0.513	S	S	.	.	H	α-helix	trans	-68.1	-40.3	174.7	58.7	0	0	0	0	112.4	E210 S211 V212 L217 E218	E210-S214 WeakPolarHBondContact O-CB 3.45Å; E210-S214 PolarHBondContact O-N 2.68Å; E210-S214 PolarHBondContact O-OG 3.34Å; S211-S214 PolarHBondContact O-OG 3.22Å; V212-S214 VanDerWaalsContact C-N 3.3Å; V212-S214 PolarHBondContact O-N 3.27Å; S214-L217 PolarHBondContact O-N 3.28Å; S214-E218 PolarHBondContact O-N 3.2Å
215	T	94.4	Very high	95.7	Very high	67 Å²	67	101.2 Å²	101.2	41%	0.411	51%	0.508	S	S	.	.	H	α-helix	trans	-64.9	-43.3	174.9	54.5	0	0	0	0	113.2	S211 V212 L217 E218 H219	S211-T215 PolarHBondContact O-N 2.86Å; S211-T215 VanDerWaalsContact O-N 3.15Å; S211-T215 PolarHBondContact O-OG1 3.28Å; V212-T215 PolarHBondContact O-N 3.21Å; V212-T215 VanDerWaalsContact O-N 3.12Å; V212-T215 PolarHBondContact O-OG1 3.01Å; T215-L217 VanDerWaalsContact C-N 3.32Å; T215-L217 PolarHBondContact O-N 3.47Å; T215-E218 PolarHBondContact O-N 3.3Å; T215-H219 PolarHBondContact O-CD2 2.88Å; T215-H219 PolarHBondContact O-N 3.22Å
216	E	95.8	Very high	95.8	Very high	122 Å²	122	100.8 Å²	100.8	57%	0.57	51%	0.508	S	S	*	.	H	α-helix	trans	-62.5	-39.1	175.6	-70.4	-60	151.3	0	0	111.7	V212 E218 H219 L220	V212-E216 HydrophobicContact CG1-CG 4.39Å; V212-E216 PolarHBondContact O-N 3.14Å; E216-E218 VanDerWaalsContact C-N 3.35Å; E216-E218 PolarHBondContact O-N 2.96Å; E216-H219 PolarHBondContact O-N 2.95Å; E216-L220 PolarHBondContact O-N 3.16Å
217	L	97	Very high	95.7	Very high	89 Å²	89	100.5 Å²	100.5	47%	0.466	51%	0.505	S	S	.	.	H	α-helix	trans	-65.4	-35.2	175.4	-174.4	64.9	0	0	0	112.5	A213 S214 T215 K221	A213-L217 WeakPolarHBondContact O-CB 3.33Å; A213-L217 PolarHBondContact O-N 3.36Å; S214-L217 PolarHBondContact O-N 3.28Å; T215-L217 VanDerWaalsContact C-N 3.32Å; T215-L217 PolarHBondContact O-N 3.47Å; L217-K221 VanDerWaalsContact O-CG 3.32Å; L217-K221 WeakPolarHBondContact O-CG 3.27Å; L217-K221 PolarHBondContact O-N 3.09Å; L217-K221 VanDerWaalsContact O-N 3.15Å
218	E	96.1	Very high	95.7	Very high	93 Å²	93	98.8 Å²	98.8	44%	0.435	50%	0.498	S	S	.	.	H	α-helix	trans	-68	-40.6	170.7	-69.1	-165.6	165.8	0	0	112.4	S214 T215 E216 L220 K221 R222	S214-E218 PolarHBondContact O-N 3.2Å; T215-E218 PolarHBondContact O-N 3.3Å; E216-E218 VanDerWaalsContact C-N 3.35Å; E216-E218 PolarHBondContact O-N 2.96Å; E218-L220 VanDerWaalsContact C-N 3.34Å; E218-K221 PolarHBondContact O-N 2.84Å; E218-R222 WeakPolarHBondContact O-CB 3.22Å; E218-R222 VanDerWaalsContact O-CG 3.29Å; E218-R222 WeakPolarHBondContact O-CG 3.43Å; E218-R222 PolarHBondContact O-N 3.37Å; E218-R222 IonicContact OE2-CZ 3.66Å; E218-R222 IonicContact OE2-NH1 2.7Å; E218-R222 PolarHBondContact OE2-NH1 3.02Å; E218-R222 IonicContact OE2-NH2 3.79Å; E218-R222 PolarHBondContact OE2-NH2 3Å
219	H	92.7	Very high	95.8	Very high	112 Å²	112	98.3 Å²	98.3	52%	0.519	50%	0.496	S	S	.	.	H	α-helix	trans	-62.8	-40.3	177.1	-81.5	-67.7	0	0	0	111.9	T215 E216 F223	T215-H219 PolarHBondContact O-CD2 2.88Å; T215-H219 PolarHBondContact O-N 3.22Å; E216-H219 PolarHBondContact O-N 2.95Å; H219-F223 PolarHBondContact O-N 3.48Å; H219-F223 VanDerWaalsContact O-N 3.1Å
220	L	96.6	Very high	95.7	Very high	90 Å²	90	99.9 Å²	99.9	47%	0.471	50%	0.495	S	S	.	.	H	α-helix	trans	-62.7	-48.5	173.9	-175.2	62	0	0	0	111.9	E216 E218 R222 F223 E224	E216-L220 PolarHBondContact O-N 3.16Å; E218-L220 VanDerWaalsContact C-N 3.34Å; L220-R222 PolarHBondContact O-N 2.99Å; L220-F223 WeakPolarHBondContact O-CB 3.47Å; L220-F223 PolarHBondContact O-N 2.99Å; L220-F223 VanDerWaalsContact O-N 3.09Å; L220-E224 PolarHBondContact O-N 3.01Å
221	K	97.4	Very high	95.5	Very high	107 Å²	107	97.6 Å²	97.6	47%	0.465	49%	0.485	S	S	.	.	H	α-helix	trans	-57.9	-46.8	177.1	-73.9	169.4	-178.5	173.6	0	112.4	L217 E218 F223 E224 E225	L217-K221 VanDerWaalsContact O-CG 3.32Å; L217-K221 WeakPolarHBondContact O-CG 3.27Å; L217-K221 PolarHBondContact O-N 3.09Å; L217-K221 VanDerWaalsContact O-N 3.15Å; E218-K221 PolarHBondContact O-N 2.84Å; K221-F223 PolarHBondContact O-N 3.11Å; K221-E224 PolarHBondContact O-N 3.41Å; K221-E224 VanDerWaalsContact O-N 3.15Å; K221-E225 WeakPolarHBondContact O-CG 3.32Å; K221-E225 PolarHBondContact O-N 2.88Å
222	R	96.6	Very high	95.6	Very high	124 Å²	124	101.6 Å²	101.6	47%	0.468	49%	0.492	S	S	.	.	H	α-helix	trans	-59.7	-33.7	176.4	-71.8	169.5	-178.8	129.1	10.4	112.3	E218 L220 M226	E218-R222 WeakPolarHBondContact O-CB 3.22Å; E218-R222 VanDerWaalsContact O-CG 3.29Å; E218-R222 WeakPolarHBondContact O-CG 3.43Å; E218-R222 PolarHBondContact O-N 3.37Å; E218-R222 IonicContact OE2-CZ 3.66Å; E218-R222 IonicContact OE2-NH1 2.7Å; E218-R222 PolarHBondContact OE2-NH1 3.02Å; E218-R222 IonicContact OE2-NH2 3.79Å; E218-R222 PolarHBondContact OE2-NH2 3Å; L220-R222 PolarHBondContact O-N 2.99Å; R222-M226 WeakPolarHBondContact O-CB 3.44Å; R222-M226 PolarHBondContact O-N 3.39Å; R222-M226 VanDerWaalsContact O-N 3.12Å
223	F	95.1	Very high	95.5	Very high	122 Å²	122	104.4 Å²	104.4	54%	0.535	50%	0.5	S	S	.	.	H	α-helix	trans	-72.4	-40.4	175.6	-179.7	-99.9	0	0	0	112.3	H219 L220 K221 M226 K227	H219-F223 PolarHBondContact O-N 3.48Å; H219-F223 VanDerWaalsContact O-N 3.1Å; L220-F223 WeakPolarHBondContact O-CB 3.47Å; L220-F223 PolarHBondContact O-N 2.99Å; L220-F223 VanDerWaalsContact O-N 3.09Å; K221-F223 PolarHBondContact O-N 3.11Å; F223-M226 HydrophobicContact CD2-CE 4.27Å; F223-M226 PolarHBondContact O-N 2.78Å; F223-K227 WeakPolarHBondContact O-CB 3.34Å; F223-K227 PolarHBondContact O-N 2.52Å
224	E	96.4	Very high	95.4	Very high	110 Å²	110	106.1 Å²	106.1	51%	0.514	50%	0.498	S	S	.	.	H	α-helix	trans	-65.5	-45.5	175	-68.5	-178.7	149.2	0	0	112.1	L220 K221 M226 K227 E228	L220-E224 PolarHBondContact O-N 3.01Å; K221-E224 PolarHBondContact O-N 3.41Å; K221-E224 VanDerWaalsContact O-N 3.15Å; E224-M226 PolarHBondContact O-N 2.82Å; E224-K227 WeakPolarHBondContact O-CB 3.49Å; E224-K227 PolarHBondContact O-N 2.77Å; E224-K227 VanDerWaalsContact O-N 3.16Å; E224-E228 PolarHBondContact O-N 2.93Å
225	E	97.1	Very high	95.4	Very high	116 Å²	116	110.2 Å²	110.2	54%	0.542	51%	0.508	S	S	.	.	H	α-helix	trans	-57.6	-45.6	173.7	-72.2	171.6	174	0	0	112	K221 K227 E228 L229	K221-E225 WeakPolarHBondContact O-CG 3.32Å; K221-E225 PolarHBondContact O-N 2.88Å; E225-K227 VanDerWaalsContact C-N 3.33Å; E225-K227 PolarHBondContact O-N 3.42Å; E225-E228 PolarHBondContact O-N 3.21Å; E225-L229 WeakPolarHBondContact O-CB 3.37Å; E225-L229 WeakPolarHBondContact O-CG 3.39Å; E225-L229 PolarHBondContact O-N 3.47Å
226	M	93.4	Very high	95.5	Very high	116 Å²	116	113.1 Å²	113.1	57%	0.571	52%	0.517	S	S	*	.	H	α-helix	trans	-61.7	-40.9	176	-171.7	-135.8	-57.7	0	0	111.8	R222 F223 E224 L229 K230	R222-M226 WeakPolarHBondContact O-CB 3.44Å; R222-M226 PolarHBondContact O-N 3.39Å; R222-M226 VanDerWaalsContact O-N 3.12Å; F223-M226 HydrophobicContact CD2-CE 4.27Å; F223-M226 PolarHBondContact O-N 2.78Å; E224-M226 PolarHBondContact O-N 2.82Å; M226-L229 PolarHBondContact O-N 3.45Å; M226-K230 WeakPolarHBondContact O-CB 3.41Å; M226-K230 PolarHBondContact O-N 3.11Å
227	K	94.6	Very high	95.4	Very high	122 Å²	122	110.8 Å²	110.8	53%	0.53	51%	0.514	S	S	.	.	H	α-helix	trans	-65.4	-44.2	178	-179.8	-177.7	172.6	-170.7	0	111.6	F223 E224 E225 K230 Q231	F223-K227 WeakPolarHBondContact O-CB 3.34Å; F223-K227 PolarHBondContact O-N 2.52Å; E224-K227 WeakPolarHBondContact O-CB 3.49Å; E224-K227 PolarHBondContact O-N 2.77Å; E224-K227 VanDerWaalsContact O-N 3.16Å; E225-K227 VanDerWaalsContact C-N 3.33Å; E225-K227 PolarHBondContact O-N 3.42Å; K227-K230 PolarHBondContact O-N 3.05Å; K227-Q231 WeakPolarHBondContact O-CG 3.37Å; K227-Q231 PolarHBondContact O-N 3.5Å
228	E	97.1	Very high	95.4	Very high	94 Å²	94	110.6 Å²	110.6	44%	0.439	51%	0.513	S	S	.	.	H	α-helix	trans	-63.5	-44.4	174.1	-70	-157.3	147.2	0	0	112.1	E224 E225 K230 Q231 R232	E224-E228 PolarHBondContact O-N 2.93Å; E225-E228 PolarHBondContact O-N 3.21Å; E228-K230 VanDerWaalsContact C-N 3.31Å; E228-K230 PolarHBondContact O-N 3.27Å; E228-Q231 PolarHBondContact O-N 2.71Å; E228-R232 VanDerWaalsContact CD-NH2 3.35Å; E228-R232 WeakPolarHBondContact O-CG 3.28Å; E228-R232 PolarHBondContact O-N 2.63Å; E228-R232 IonicContact OE1-NH2 3.36Å; E228-R232 IonicContact OE2-CZ 2.67Å; E228-R232 IonicContact OE2-NH1 3.38Å; E228-R232 PolarHBondContact OE2-NH1 2.96Å; E228-R232 IonicContact OE2-NH2 3.79Å; E228-R232 PolarHBondContact OE2-NH2 3.42Å
229	L	96.5	Very high	95.4	Very high	100 Å²	100	114.7 Å²	114.7	52%	0.524	52%	0.524	S	S	.	.	H	α-helix	trans	-59.6	-43	178.2	-79.4	166.3	0	0	0	111.4	E225 M226 R232 Q233	E225-L229 WeakPolarHBondContact O-CB 3.37Å; E225-L229 WeakPolarHBondContact O-CG 3.39Å; E225-L229 PolarHBondContact O-N 3.47Å; M226-L229 PolarHBondContact O-N 3.45Å; L229-R232 PolarHBondContact O-N 3.22Å; L229-Q233 WeakPolarHBondContact O-CG 3.45Å; L229-Q233 PolarHBondContact O-N 2.98Å
230	K	94.1	Very high	95.5	Very high	123 Å²	123	112.8 Å²	112.8	54%	0.535	52%	0.518	S	S	.	.	H	α-helix	trans	-61.9	-47	175.2	-172.4	178.9	179	-164.6	0	111.8	M226 K227 E228 R232 Q233 E234	M226-K230 WeakPolarHBondContact O-CB 3.41Å; M226-K230 PolarHBondContact O-N 3.11Å; K227-K230 PolarHBondContact O-N 3.05Å; E228-K230 VanDerWaalsContact C-N 3.31Å; E228-K230 PolarHBondContact O-N 3.27Å; K230-R232 VanDerWaalsContact C-N 3.34Å; K230-R232 PolarHBondContact O-N 3.02Å; K230-Q233 WeakPolarHBondContact O-CB 3.49Å; K230-Q233 PolarHBondContact O-N 3.39Å; K230-E234 WeakPolarHBondContact CE-OE1 3.38Å; K230-E234 IonicContact NZ-OE1 2.73Å; K230-E234 WeakPolarHBondContact O-CG 2.99Å; K230-E234 PolarHBondContact O-N 3.43Å
231	Q	93.9	Very high	95.5	Very high	92 Å²	92	112.5 Å²	112.5	43%	0.43	52%	0.515	S	S	.	.	H	α-helix	trans	-60.8	-41.3	176.6	-73.7	-179.6	-18.1	0	0	112.2	K227 E228 Q233 E234 F235	K227-Q231 WeakPolarHBondContact O-CG 3.37Å; K227-Q231 PolarHBondContact O-N 3.5Å; E228-Q231 PolarHBondContact O-N 2.71Å; Q231-Q233 PolarHBondContact O-N 3.08Å; Q231-E234 PolarHBondContact O-N 3.2Å; Q231-F235 WeakPolarHBondContact O-CD2 3.48Å; Q231-F235 PolarHBondContact O-N 3.31Å
232	R	96.3	Very high	95.4	Very high	137 Å²	137	111.6 Å²	111.6	52%	0.517	51%	0.514	S	S	.	.	H	α-helix	trans	-61.4	-41.9	175.2	-72	174.1	-177.6	120.8	11.9	111.8	E228 L229 K230 Q236	E228-R232 VanDerWaalsContact CD-NH2 3.35Å; E228-R232 WeakPolarHBondContact O-CG 3.28Å; E228-R232 PolarHBondContact O-N 2.63Å; E228-R232 IonicContact OE1-NH2 3.36Å; E228-R232 IonicContact OE2-CZ 2.67Å; E228-R232 IonicContact OE2-NH1 3.38Å; E228-R232 PolarHBondContact OE2-NH1 2.96Å; E228-R232 IonicContact OE2-NH2 3.79Å; E228-R232 PolarHBondContact OE2-NH2 3.42Å; L229-R232 PolarHBondContact O-N 3.22Å; K230-R232 VanDerWaalsContact C-N 3.34Å; K230-R232 PolarHBondContact O-N 3.02Å; R232-Q236 WeakPolarHBondContact O-CB 3.35Å; R232-Q236 PolarHBondContact O-N 3.31Å
233	Q	93.9	Very high	95.4	Very high	135 Å²	135	109.1 Å²	109.1	63%	0.631	51%	0.51	S	S	*	.	H	α-helix	trans	-64.6	-41.3	174.4	-72.6	176.1	-4.4	0	0	112.5	L229 K230 Q231 Q236 S237	L229-Q233 WeakPolarHBondContact O-CG 3.45Å; L229-Q233 PolarHBondContact O-N 2.98Å; K230-Q233 WeakPolarHBondContact O-CB 3.49Å; K230-Q233 PolarHBondContact O-N 3.39Å; Q231-Q233 PolarHBondContact O-N 3.08Å; Q233-Q236 PolarHBondContact O-N 2.93Å; Q233-S237 WeakPolarHBondContact O-CB 3.28Å; Q233-S237 PolarHBondContact O-N 3.11Å
234	E	93.9	Very high	95.4	Very high	93 Å²	93	109.6 Å²	109.6	44%	0.435	51%	0.509	S	S	.	.	H	α-helix	trans	-62.3	-48.5	176	-72.7	169	169.5	0	0	111.3	K230 Q231 Q236 S237 I238	K230-E234 WeakPolarHBondContact CE-OE1 3.38Å; K230-E234 IonicContact NZ-OE1 2.73Å; K230-E234 WeakPolarHBondContact O-CG 2.99Å; K230-E234 PolarHBondContact O-N 3.43Å; Q231-E234 PolarHBondContact O-N 3.2Å; E234-Q236 VanDerWaalsContact C-N 3.33Å; E234-Q236 PolarHBondContact O-N 2.9Å; E234-S237 PolarHBondContact O-N 2.99Å; E234-I238 WeakPolarHBondContact O-CD1 3.32Å; E234-I238 VanDerWaalsContact O-CG1 3.28Å; E234-I238 WeakPolarHBondContact O-CG1 3.4Å; E234-I238 PolarHBondContact O-N 3.4Å
235	F	95.2	Very high	95.2	Very high	151 Å²	151	109.9 Å²	109.9	66%	0.662	51%	0.51	S	S	*	.	H	α-helix	trans	-61	-38.4	175.4	-79.7	-61.4	0	0	0	113.3	Q231 R239	Q231-F235 WeakPolarHBondContact O-CD2 3.48Å; Q231-F235 PolarHBondContact O-N 3.31Å; F235-R239 PolarHBondContact O-N 3.08Å
236	Q	95.5	Very high	95.2	Very high	128 Å²	128	107.8 Å²	107.8	60%	0.598	51%	0.505	S	S	*	.	H	α-helix	trans	-70.7	-42	177.9	-170.7	161.8	2.1	0	0	111.7	R232 Q233 E234 I238 R239 D240	R232-Q236 WeakPolarHBondContact O-CB 3.35Å; R232-Q236 PolarHBondContact O-N 3.31Å; Q233-Q236 PolarHBondContact O-N 2.93Å; E234-Q236 VanDerWaalsContact C-N 3.33Å; E234-Q236 PolarHBondContact O-N 2.9Å; Q236-I238 VanDerWaalsContact C-N 3.34Å; Q236-I238 PolarHBondContact O-N 2.92Å; Q236-R239 PolarHBondContact O-N 3.22Å; Q236-R239 VanDerWaalsContact O-N 3.14Å; Q236-D240 PolarHBondContact O-N 3.23Å
237	S	94.6	Very high	95.2	Very high	72 Å²	72	108 Å²	108	50%	0.503	50%	0.503	S	S	.	.	H	α-helix	trans	-59.3	-42.5	174.2	-174.1	0	0	0	0	112.5	Q233 E234 D240 M241	Q233-S237 WeakPolarHBondContact O-CB 3.28Å; Q233-S237 PolarHBondContact O-N 3.11Å; E234-S237 PolarHBondContact O-N 2.99Å; S237-D240 PolarHBondContact O-N 3Å; S237-M241 WeakPolarHBondContact O-CB 3.45Å; S237-M241 PolarHBondContact O-N 3.41Å
238	I	95.4	Very high	95.2	Very high	86 Å²	86	107.2 Å²	107.2	44%	0.441	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-41.6	174.7	-68.9	164	0	0	0	111	E234 Q236 M241 I242	E234-I238 WeakPolarHBondContact O-CD1 3.32Å; E234-I238 VanDerWaalsContact O-CG1 3.28Å; E234-I238 WeakPolarHBondContact O-CG1 3.4Å; E234-I238 PolarHBondContact O-N 3.4Å; Q236-I238 VanDerWaalsContact C-N 3.34Å; Q236-I238 PolarHBondContact O-N 2.92Å; I238-M241 WeakPolarHBondContact O-CB 3.43Å; I238-M241 PolarHBondContact O-N 3.43Å; I238-I242 HydrophobicContact CG2-CD1 3.98Å; I238-I242 WeakPolarHBondContact O-CG1 3.49Å; I238-I242 PolarHBondContact O-N 2.91Å; I238-I242 VanDerWaalsContact O-N 3.08Å
239	R	96.9	Very high	94.8	Very high	179 Å²	179	106.5 Å²	106.5	68%	0.675	51%	0.506	S	S	*	.	H	α-helix	trans	-64.6	-48.1	176.6	-174.8	163.1	-65.4	-174.5	0.8	111.8	F235 Q236 M241 I242 D243	F235-R239 PolarHBondContact O-N 3.08Å; Q236-R239 PolarHBondContact O-N 3.22Å; Q236-R239 VanDerWaalsContact O-N 3.14Å; R239-M241 PolarHBondContact O-N 3.48Å; R239-I242 PolarHBondContact O-N 2.86Å; R239-D243 WeakPolarHBondContact O-CB 3.45Å; R239-D243 PolarHBondContact O-N 2.92Å
240	D	95.8	Very high	94.6	Very high	72 Å²	72	106.6 Å²	106.6	39%	0.385	51%	0.505	S	S	.	.	H	α-helix	trans	-61.7	-30.9	178	-67	-13.7	0	0	0	111.9	Q236 S237 R244	Q236-D240 PolarHBondContact O-N 3.23Å; S237-D240 PolarHBondContact O-N 3Å; D240-R244 WeakPolarHBondContact O-CB 3.4Å; D240-R244 VanDerWaalsContact O-CG 3.27Å; D240-R244 WeakPolarHBondContact O-CG 3.35Å; D240-R244 PolarHBondContact O-N 3.17Å; D240-R244 PolarHBondContact O-NE 3.2Å; D240-R244 PolarHBondContact O-NH1 3.03Å
241	M	95.6	Very high	94.5	Very high	83 Å²	83	102 Å²	102	41%	0.409	49%	0.493	S	S	.	.	H	α-helix	trans	-66.7	-51.5	173.1	-176.3	-179.4	77	0	0	112	S237 I238 R239 D243 R244 E245	S237-M241 WeakPolarHBondContact O-CB 3.45Å; S237-M241 PolarHBondContact O-N 3.41Å; I238-M241 WeakPolarHBondContact O-CB 3.43Å; I238-M241 PolarHBondContact O-N 3.43Å; R239-M241 PolarHBondContact O-N 3.48Å; M241-D243 VanDerWaalsContact C-N 3.27Å; M241-D243 PolarHBondContact O-N 3.1Å; M241-R244 WeakPolarHBondContact O-CB 3.44Å; M241-R244 PolarHBondContact O-N 2.87Å; M241-R244 VanDerWaalsContact O-N 3.12Å; M241-E245 PolarHBondContact O-N 3.31Å
242	I	95	Very high	94.4	Very high	88 Å²	88	105.2 Å²	105.2	45%	0.451	50%	0.501	S	S	.	.	H	α-helix	trans	-60	-40.2	177.3	-66.4	164	0	0	0	110.7	I238 R239 R244 E245 T246	I238-I242 HydrophobicContact CG2-CD1 3.98Å; I238-I242 WeakPolarHBondContact O-CG1 3.49Å; I238-I242 PolarHBondContact O-N 2.91Å; I238-I242 VanDerWaalsContact O-N 3.08Å; R239-I242 PolarHBondContact O-N 2.86Å; I242-R244 PolarHBondContact O-N 2.99Å; I242-E245 PolarHBondContact O-N 3Å; I242-T246 VanDerWaalsContact O-CB 3.31Å; I242-T246 WeakPolarHBondContact O-CB 3.28Å; I242-T246 PolarHBondContact O-N 3.24Å; I242-T246 PolarHBondContact O-OG1 3.35Å
243	D	96.6	Very high	94.2	Very high	72 Å²	72	104 Å²	104	39%	0.385	50%	0.501	S	S	.	.	H	α-helix	trans	-63.7	-38.1	176.4	-108.4	47	0	0	0	112.6	R239 M241 K247	R239-D243 WeakPolarHBondContact O-CB 3.45Å; R239-D243 PolarHBondContact O-N 2.92Å; M241-D243 VanDerWaalsContact C-N 3.27Å; M241-D243 PolarHBondContact O-N 3.1Å; D243-K247 WeakPolarHBondContact O-CB 3.46Å; D243-K247 WeakPolarHBondContact O-CD 3.43Å; D243-K247 WeakPolarHBondContact O-CG 3.41Å; D243-K247 PolarHBondContact O-N 3.42Å; D243-K247 VanDerWaalsContact O-N 3.15Å; D243-K247 IonicContact OD2-NZ 3.73Å; D243-K247 PolarHBondContact OD2-NZ 3.45Å
244	R	95.7	Very high	94.2	Very high	133 Å²	133	103.1 Å²	103.1	50%	0.502	50%	0.497	S	S	.	.	H	α-helix	trans	-67.1	-51.1	173.7	-77.8	-177.5	-61.4	-98.3	2.7	111.3	D240 M241 I242 T246 K247 E248	D240-R244 WeakPolarHBondContact O-CB 3.4Å; D240-R244 VanDerWaalsContact O-CG 3.27Å; D240-R244 WeakPolarHBondContact O-CG 3.35Å; D240-R244 PolarHBondContact O-N 3.17Å; D240-R244 PolarHBondContact O-NE 3.2Å; D240-R244 PolarHBondContact O-NH1 3.03Å; M241-R244 WeakPolarHBondContact O-CB 3.44Å; M241-R244 PolarHBondContact O-N 2.87Å; M241-R244 VanDerWaalsContact O-N 3.12Å; I242-R244 PolarHBondContact O-N 2.99Å; R244-T246 VanDerWaalsContact C-N 3.29Å; R244-T246 PolarHBondContact O-N 2.9Å; R244-K247 PolarHBondContact O-N 3.3Å; R244-K247 VanDerWaalsContact O-N 3.17Å; R244-E248 PolarHBondContact O-N 2.94Å
245	E	93.1	Very high	94.1	Very high	116 Å²	116	105.4 Å²	105.4	54%	0.542	51%	0.505	S	S	.	.	H	α-helix	trans	-59.2	-40	179.2	-71.3	-178.5	168.8	0	0	112.1	M241 I242 E248 S249	M241-E245 PolarHBondContact O-N 3.31Å; I242-E245 PolarHBondContact O-N 3Å; E245-E248 PolarHBondContact O-N 3.3Å; E245-S249 VanDerWaalsContact O-CB 3.31Å; E245-S249 WeakPolarHBondContact O-CB 3.47Å; E245-S249 PolarHBondContact O-N 3.28Å
246	T	95.1	Very high	94	Very high	72 Å²	72	103 Å²	103	44%	0.442	50%	0.499	S	S	.	.	H	α-helix	trans	-65	-44.2	176.6	-55.5	0	0	0	0	111.4	I242 R244 S249 M250	I242-T246 VanDerWaalsContact O-CB 3.31Å; I242-T246 WeakPolarHBondContact O-CB 3.28Å; I242-T246 PolarHBondContact O-N 3.24Å; I242-T246 PolarHBondContact O-OG1 3.35Å; R244-T246 VanDerWaalsContact C-N 3.29Å; R244-T246 PolarHBondContact O-N 2.9Å; T246-S249 PolarHBondContact O-N 2.91Å; T246-M250 HydrophobicContact CG2-CE 4.41Å; T246-M250 WeakPolarHBondContact O-CG 3.46Å; T246-M250 PolarHBondContact O-N 3.46Å
247	K	95.4	Very high	93.9	Very high	121 Å²	121	101 Å²	101	53%	0.526	49%	0.488	S	S	.	.	H	α-helix	trans	-65	-39.9	176	-71.9	161.5	-163.8	153.2	0	111.9	D243 R244 M250 G251	D243-K247 WeakPolarHBondContact O-CB 3.46Å; D243-K247 WeakPolarHBondContact O-CD 3.43Å; D243-K247 WeakPolarHBondContact O-CG 3.41Å; D243-K247 PolarHBondContact O-N 3.42Å; D243-K247 VanDerWaalsContact O-N 3.15Å; D243-K247 IonicContact OD2-NZ 3.73Å; D243-K247 PolarHBondContact OD2-NZ 3.45Å; R244-K247 PolarHBondContact O-N 3.3Å; R244-K247 VanDerWaalsContact O-N 3.17Å; K247-M250 HydrophobicContact CG-CE 4.24Å; K247-G251 PolarHBondContact O-N 3.45Å
248	E	93.6	Very high	93.9	Very high	105 Å²	105	103 Å²	103	49%	0.491	49%	0.49	S	S	.	.	H	α-helix	trans	-64.4	-43.3	173	-78.1	-167.1	-139.9	0	0	112.6	R244 E245 G251 R252	R244-E248 PolarHBondContact O-N 2.94Å; E245-E248 PolarHBondContact O-N 3.3Å; E248-G251 PolarHBondContact O-N 2.89Å; E248-R252 WeakPolarHBondContact O-CB 3.25Å; E248-R252 WeakPolarHBondContact O-CG 3.5Å; E248-R252 PolarHBondContact O-N 3.19Å; E248-R252 IonicContact OE2-CZ 2.71Å; E248-R252 IonicContact OE2-NE 3.02Å; E248-R252 IonicContact OE2-NH2 3.71Å; E248-R252 PolarHBondContact OE2-NH2 2.88Å
249	S	89.2	Confident	93.7	Very high	79 Å²	79	102.9 Å²	102.9	55%	0.552	49%	0.487	S	S	*	.	H	α-helix	trans	-60.1	-46.4	177.5	-173.5	0	0	0	0	111.5	E245 T246 R252 Q253	E245-S249 VanDerWaalsContact O-CB 3.31Å; E245-S249 WeakPolarHBondContact O-CB 3.47Å; E245-S249 PolarHBondContact O-N 3.28Å; T246-S249 PolarHBondContact O-N 2.91Å; S249-R252 PolarHBondContact O-N 3.49Å; S249-Q253 PolarHBondContact O-N 3Å
250	M	91.1	Very high	93.5	Very high	101 Å²	101	100.2 Å²	100.2	50%	0.498	48%	0.482	S	S	.	.	H	α-helix	trans	-59.8	-49	173	-69.4	-171.8	-62.8	0	0	111.7	T246 K247 R252 Q253 E254	T246-M250 HydrophobicContact CG2-CE 4.41Å; T246-M250 WeakPolarHBondContact O-CG 3.46Å; T246-M250 PolarHBondContact O-N 3.46Å; K247-M250 HydrophobicContact CG-CE 4.24Å; M250-R252 VanDerWaalsContact C-N 3.31Å; M250-R252 PolarHBondContact O-N 2.97Å; M250-Q253 CarbonylContact O-C 3.57Å; M250-Q253 WeakPolarHBondContact O-CA 3.28Å; M250-Q253 WeakPolarHBondContact O-CB 3.33Å; M250-Q253 PolarHBondContact O-N 3.15Å; M250-E254 WeakPolarHBondContact O-CG 3.11Å; M250-E254 PolarHBondContact O-N 3.27Å
251	G	92.9	Very high	93.4	Very high	26 Å²	26	103 Å²	103	27%	0.268	49%	0.488	S	S	.	.	H	α-helix	trans	-62.4	-32.9	178.9	0	0	0	0	0	114.1	K247 E248 K255	K247-G251 PolarHBondContact O-N 3.45Å; E248-G251 PolarHBondContact O-N 2.89Å; G251-K255 WeakPolarHBondContact O-CG 2.98Å; G251-K255 PolarHBondContact O-N 3.27Å; G251-K255 VanDerWaalsContact O-N 3.13Å
252	R	91.6	Very high	93.3	Very high	161 Å²	161	104.5 Å²	104.5	61%	0.608	49%	0.493	S	S	*	.	H	α-helix	trans	-67.1	-42.9	170.8	-68.4	166.9	-162.5	-161.2	8.4	110.9	E248 S249 M250 K255 L256	E248-R252 WeakPolarHBondContact O-CB 3.25Å; E248-R252 WeakPolarHBondContact O-CG 3.5Å; E248-R252 PolarHBondContact O-N 3.19Å; E248-R252 IonicContact OE2-CZ 2.71Å; E248-R252 IonicContact OE2-NE 3.02Å; E248-R252 IonicContact OE2-NH2 3.71Å; E248-R252 PolarHBondContact OE2-NH2 2.88Å; S249-R252 PolarHBondContact O-N 3.49Å; M250-R252 VanDerWaalsContact C-N 3.31Å; M250-R252 PolarHBondContact O-N 2.97Å; R252-K255 PolarHBondContact O-N 3.12Å; R252-L256 WeakPolarHBondContact O-CG 3.48Å; R252-L256 PolarHBondContact O-N 3.31Å
253	Q	91.5	Very high	93.2	Very high	110 Å²	110	108 Å²	108	51%	0.514	50%	0.501	S	S	.	.	H	α-helix	trans	-67	-35.6	177.5	-158.1	-164.2	49.5	0	0	112.6	S249 M250 K257	S249-Q253 PolarHBondContact O-N 3Å; M250-Q253 CarbonylContact O-C 3.57Å; M250-Q253 WeakPolarHBondContact O-CA 3.28Å; M250-Q253 WeakPolarHBondContact O-CB 3.33Å; M250-Q253 PolarHBondContact O-N 3.15Å; Q253-K257 WeakPolarHBondContact O-CG 3.35Å; Q253-K257 PolarHBondContact O-N 2.85Å; Q253-K257 VanDerWaalsContact O-N 3.14Å
254	E	93.6	Very high	93.2	Very high	118 Å²	118	109.4 Å²	109.4	55%	0.551	51%	0.507	S	S	*	.	H	α-helix	trans	-68.7	-43.3	176	-72	-172.2	139.6	0	0	112.1	M250 L256 K257 E258	M250-E254 WeakPolarHBondContact O-CG 3.11Å; M250-E254 PolarHBondContact O-N 3.27Å; E254-L256 VanDerWaalsContact C-N 3.33Å; E254-L256 PolarHBondContact O-N 3.27Å; E254-K257 CarbonylContact O-C 3.57Å; E254-K257 WeakPolarHBondContact O-CA 3.27Å; E254-K257 WeakPolarHBondContact O-CB 3.38Å; E254-K257 PolarHBondContact O-N 2.91Å; E254-K257 VanDerWaalsContact O-N 3.09Å; E254-E258 WeakPolarHBondContact O-CG 3.29Å; E254-E258 PolarHBondContact O-N 3.2Å
255	K	93.1	Very high	93.2	Very high	140 Å²	140	109.8 Å²	109.8	61%	0.609	51%	0.512	S	S	*	.	H	α-helix	trans	-56.2	-44.6	172.6	-75.4	175.4	179.4	-176.2	0	112.4	G251 R252 K257 E258 E259	G251-K255 WeakPolarHBondContact O-CG 2.98Å; G251-K255 PolarHBondContact O-N 3.27Å; G251-K255 VanDerWaalsContact O-N 3.13Å; R252-K255 PolarHBondContact O-N 3.12Å; K255-K257 VanDerWaalsContact C-N 3.33Å; K255-K257 PolarHBondContact O-N 2.9Å; K255-E258 WeakPolarHBondContact O-CB 3.5Å; K255-E258 PolarHBondContact O-N 2.79Å; K255-E258 VanDerWaalsContact O-N 3.08Å; K255-E259 PolarHBondContact O-N 2.71Å
256	L	92.6	Very high	93.2	Very high	102 Å²	102	108.4 Å²	108.4	53%	0.534	51%	0.508	S	S	.	.	H	α-helix	trans	-61.9	-39	175.8	-70.1	171.1	0	0	0	112.5	R252 E254 E258 Q260	R252-L256 WeakPolarHBondContact O-CG 3.48Å; R252-L256 PolarHBondContact O-N 3.31Å; E254-L256 VanDerWaalsContact C-N 3.33Å; E254-L256 PolarHBondContact O-N 3.27Å; L256-E258 VanDerWaalsContact C-N 3.33Å; L256-Q260 WeakPolarHBondContact O-CG 3.37Å; L256-Q260 PolarHBondContact O-N 3.17Å
257	K	94	Very high	93.2	Very high	85 Å²	85	110.6 Å²	110.6	37%	0.37	52%	0.516	S	S	.	.	H	α-helix	trans	-65.7	-35.3	172.8	-69.8	162.5	178.4	166.2	0	111.6	Q253 E254 K255 R261	Q253-K257 WeakPolarHBondContact O-CG 3.35Å; Q253-K257 PolarHBondContact O-N 2.85Å; Q253-K257 VanDerWaalsContact O-N 3.14Å; E254-K257 CarbonylContact O-C 3.57Å; E254-K257 WeakPolarHBondContact O-CA 3.27Å; E254-K257 WeakPolarHBondContact O-CB 3.38Å; E254-K257 PolarHBondContact O-N 2.91Å; E254-K257 VanDerWaalsContact O-N 3.09Å; K255-K257 VanDerWaalsContact C-N 3.33Å; K255-K257 PolarHBondContact O-N 2.9Å; K257-R261 WeakPolarHBondContact O-CB 3.41Å; K257-R261 VanDerWaalsContact O-CG 3.28Å; K257-R261 WeakPolarHBondContact O-CG 3.46Å; K257-R261 PolarHBondContact O-N 2.77Å
258	E	93.7	Very high	93.2	Very high	113 Å²	113	109 Å²	109	53%	0.528	51%	0.513	S	S	.	.	H	α-helix	trans	-70.6	-42.6	175.8	-73.3	-169.6	153.3	0	0	113.2	E254 K255 L256 Q260 R261 H262	E254-E258 WeakPolarHBondContact O-CG 3.29Å; E254-E258 PolarHBondContact O-N 3.2Å; K255-E258 WeakPolarHBondContact O-CB 3.5Å; K255-E258 PolarHBondContact O-N 2.79Å; K255-E258 VanDerWaalsContact O-N 3.08Å; L256-E258 VanDerWaalsContact C-N 3.33Å; E258-Q260 VanDerWaalsContact C-N 3.33Å; E258-Q260 PolarHBondContact O-N 3.17Å; E258-R261 CarbonylContact O-C 3.57Å; E258-R261 PolarHBondContact O-N 3.01Å; E258-R261 IonicContact OE1-NH2 3.84Å; E258-H262 WeakPolarHBondContact O-CB 3.42Å; E258-H262 PolarHBondContact O-N 3.43Å
259	E	92.1	Very high	93.2	Very high	85 Å²	85	108.7 Å²	108.7	40%	0.397	52%	0.515	S	S	.	.	H	α-helix	trans	-58.5	-44.7	171.5	-75.1	-176.2	-134.4	0	0	111.6	K255 H262 R263	K255-E259 PolarHBondContact O-N 2.71Å; E259-H262 PolarHBondContact O-N 3.32Å; E259-R263 WeakPolarHBondContact O-CB 3.31Å; E259-R263 VanDerWaalsContact O-CG 3.23Å; E259-R263 WeakPolarHBondContact O-CG 3.44Å; E259-R263 PolarHBondContact O-N 2.96Å; E259-R263 IonicContact OE2-CZ 3.63Å; E259-R263 IonicContact OE2-NH2 2.65Å; E259-R263 PolarHBondContact OE2-NH2 3.1Å
260	Q	91.5	Very high	93.3	Very high	122 Å²	122	112.9 Å²	112.9	57%	0.57	52%	0.519	S	S	*	.	H	α-helix	trans	-60.2	-47.3	174.6	-74	175.4	-8.8	0	0	111.5	L256 E258 H262 R263 I264	L256-Q260 WeakPolarHBondContact O-CG 3.37Å; L256-Q260 PolarHBondContact O-N 3.17Å; E258-Q260 VanDerWaalsContact C-N 3.33Å; E258-Q260 PolarHBondContact O-N 3.17Å; Q260-H262 VanDerWaalsContact C-N 3.28Å; Q260-H262 PolarHBondContact O-N 2.95Å; Q260-R263 PolarHBondContact O-N 3.32Å; Q260-I264 WeakPolarHBondContact O-CD1 3.35Å; Q260-I264 VanDerWaalsContact O-CG1 3.28Å; Q260-I264 WeakPolarHBondContact O-CG1 3.49Å; Q260-I264 PolarHBondContact O-N 3.15Å
261	R	94.3	Very high	93.5	Very high	132 Å²	132	111.3 Å²	111.3	50%	0.498	51%	0.514	S	S	.	.	H	α-helix	trans	-59	-37.6	174.3	-73.9	-174.5	-68.2	-114.8	16.9	112.4	K257 E258 K265	K257-R261 WeakPolarHBondContact O-CB 3.41Å; K257-R261 VanDerWaalsContact O-CG 3.28Å; K257-R261 WeakPolarHBondContact O-CG 3.46Å; K257-R261 PolarHBondContact O-N 2.77Å; E258-R261 CarbonylContact O-C 3.57Å; E258-R261 PolarHBondContact O-N 3.01Å; E258-R261 IonicContact OE1-NH2 3.84Å; R261-K265 WeakPolarHBondContact O-CG 3.5Å; R261-K265 PolarHBondContact O-N 2.87Å; R261-K265 VanDerWaalsContact O-N 3.09Å
262	H	93.4	Very high	93.5	Very high	114 Å²	114	117.5 Å²	117.5	53%	0.528	53%	0.53	S	S	.	.	H	α-helix	trans	-72.5	-44.8	179.7	-174.9	65.4	0	0	0	112.1	E258 E259 Q260 I264 K265 I266	E258-H262 WeakPolarHBondContact O-CB 3.42Å; E258-H262 PolarHBondContact O-N 3.43Å; E259-H262 PolarHBondContact O-N 3.32Å; Q260-H262 VanDerWaalsContact C-N 3.28Å; Q260-H262 PolarHBondContact O-N 2.95Å; H262-I264 VanDerWaalsContact C-N 3.32Å; H262-I264 PolarHBondContact O-N 3.12Å; H262-K265 WeakPolarHBondContact O-CB 3.29Å; H262-K265 PolarHBondContact O-N 3.35Å; H262-K265 VanDerWaalsContact O-N 3.11Å; H262-I266 WeakPolarHBondContact O-CG1 3.47Å; H262-I266 PolarHBondContact O-N 3.48Å
263	R	93	Very high	93.5	Very high	162 Å²	162	114.9 Å²	114.9	61%	0.611	52%	0.524	S	S	*	.	H	α-helix	trans	-58.5	-42.2	174	-67.8	170.3	-160.2	-157.7	8.5	111.4	E259 Q260 I266 L267	E259-R263 WeakPolarHBondContact O-CB 3.31Å; E259-R263 VanDerWaalsContact O-CG 3.23Å; E259-R263 WeakPolarHBondContact O-CG 3.44Å; E259-R263 PolarHBondContact O-N 2.96Å; E259-R263 IonicContact OE2-CZ 3.63Å; E259-R263 IonicContact OE2-NH2 2.65Å; E259-R263 PolarHBondContact OE2-NH2 3.1Å; Q260-R263 PolarHBondContact O-N 3.32Å; R263-I266 PolarHBondContact O-N 2.87Å; R263-L267 PolarHBondContact O-N 3.12Å
264	I	95.8	Very high	93.6	Very high	100 Å²	100	114.3 Å²	114.3	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-63.4	-41.7	174.3	-67.6	165	0	0	0	111.5	Q260 H262 L267 N268	Q260-I264 WeakPolarHBondContact O-CD1 3.35Å; Q260-I264 VanDerWaalsContact O-CG1 3.28Å; Q260-I264 WeakPolarHBondContact O-CG1 3.49Å; Q260-I264 PolarHBondContact O-N 3.15Å; H262-I264 VanDerWaalsContact C-N 3.32Å; H262-I264 PolarHBondContact O-N 3.12Å; I264-L267 PolarHBondContact O-N 2.96Å; I264-N268 WeakPolarHBondContact O-CB 3.17Å; I264-N268 VanDerWaalsContact O-CG 3.25Å; I264-N268 PolarHBondContact O-N 3.28Å; I264-N268 PolarHBondContact O-ND2 3.08Å
265	K	96	Very high	93.5	Very high	141 Å²	141	113.3 Å²	113.3	61%	0.613	52%	0.52	S	S	*	.	H	α-helix	trans	-60.9	-45.3	174.7	-76.6	175	179.5	-175.8	0	112.1	R261 H262 N268 L269	R261-K265 WeakPolarHBondContact O-CG 3.5Å; R261-K265 PolarHBondContact O-N 2.87Å; R261-K265 VanDerWaalsContact O-N 3.09Å; H262-K265 WeakPolarHBondContact O-CB 3.29Å; H262-K265 PolarHBondContact O-N 3.35Å; H262-K265 VanDerWaalsContact O-N 3.11Å; K265-N268 PolarHBondContact O-N 2.99Å; K265-L269 WeakPolarHBondContact O-CG 3.41Å; K265-L269 PolarHBondContact O-N 3.25Å
266	I	94.1	Very high	93.4	Very high	88 Å²	88	112.2 Å²	112.2	45%	0.451	52%	0.516	S	S	.	.	H	α-helix	trans	-60.7	-46.3	176.3	-67.9	167.5	0	0	0	110.6	H262 R263 N268 L269 R270	H262-I266 WeakPolarHBondContact O-CG1 3.47Å; H262-I266 PolarHBondContact O-N 3.48Å; R263-I266 PolarHBondContact O-N 2.87Å; I266-N268 VanDerWaalsContact C-N 3.34Å; I266-N268 PolarHBondContact O-N 3.2Å; I266-L269 PolarHBondContact O-N 3.13Å; I266-R270 PolarHBondContact O-N 3.35Å
267	L	94.1	Very high	93.2	Very high	117 Å²	117	111.7 Å²	111.7	61%	0.613	51%	0.512	S	S	*	.	H	α-helix	trans	-59.7	-45.5	179.6	-153	80.8	0	0	0	111.4	R263 I264 L269 R270 V271	R263-L267 PolarHBondContact O-N 3.12Å; I264-L267 PolarHBondContact O-N 2.96Å; L267-L269 VanDerWaalsContact C-N 3.35Å; L267-L269 PolarHBondContact O-N 2.95Å; L267-R270 PolarHBondContact O-N 3.29Å; L267-V271 WeakPolarHBondContact O-CG2 3.5Å; L267-V271 PolarHBondContact O-N 3.48Å
268	N	95.1	Very high	93.2	Very high	87 Å²	87	115.7 Å²	115.7	47%	0.465	52%	0.524	S	S	.	.	H	α-helix	trans	-66.7	-31.8	178.4	-70.5	-14.5	0	0	0	113.3	I264 K265 I266 R272	I264-N268 WeakPolarHBondContact O-CB 3.17Å; I264-N268 VanDerWaalsContact O-CG 3.25Å; I264-N268 PolarHBondContact O-N 3.28Å; I264-N268 PolarHBondContact O-ND2 3.08Å; K265-N268 PolarHBondContact O-N 2.99Å; I266-N268 VanDerWaalsContact C-N 3.34Å; I266-N268 PolarHBondContact O-N 3.2Å; N268-R272 WeakPolarHBondContact O-CG 3.37Å; N268-R272 PolarHBondContact O-N 2.83Å
269	L	94	Very high	93	Very high	99 Å²	99	115.7 Å²	115.7	52%	0.518	52%	0.524	S	S	.	.	H	α-helix	trans	-67.6	-47.8	171.9	-73.3	169.6	0	0	0	110.6	K265 I266 L267 V271 R272 E273	K265-L269 WeakPolarHBondContact O-CG 3.41Å; K265-L269 PolarHBondContact O-N 3.25Å; I266-L269 PolarHBondContact O-N 3.13Å; L267-L269 VanDerWaalsContact C-N 3.35Å; L267-L269 PolarHBondContact O-N 2.95Å; L269-V271 VanDerWaalsContact C-N 3.31Å; L269-V271 PolarHBondContact O-N 3.2Å; L269-R272 WeakPolarHBondContact O-CB 3.19Å; L269-R272 PolarHBondContact O-N 3.41Å; L269-E273 WeakPolarHBondContact O-CG 3.24Å; L269-E273 PolarHBondContact O-N 3.48Å
270	R	92.9	Very high	93	Very high	168 Å²	168	117.7 Å²	117.7	63%	0.634	53%	0.528	S	S	*	.	H	α-helix	trans	-64.2	-33.6	-179.6	-164.5	171.3	-175.2	164.3	2.1	113.2	I266 L267 E273 L274	I266-R270 PolarHBondContact O-N 3.35Å; L267-R270 PolarHBondContact O-N 3.29Å; R270-E273 PolarHBondContact O-N 3.01Å; R270-L274 VanDerWaalsContact O-CG 3.31Å; R270-L274 WeakPolarHBondContact O-CG 3.33Å; R270-L274 PolarHBondContact O-N 2.9Å; R270-L274 VanDerWaalsContact O-N 3.09Å
271	V	93.9	Very high	92.8	Very high	67 Å²	67	117.7 Å²	117.7	41%	0.406	53%	0.528	S	S	.	.	H	α-helix	trans	-61.5	-46.9	170.5	169.2	0	0	0	0	110.8	L267 L269 E273 L274 E275	L267-V271 WeakPolarHBondContact O-CG2 3.5Å; L267-V271 PolarHBondContact O-N 3.48Å; L269-V271 VanDerWaalsContact C-N 3.31Å; L269-V271 PolarHBondContact O-N 3.2Å; V271-E273 VanDerWaalsContact C-N 3.34Å; V271-E273 PolarHBondContact O-N 2.97Å; V271-L274 PolarHBondContact O-N 3.45Å; V271-E275 WeakPolarHBondContact O-CG 3.49Å; V271-E275 PolarHBondContact O-N 3.49Å
272	R	93.6	Very high	92.7	Very high	157 Å²	157	113.6 Å²	113.6	59%	0.592	52%	0.522	S	S	*	.	H	α-helix	trans	-64.4	-35.8	177.6	-69.9	169.3	176.4	-168.7	-2.5	113	N268 L269 E275 Q276	N268-R272 WeakPolarHBondContact O-CG 3.37Å; N268-R272 PolarHBondContact O-N 2.83Å; L269-R272 WeakPolarHBondContact O-CB 3.19Å; L269-R272 PolarHBondContact O-N 3.41Å; R272-E275 PolarHBondContact O-N 2.85Å; R272-Q276 WeakPolarHBondContact O-CB 3.49Å; R272-Q276 VanDerWaalsContact O-CG 3.31Å; R272-Q276 WeakPolarHBondContact O-CG 3.48Å; R272-Q276 PolarHBondContact O-N 3.48Å
273	E	91.3	Very high	92.6	Very high	106 Å²	106	113.4 Å²	113.4	50%	0.495	52%	0.521	S	S	.	.	H	α-helix	trans	-63.3	-44.2	174.8	-71.7	167.5	171.7	0	0	111.4	L269 R270 V271 Q276 Q277	L269-E273 WeakPolarHBondContact O-CG 3.24Å; L269-E273 PolarHBondContact O-N 3.48Å; R270-E273 PolarHBondContact O-N 3.01Å; V271-E273 VanDerWaalsContact C-N 3.34Å; V271-E273 PolarHBondContact O-N 2.97Å; E273-Q276 PolarHBondContact O-N 3.46Å; E273-Q277 WeakPolarHBondContact O-CG 3.32Å; E273-Q277 PolarHBondContact O-N 2.9Å
274	L	92.6	Very high	92.4	Very high	98 Å²	98	110.3 Å²	110.3	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-65.5	-40	174.9	-69.5	166	0	0	0	112	R270 V271 Q277 R278	R270-L274 VanDerWaalsContact O-CG 3.31Å; R270-L274 WeakPolarHBondContact O-CG 3.33Å; R270-L274 PolarHBondContact O-N 2.9Å; R270-L274 VanDerWaalsContact O-N 3.09Å; V271-L274 PolarHBondContact O-N 3.45Å; L274-Q277 PolarHBondContact O-N 2.95Å; L274-R278 WeakPolarHBondContact O-CB 3.46Å; L274-R278 PolarHBondContact O-N 3.41Å
275	E	91.9	Very high	92.1	Very high	97 Å²	97	108.8 Å²	108.8	45%	0.453	51%	0.507	S	S	.	.	H	α-helix	trans	-60.2	-46.1	172.5	-72	172	152.9	0	0	111.1	V271 R272 Q277 R278 H279	V271-E275 WeakPolarHBondContact O-CG 3.49Å; V271-E275 PolarHBondContact O-N 3.49Å; R272-E275 PolarHBondContact O-N 2.85Å; E275-Q277 PolarHBondContact O-N 2.93Å; E275-R278 PolarHBondContact O-N 3.4Å; E275-H279 WeakPolarHBondContact O-CB 3.45Å; E275-H279 PolarHBondContact O-CD2 3.45Å; E275-H279 VanDerWaalsContact O-CD2 3.22Å; E275-H279 PolarHBondContact O-N 3.13Å
276	Q	92.2	Very high	91.8	Very high	116 Å²	116	108.8 Å²	108.8	54%	0.542	51%	0.507	S	S	.	.	H	α-helix	trans	-67	-32.3	176.1	-73.9	178.7	2.5	0	0	113.5	R272 E273 R280	R272-Q276 WeakPolarHBondContact O-CB 3.49Å; R272-Q276 VanDerWaalsContact O-CG 3.31Å; R272-Q276 WeakPolarHBondContact O-CG 3.48Å; R272-Q276 PolarHBondContact O-N 3.48Å; E273-Q276 PolarHBondContact O-N 3.46Å; Q276-R280 WeakPolarHBondContact O-CG 3.48Å; Q276-R280 PolarHBondContact O-N 3.32Å; Q276-R280 VanDerWaalsContact O-N 3.14Å; Q276-R280 PolarHBondContact O-NE 3.26Å
277	Q	88.8	Confident	91.5	Very high	92 Å²	92	109.8 Å²	109.8	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-64.8	-53.2	171	-77.4	173.9	-25.2	0	0	110.2	E273 L274 E275 H279 R280 E281	E273-Q277 WeakPolarHBondContact O-CG 3.32Å; E273-Q277 PolarHBondContact O-N 2.9Å; L274-Q277 PolarHBondContact O-N 2.95Å; E275-Q277 PolarHBondContact O-N 2.93Å; Q277-H279 VanDerWaalsContact C-N 3.26Å; Q277-H279 PolarHBondContact O-N 3.06Å; Q277-R280 PolarHBondContact O-N 3.21Å; Q277-E281 WeakPolarHBondContact O-CG 3.48Å; Q277-E281 PolarHBondContact O-N 2.97Å
278	R	92.3	Very high	91.2	Very high	168 Å²	168	111.7 Å²	111.7	63%	0.634	51%	0.509	S	S	*	.	H	α-helix	trans	-59.2	-34.2	177.9	-164.7	-176.4	69.2	171.3	-0.1	113.1	L274 E275 A282	L274-R278 WeakPolarHBondContact O-CB 3.46Å; L274-R278 PolarHBondContact O-N 3.41Å; E275-R278 PolarHBondContact O-N 3.4Å; R278-A282 VanDerWaalsContact O-CB 3.31Å; R278-A282 WeakPolarHBondContact O-CB 3.46Å; R278-A282 PolarHBondContact O-N 3.38Å
279	H	90.7	Very high	90.9	Very high	113 Å²	113	110.9 Å²	110.9	52%	0.523	50%	0.503	S	S	.	.	H	α-helix	trans	-66.3	-46.7	172.7	-90.7	-76.4	0	0	0	112.4	E275 Q277 A282 E283	E275-H279 WeakPolarHBondContact O-CB 3.45Å; E275-H279 PolarHBondContact O-CD2 3.45Å; E275-H279 VanDerWaalsContact O-CD2 3.22Å; E275-H279 PolarHBondContact O-N 3.13Å; Q277-H279 VanDerWaalsContact C-N 3.26Å; Q277-H279 PolarHBondContact O-N 3.06Å; H279-A282 PolarHBondContact O-N 3.45Å; H279-E283 WeakPolarHBondContact O-CG 3.45Å; H279-E283 PolarHBondContact O-N 2.77Å
280	R	90.8	Very high	90.6	Very high	128 Å²	128	108.4 Å²	108.4	48%	0.483	50%	0.496	S	S	.	.	H	α-helix	trans	-64	-39.6	176.3	-76.3	173	-72.4	-167.9	-2.6	112.4	Q276 Q277 E283 L284	Q276-R280 WeakPolarHBondContact O-CG 3.48Å; Q276-R280 PolarHBondContact O-N 3.32Å; Q276-R280 VanDerWaalsContact O-N 3.14Å; Q276-R280 PolarHBondContact O-NE 3.26Å; Q277-R280 PolarHBondContact O-N 3.21Å; R280-E283 PolarHBondContact O-N 3.12Å; R280-L284 WeakPolarHBondContact O-CB 3.42Å; R280-L284 VanDerWaalsContact O-CG 3.32Å; R280-L284 WeakPolarHBondContact O-CG 3.36Å; R280-L284 PolarHBondContact O-N 3.02Å
281	E	89.2	Confident	90.4	Very high	122 Å²	122	104.3 Å²	104.3	57%	0.57	48%	0.484	S	S	*	.	H	α-helix	trans	-60.9	-44.8	173.3	-71.4	164.1	-175.6	0	0	111.4	Q277 E283 L284 E285	Q277-E281 WeakPolarHBondContact O-CG 3.48Å; Q277-E281 PolarHBondContact O-N 2.97Å; E281-E283 VanDerWaalsContact C-N 3.32Å; E281-E283 PolarHBondContact O-N 3.47Å; E281-L284 PolarHBondContact O-N 3.21Å; E281-E285 VanDerWaalsContact O-CB 3.28Å; E281-E285 WeakPolarHBondContact O-CB 3.36Å; E281-E285 PolarHBondContact O-N 3.27Å
282	A	92.2	Very high	90.2	Very high	46 Å²	46	101.2 Å²	101.2	38%	0.38	47%	0.466	S	S	.	.	H	α-helix	trans	-68.7	-26.6	176.2	0	0	0	0	0	113.6	R278 H279 K286	R278-A282 VanDerWaalsContact O-CB 3.31Å; R278-A282 WeakPolarHBondContact O-CB 3.46Å; R278-A282 PolarHBondContact O-N 3.38Å; H279-A282 PolarHBondContact O-N 3.45Å; A282-K286 WeakPolarHBondContact O-CB 3.19Å; A282-K286 WeakPolarHBondContact O-CD 3.36Å; A282-K286 VanDerWaalsContact O-CG 3.22Å; A282-K286 WeakPolarHBondContact O-CG 3.36Å; A282-K286 PolarHBondContact O-N 3.19Å; A282-K286 VanDerWaalsContact O-N 3.14Å
283	E	90	Very high	89.9	Confident	109 Å²	109	99.4 Å²	99.4	51%	0.509	46%	0.459	S	S	.	.	H	α-helix	trans	-75.9	-46.1	172.8	-76.4	173.6	175	0	0	111.9	H279 R280 E281 E285 K286 Q287	H279-E283 WeakPolarHBondContact O-CG 3.45Å; H279-E283 PolarHBondContact O-N 2.77Å; R280-E283 PolarHBondContact O-N 3.12Å; E281-E283 VanDerWaalsContact C-N 3.32Å; E281-E283 PolarHBondContact O-N 3.47Å; E283-E285 VanDerWaalsContact C-N 3.28Å; E283-E285 PolarHBondContact O-N 2.87Å; E283-K286 WeakPolarHBondContact O-CB 3.5Å; E283-K286 PolarHBondContact O-N 3.11Å; E283-Q287 WeakPolarHBondContact O-CG 3.44Å; E283-Q287 PolarHBondContact O-N 3.14Å
284	L	89.5	Confident	89.8	Confident	98 Å²	98	99.2 Å²	99.2	51%	0.513	46%	0.458	S	S	.	.	H	α-helix	trans	-59.5	-39.5	172.8	-72	168.7	0	0	0	111.4	R280 E281 Q287 R288	R280-L284 WeakPolarHBondContact O-CB 3.42Å; R280-L284 VanDerWaalsContact O-CG 3.32Å; R280-L284 WeakPolarHBondContact O-CG 3.36Å; R280-L284 PolarHBondContact O-N 3.02Å; E281-L284 PolarHBondContact O-N 3.21Å; L284-Q287 WeakPolarHBondContact O-CB 3.43Å; L284-Q287 PolarHBondContact O-N 3.18Å; L284-R288 WeakPolarHBondContact O-CG 3.35Å; L284-R288 PolarHBondContact O-N 3.3Å
285	E	88.6	Confident	89.7	Confident	68 Å²	68	98.3 Å²	98.3	32%	0.318	45%	0.448	S	S	.	.	H	α-helix	trans	-67.9	-40.4	176.6	-175.4	50.6	-146.9	0	0	112.2	E281 E283 Q287 R288 Q289	E281-E285 VanDerWaalsContact O-CB 3.28Å; E281-E285 WeakPolarHBondContact O-CB 3.36Å; E281-E285 PolarHBondContact O-N 3.27Å; E283-E285 VanDerWaalsContact C-N 3.28Å; E283-E285 PolarHBondContact O-N 2.87Å; E285-Q287 VanDerWaalsContact C-N 3.29Å; E285-Q287 PolarHBondContact O-N 2.95Å; E285-R288 PolarHBondContact O-N 3.15Å; E285-R288 IonicContact OE2-CZ 3.37Å; E285-R288 VanDerWaalsContact OE2-CZ 3.27Å; E285-R288 IonicContact OE2-NE 3.1Å; E285-R288 PolarHBondContact OE2-NE 3.2Å; E285-R288 IonicContact OE2-NH2 3.73Å; E285-R288 PolarHBondContact OE2-NH2 3.36Å; E285-Q289 VanDerWaalsContact O-CG 3.3Å; E285-Q289 WeakPolarHBondContact O-CG 3.46Å; E285-Q289 PolarHBondContact O-N 3.36Å; E285-Q289 PolarHBondContact OE1-NE2 2.92Å
286	K	90.9	Very high	89.6	Confident	141 Å²	141	96.3 Å²	96.3	61%	0.613	44%	0.44	S	S	*	.	H	α-helix	trans	-61.1	-37.4	170.5	-77.7	168.9	-178.5	176.3	0	112.4	A282 E283 A290	A282-K286 WeakPolarHBondContact O-CB 3.19Å; A282-K286 WeakPolarHBondContact O-CD 3.36Å; A282-K286 VanDerWaalsContact O-CG 3.22Å; A282-K286 WeakPolarHBondContact O-CG 3.36Å; A282-K286 PolarHBondContact O-N 3.19Å; A282-K286 VanDerWaalsContact O-N 3.14Å; E283-K286 WeakPolarHBondContact O-CB 3.5Å; E283-K286 PolarHBondContact O-N 3.11Å; K286-A290 WeakPolarHBondContact O-CB 3.48Å; K286-A290 PolarHBondContact O-N 3.04Å
287	Q	88.1	Confident	89.5	Confident	109 Å²	109	97.9 Å²	97.9	51%	0.509	44%	0.441	S	S	.	.	H	α-helix	trans	-65.5	-51	175.2	-73.8	172.2	-7.1	0	0	111.1	E283 L284 E285 Q289 A290 E291	E283-Q287 WeakPolarHBondContact O-CG 3.44Å; E283-Q287 PolarHBondContact O-N 3.14Å; L284-Q287 WeakPolarHBondContact O-CB 3.43Å; L284-Q287 PolarHBondContact O-N 3.18Å; E285-Q287 VanDerWaalsContact C-N 3.29Å; E285-Q287 PolarHBondContact O-N 2.95Å; Q287-Q289 VanDerWaalsContact C-N 3.27Å; Q287-Q289 PolarHBondContact O-N 3.1Å; Q287-A290 WeakPolarHBondContact O-CA 3.4Å; Q287-A290 WeakPolarHBondContact O-CB 3.14Å; Q287-A290 PolarHBondContact O-N 3.01Å; Q287-E291 WeakPolarHBondContact O-CG 3.41Å; Q287-E291 PolarHBondContact O-N 2.75Å
288	R	87.5	Confident	89.7	Confident	156 Å²	156	96 Å²	96	59%	0.589	44%	0.438	S	S	*	.	H	α-helix	trans	-54.6	-42.3	175.6	-71.6	-165.8	-66.2	-147.3	1.4	112.5	L284 E285 G292	L284-R288 WeakPolarHBondContact O-CG 3.35Å; L284-R288 PolarHBondContact O-N 3.3Å; E285-R288 PolarHBondContact O-N 3.15Å; E285-R288 IonicContact OE2-CZ 3.37Å; E285-R288 VanDerWaalsContact OE2-CZ 3.27Å; E285-R288 IonicContact OE2-NE 3.1Å; E285-R288 PolarHBondContact OE2-NE 3.2Å; E285-R288 IonicContact OE2-NH2 3.73Å; E285-R288 PolarHBondContact OE2-NH2 3.36Å; R288-G292 PolarHBondContact O-N 3Å
289	Q	87.7	Confident	89.7	Confident	71 Å²	71	88 Å²	88	33%	0.332	41%	0.407	S	S	.	.	H	α-helix	trans	-71	-29.8	175.6	-66.6	176.3	17.6	0	0	113.5	E285 Q287 R293 F354	E285-Q289 VanDerWaalsContact O-CG 3.3Å; E285-Q289 WeakPolarHBondContact O-CG 3.46Å; E285-Q289 PolarHBondContact O-N 3.36Å; E285-Q289 PolarHBondContact OE1-NE2 2.92Å; Q287-Q289 VanDerWaalsContact C-N 3.27Å; Q287-Q289 PolarHBondContact O-N 3.1Å; Q289-R293 VanDerWaalsContact C-NH2 3.32Å; Q289-R293 WeakPolarHBondContact O-CB 3.45Å; Q289-R293 VanDerWaalsContact O-CG 3.31Å; Q289-R293 WeakPolarHBondContact O-CG 3.4Å; Q289-R293 PolarHBondContact O-N 3.5Å; Q289-R293 VanDerWaalsContact O-N 3.12Å; Q289-R293 PolarHBondContact O-NE 3.05Å; Q289-R293 PolarHBondContact O-NH2 3.41Å; Q289-F354 HydrophobicContact CB-CE2 4.38Å; Q289-F354 HydrophobicContact CG-CE2 4.33Å
290	A	88.6	Confident	89.6	Confident	46 Å²	46	85.7 Å²	85.7	38%	0.38	40%	0.399	S	S	.	.	H	α-helix	trans	-71.5	-46.4	174.6	0	0	0	0	0	111.3	K286 Q287 G292 R293 E294	K286-A290 WeakPolarHBondContact O-CB 3.48Å; K286-A290 PolarHBondContact O-N 3.04Å; Q287-A290 WeakPolarHBondContact O-CA 3.4Å; Q287-A290 WeakPolarHBondContact O-CB 3.14Å; Q287-A290 PolarHBondContact O-N 3.01Å; A290-G292 PolarHBondContact O-N 2.93Å; A290-R293 CarbonylContact O-C 3.56Å; A290-R293 PolarHBondContact O-N 2.91Å; A290-E294 PolarHBondContact O-N 3.44Å
291	E	88.5	Confident	89.8	Confident	83 Å²	83	82.9 Å²	82.9	39%	0.388	40%	0.399	S	S	.	.	H	α-helix	trans	-58.6	-44.1	172	-69.6	175.3	-157.2	0	0	111.8	Q287 R293 E294 R295	Q287-E291 WeakPolarHBondContact O-CG 3.41Å; Q287-E291 PolarHBondContact O-N 2.75Å; E291-R293 PolarHBondContact O-N 2.97Å; E291-E294 CarbonylContact O-C 3.59Å; E291-E294 WeakPolarHBondContact O-CA 3.3Å; E291-E294 WeakPolarHBondContact O-CB 3.22Å; E291-E294 PolarHBondContact O-N 3.48Å; E291-R295 WeakPolarHBondContact O-CG 3.38Å; E291-R295 PolarHBondContact O-N 3.31Å; E291-R295 IonicContact OE2-CZ 2.91Å; E291-R295 IonicContact OE2-NH1 3.34Å; E291-R295 IonicContact OE2-NH2 3.89Å; E291-R295 PolarHBondContact OE2-NH2 2.58Å
292	G	89.1	Confident	89.9	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.01	38%	0.376	C	S	.	.	H	α-helix	trans	-59.9	-43.5	176.1	0	0	0	0	0	112.8	R288 A290 E294 L296 F354	R288-G292 PolarHBondContact O-N 3Å; A290-G292 PolarHBondContact O-N 2.93Å; G292-E294 PolarHBondContact O-N 2.89Å; G292-L296 WeakPolarHBondContact O-CB 3.45Å; G292-L296 PolarHBondContact O-N 3.04Å; G292-F354 VanDerWaalsContact CA-CG 3.45Å; G292-F354 WeakPolarHBondContact O-CD1 3.27Å
293	R	88.1	Confident	89.8	Confident	119 Å²	119	78 Å²	78	45%	0.449	37%	0.369	S	S	.	.	H	α-helix	trans	-68.4	-17.6	171.8	-73.5	-178.8	-66.2	-102.6	-4.5	113.7	Q289 A290 E291 R297 F354	Q289-R293 VanDerWaalsContact C-NH2 3.32Å; Q289-R293 WeakPolarHBondContact O-CB 3.45Å; Q289-R293 VanDerWaalsContact O-CG 3.31Å; Q289-R293 WeakPolarHBondContact O-CG 3.4Å; Q289-R293 PolarHBondContact O-N 3.5Å; Q289-R293 VanDerWaalsContact O-N 3.12Å; Q289-R293 PolarHBondContact O-NE 3.05Å; Q289-R293 PolarHBondContact O-NH2 3.41Å; A290-R293 CarbonylContact O-C 3.56Å; A290-R293 PolarHBondContact O-N 2.91Å; E291-R293 PolarHBondContact O-N 2.97Å; R293-R297 WeakPolarHBondContact O-CG 3.35Å; R293-R297 PolarHBondContact O-NE 3.31Å; R293-F354 HydrophobicContact CB-CE1 4.5Å; R293-F354 HydrophobicContact CG-CE1 3.7Å; R293-F354 HydrophobicContact CG-CZ 3.94Å
294	E	89.3	Confident	89.9	Confident	103 Å²	103	78.6 Å²	78.6	48%	0.481	37%	0.372	S	S	.	.	H	α-helix	trans	-82.8	-50.6	172.2	-171.4	137.6	-104.8	0	0	111.4	A290 E291 G292 L296 R297 S298	A290-E294 PolarHBondContact O-N 3.44Å; E291-E294 CarbonylContact O-C 3.59Å; E291-E294 WeakPolarHBondContact O-CA 3.3Å; E291-E294 WeakPolarHBondContact O-CB 3.22Å; E291-E294 PolarHBondContact O-N 3.48Å; G292-E294 PolarHBondContact O-N 2.89Å; E294-L296 PolarHBondContact O-N 2.94Å; E294-R297 WeakPolarHBondContact O-CB 3.33Å; E294-R297 PolarHBondContact O-N 3.36Å; E294-R297 IonicContact OE1-CZ 3.77Å; E294-R297 IonicContact OE1-NH1 3.86Å; E294-R297 IonicContact OE1-NH2 2.65Å; E294-R297 PolarHBondContact OE1-NH2 3.34Å; E294-S298 PolarHBondContact O-N 3.36Å; E294-S298 PolarHBondContact O-OG 3.34Å
295	R	90.4	Very high	89.9	Confident	78 Å²	78	76.6 Å²	76.6	29%	0.294	36%	0.36	S	S	.	.	H	α-helix	trans	-52	-44.2	172.7	-67.6	176.4	-167.3	123.5	15.6	111.2	E291 R297 S298 L299 P355 M360	E291-R295 WeakPolarHBondContact O-CG 3.38Å; E291-R295 PolarHBondContact O-N 3.31Å; E291-R295 IonicContact OE2-CZ 2.91Å; E291-R295 IonicContact OE2-NH1 3.34Å; E291-R295 IonicContact OE2-NH2 3.89Å; E291-R295 PolarHBondContact OE2-NH2 2.58Å; R295-R297 PolarHBondContact O-N 3.14Å; R295-S298 PolarHBondContact O-N 2.71Å; R295-L299 WeakPolarHBondContact O-CB 3.24Å; R295-L299 PolarHBondContact O-N 2.86Å; R295-P355 HydrophobicContact CB-CB 4.21Å; R295-P355 HydrophobicContact CB-CG 4.02Å; R295-P355 WeakPolarHBondContact CD-O 3.26Å; R295-M360 HydrophobicContact CB-CG 4Å; R295-M360 HydrophobicContact CB-SD 3.96Å; R295-M360 HydrophobicContact CG-CG 4.09Å; R295-M360 VanDerWaalsContact O-SD 3.32Å
296	L	89.7	Confident	90	Very high	56 Å²	56	73.5 Å²	73.5	29%	0.293	35%	0.345	S	S	.	.	H	α-helix	trans	-64.5	-37.3	177.4	-173.7	61.8	0	0	0	113.2	G292 E294 N300 P355	G292-L296 WeakPolarHBondContact O-CB 3.45Å; G292-L296 PolarHBondContact O-N 3.04Å; E294-L296 PolarHBondContact O-N 2.94Å; L296-N300 VanDerWaalsContact O-CG 3.25Å; L296-N300 PolarHBondContact O-N 3.28Å; L296-N300 VanDerWaalsContact O-N 3.11Å; L296-N300 PolarHBondContact O-OD1 3.03Å; L296-P355 HydrophobicContact CB-CG 4.18Å; L296-P355 HydrophobicContact CD1-CG 4.26Å
297	R	90.5	Very high	89.9	Confident	149 Å²	149	70.5 Å²	70.5	56%	0.562	34%	0.336	S	S	*	.	H	α-helix	trans	-67	-42.8	173.7	-75.8	178.3	-66.4	133.8	2.6	111.4	R293 E294 R295 N300 S301	R293-R297 WeakPolarHBondContact O-CG 3.35Å; R293-R297 PolarHBondContact O-NE 3.31Å; E294-R297 WeakPolarHBondContact O-CB 3.33Å; E294-R297 PolarHBondContact O-N 3.36Å; E294-R297 IonicContact OE1-CZ 3.77Å; E294-R297 IonicContact OE1-NH1 3.86Å; E294-R297 IonicContact OE1-NH2 2.65Å; E294-R297 PolarHBondContact OE1-NH2 3.34Å; R295-R297 PolarHBondContact O-N 3.14Å; R297-N300 PolarHBondContact O-N 2.79Å; R297-S301 PolarHBondContact O-N 3.41Å
298	S	91.6	Very high	89.9	Confident	51 Å²	51	71 Å²	71	36%	0.357	34%	0.338	S	S	.	.	H	α-helix	trans	-63.9	-41.1	175.7	-63.5	0	0	0	0	112	E294 R295 S301 I302	E294-S298 PolarHBondContact O-N 3.36Å; E294-S298 PolarHBondContact O-OG 3.34Å; R295-S298 PolarHBondContact O-N 2.71Å; S298-S301 WeakPolarHBondContact O-CB 3.34Å; S298-S301 PolarHBondContact O-N 3.39Å; S298-I302 VanDerWaalsContact O-CG1 3.28Å; S298-I302 WeakPolarHBondContact O-CG1 3.33Å; S298-I302 PolarHBondContact O-N 2.89Å
299	L	92.3	Very high	89.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-60.8	-44.9	176	-179.4	61.6	0	0	0	111.8	R295 I302 Q303 V342 V345 V346 T349 P355 M360 A363	R295-L299 WeakPolarHBondContact O-CB 3.24Å; R295-L299 PolarHBondContact O-N 2.86Å; L299-I302 PolarHBondContact O-N 3.44Å; L299-Q303 PolarHBondContact O-N 3.06Å; L299-V342 HydrophobicContact CD1-CG1 4.27Å; L299-V345 HydrophobicContact CD1-CG1 3.81Å; L299-V345 HydrophobicContact CD2-CG1 3.95Å; L299-V346 HydrophobicContact CD1-CG2 4.15Å; L299-V346 HydrophobicContact CD2-CG2 3.9Å; L299-V346 HydrophobicContact CG-CG2 3.79Å; L299-T349 HydrophobicContact CD2-CG2 4Å; L299-P355 HydrophobicContact CB-CG 4.48Å; L299-P355 HydrophobicContact CD2-CB 4.29Å; L299-P355 HydrophobicContact CD2-CG 3.94Å; L299-M360 HydrophobicContact CB-CE 4.49Å; L299-M360 HydrophobicContact CB-SD 3.91Å; L299-A363 HydrophobicContact CD1-CB 3.58Å
300	N	90.3	Very high	89.7	Confident	66 Å²	66	62.2 Å²	62.2	35%	0.353	31%	0.305	S	S	.	.	H	α-helix	trans	-62.9	-42.1	175.5	-66.8	-1.3	0	0	0	111.4	L296 R297 I302 Q303 E304	L296-N300 VanDerWaalsContact O-CG 3.25Å; L296-N300 PolarHBondContact O-N 3.28Å; L296-N300 VanDerWaalsContact O-N 3.11Å; L296-N300 PolarHBondContact O-OD1 3.03Å; R297-N300 PolarHBondContact O-N 2.79Å; N300-I302 VanDerWaalsContact C-N 3.31Å; N300-I302 PolarHBondContact O-N 3.5Å; N300-Q303 WeakPolarHBondContact O-CB 3.46Å; N300-Q303 PolarHBondContact O-N 2.89Å; N300-E304 WeakPolarHBondContact O-CG 3.35Å; N300-E304 PolarHBondContact O-N 3.23Å
301	S	93.2	Very high	89.4	Confident	69 Å²	69	66.8 Å²	66.8	48%	0.483	32%	0.318	S	S	.	.	H	α-helix	trans	-62.4	-36.2	174.7	-171.7	0	0	0	0	112.7	R297 S298 E305	R297-S301 PolarHBondContact O-N 3.41Å; S298-S301 WeakPolarHBondContact O-CB 3.34Å; S298-S301 PolarHBondContact O-N 3.39Å; S301-E305 PolarHBondContact O-N 3.35Å
302	I	91.6	Very high	89	Confident	14 Å²	14	68.1 Å²	68.1	7%	0.072	33%	0.327	C	S	.	.	H	α-helix	trans	-68.2	-41.6	174.3	-70.6	162.8	0	0	0	110.5	S298 L299 N300 E305 I306 V342 M360 A363 E364 L367	S298-I302 VanDerWaalsContact O-CG1 3.28Å; S298-I302 WeakPolarHBondContact O-CG1 3.33Å; S298-I302 PolarHBondContact O-N 2.89Å; L299-I302 PolarHBondContact O-N 3.44Å; N300-I302 VanDerWaalsContact C-N 3.31Å; N300-I302 PolarHBondContact O-N 3.5Å; I302-E305 PolarHBondContact O-N 2.99Å; I302-I306 HydrophobicContact CG2-CD1 3.68Å; I302-I306 HydrophobicContact CG2-CG1 4.32Å; I302-I306 WeakPolarHBondContact O-CB 3.41Å; I302-I306 VanDerWaalsContact O-CG1 3.29Å; I302-I306 WeakPolarHBondContact O-CG1 3.49Å; I302-I306 PolarHBondContact O-N 3.4Å; I302-V342 HydrophobicContact CG2-CG1 4.38Å; I302-M360 HydrophobicContact CD1-CE 3.9Å; I302-A363 HydrophobicContact CD1-CB 4.27Å; I302-A363 HydrophobicContact CG2-CB 4Å; I302-E364 HydrophobicContact CD1-CG 3.76Å; I302-L367 HydrophobicContact CG1-CD2 4.07Å; I302-L367 HydrophobicContact CG2-CB 4.08Å; I302-L367 HydrophobicContact CG2-CD2 4.28Å
303	Q	91.6	Very high	88.3	Confident	52 Å²	52	68 Å²	68	24%	0.243	33%	0.327	C	S	.	.	H	α-helix	trans	-61.4	-45.8	175.4	-172.1	-175.1	11.8	0	0	111.3	L299 N300 L307 V342 V346	L299-Q303 PolarHBondContact O-N 3.06Å; N300-Q303 WeakPolarHBondContact O-CB 3.46Å; N300-Q303 PolarHBondContact O-N 2.89Å; Q303-L307 HydrophobicContact CG-CD1 4.12Å; Q303-L307 WeakPolarHBondContact O-CB 3.11Å; Q303-L307 VanDerWaalsContact O-CG 3.25Å; Q303-L307 WeakPolarHBondContact O-CG 3.26Å; Q303-L307 PolarHBondContact O-N 2.95Å; Q303-V342 HydrophobicContact CB-CG1 4.26Å; Q303-V346 HydrophobicContact CB-CG2 4.44Å; Q303-V346 HydrophobicContact CG-CG2 4.49Å
304	E	90.9	Very high	87.4	Confident	121 Å²	121	66.3 Å²	66.3	57%	0.565	32%	0.324	S	S	*	.	H	α-helix	trans	-60.8	-47.2	175.9	-74.3	177.2	-157.9	0	0	112	N300 L307 Q308	N300-E304 WeakPolarHBondContact O-CG 3.35Å; N300-E304 PolarHBondContact O-N 3.23Å; E304-L307 PolarHBondContact O-N 3.5Å; E304-Q308 WeakPolarHBondContact O-CG 3.45Å; E304-Q308 PolarHBondContact O-N 3.34Å
305	E	90.4	Very high	86	Confident	56 Å²	56	65.6 Å²	65.6	26%	0.262	33%	0.328	S	S	.	.	H	α-helix	trans	-65	-44.9	178.6	-164	-171.4	147.6	0	0	111.6	S301 I302 L307 Q308 L309 L367 R371	S301-E305 PolarHBondContact O-N 3.35Å; I302-E305 PolarHBondContact O-N 2.99Å; E305-L307 VanDerWaalsContact C-N 3.28Å; E305-L307 PolarHBondContact O-N 3.46Å; E305-Q308 PolarHBondContact O-N 3.33Å; E305-Q308 VanDerWaalsContact O-N 3.17Å; E305-L309 HydrophobicContact CG-CD1 4.03Å; E305-L309 HydrophobicContact CG-CG 4.25Å; E305-L309 WeakPolarHBondContact O-CB 3.32Å; E305-L309 VanDerWaalsContact O-CG 3.25Å; E305-L309 WeakPolarHBondContact O-CG 3.36Å; E305-L309 PolarHBondContact O-N 3.06Å; E305-L367 HydrophobicContact CB-CD1 4.23Å; E305-L367 HydrophobicContact CG-CD1 4.07Å; E305-R371 IonicContact OE1-CZ 2.8Å; E305-R371 IonicContact OE1-NE 3.74Å; E305-R371 PolarHBondContact OE1-NE 3.2Å; E305-R371 IonicContact OE1-NH2 3.46Å; E305-R371 PolarHBondContact OE1-NH2 3.41Å; E305-R371 IonicContact OE2-CZ 3.36Å; E305-R371 IonicContact OE2-NH2 3.35Å; E305-R371 PolarHBondContact OE2-NH2 3.13Å
306	I	90.4	Very high	84.2	Confident	2 Å²	2	65 Å²	65	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-59.6	-38.5	177.2	-75.2	175.1	0	0	0	111.4	I302 N310 C339 V342 A366 L367 M370	I302-I306 HydrophobicContact CG2-CD1 3.68Å; I302-I306 HydrophobicContact CG2-CG1 4.32Å; I302-I306 WeakPolarHBondContact O-CB 3.41Å; I302-I306 VanDerWaalsContact O-CG1 3.29Å; I302-I306 WeakPolarHBondContact O-CG1 3.49Å; I302-I306 PolarHBondContact O-N 3.4Å; I306-N310 WeakPolarHBondContact O-CB 3.47Å; I306-N310 PolarHBondContact O-N 3.16Å; I306-C339 HydrophobicContact CG2-CB 4.39Å; I306-V342 HydrophobicContact CD1-CB 4.12Å; I306-V342 HydrophobicContact CD1-CG1 4.36Å; I306-V342 HydrophobicContact CD1-CG2 3.42Å; I306-V342 VanDerWaalsContact CD1-CG2 3.42Å; I306-A366 HydrophobicContact CD1-CB 4.28Å; I306-L367 HydrophobicContact CD1-CB 3.97Å; I306-L367 HydrophobicContact CG1-CB 4.06Å; I306-L367 HydrophobicContact CG1-CD1 3.75Å; I306-L367 HydrophobicContact CG1-CG 4.48Å; I306-M370 HydrophobicContact CG2-CE 3.86Å
307	L	88.4	Confident	82.2	Confident	79 Å²	79	67.5 Å²	67.5	41%	0.414	37%	0.365	S	S	.	.	H	α-helix	trans	-69.9	-37.1	176.7	-72.4	170	0	0	0	112.6	Q303 E304 E305 Q311	Q303-L307 HydrophobicContact CG-CD1 4.12Å; Q303-L307 WeakPolarHBondContact O-CB 3.11Å; Q303-L307 VanDerWaalsContact O-CG 3.25Å; Q303-L307 WeakPolarHBondContact O-CG 3.26Å; Q303-L307 PolarHBondContact O-N 2.95Å; E304-L307 PolarHBondContact O-N 3.5Å; E305-L307 VanDerWaalsContact C-N 3.28Å; E305-L307 PolarHBondContact O-N 3.46Å; L307-Q311 WeakPolarHBondContact O-CG 3.35Å; L307-Q311 PolarHBondContact O-N 3.22Å; L307-Q311 PolarHBondContact O-NE2 2.68Å
308	Q	87.8	Confident	80.3	Confident	118 Å²	118	69.6 Å²	69.6	55%	0.551	38%	0.381	S	S	*	.	H	α-helix	trans	-66.4	-43.2	172.9	-69.7	171.4	31.9	0	0	111.5	E304 E305 Q311 L312	E304-Q308 WeakPolarHBondContact O-CG 3.45Å; E304-Q308 PolarHBondContact O-N 3.34Å; E305-Q308 PolarHBondContact O-N 3.33Å; E305-Q308 VanDerWaalsContact O-N 3.17Å; Q308-Q311 WeakPolarHBondContact O-CB 3.4Å; Q308-Q311 PolarHBondContact O-N 2.96Å; Q308-L312 PolarHBondContact O-N 2.94Å
309	L	85.8	Confident	78.3	Confident	26 Å²	26	70.5 Å²	70.5	14%	0.136	39%	0.391	C	S	.	.	H	α-helix	trans	-63.5	-40.4	176.3	-71.3	176.1	0	0	0	111.6	E305 Q311 L312 L313 L367 M370 R371 I374	E305-L309 HydrophobicContact CG-CD1 4.03Å; E305-L309 HydrophobicContact CG-CG 4.25Å; E305-L309 WeakPolarHBondContact O-CB 3.32Å; E305-L309 VanDerWaalsContact O-CG 3.25Å; E305-L309 WeakPolarHBondContact O-CG 3.36Å; E305-L309 PolarHBondContact O-N 3.06Å; L309-Q311 VanDerWaalsContact C-N 3.28Å; L309-Q311 PolarHBondContact O-N 2.93Å; L309-L312 HydrophobicContact CD2-CD1 4.41Å; L309-L312 WeakPolarHBondContact O-CB 3.36Å; L309-L312 PolarHBondContact O-N 2.93Å; L309-L313 PolarHBondContact O-N 3.16Å; L309-L367 HydrophobicContact CD1-CD1 3.64Å; L309-M370 HydrophobicContact CB-CG 3.62Å; L309-M370 HydrophobicContact CB-SD 4.41Å; L309-M370 HydrophobicContact CD1-CB 4.49Å; L309-M370 HydrophobicContact CD1-CG 3.89Å; L309-M370 HydrophobicContact CG-CG 4.42Å; L309-R371 HydrophobicContact CD1-CG 3.72Å; L309-I374 HydrophobicContact CB-CD1 3.55Å; L309-I374 HydrophobicContact CD2-CD1 3.66Å; L309-I374 HydrophobicContact CG-CD1 4.1Å; L309-I374 WeakPolarHBondContact O-CD1 3.47Å
310	N	85.7	Confident	76.5	Confident	17 Å²	17	72.1 Å²	72.1	9%	0.091	40%	0.4	C	S	.	.	H	α-helix	trans	-64.4	-31.4	175.9	-159.4	57.7	0	0	0	112.6	I306 L312 L313 E314 G335 N336 C339 M370	I306-N310 WeakPolarHBondContact O-CB 3.47Å; I306-N310 PolarHBondContact O-N 3.16Å; N310-L312 PolarHBondContact O-N 2.96Å; N310-L313 WeakPolarHBondContact O-CB 3.26Å; N310-L313 PolarHBondContact O-N 3.32Å; N310-L313 VanDerWaalsContact O-N 3.08Å; N310-E314 PolarHBondContact O-N 3.41Å; N310-G335 WeakPolarHBondContact OD1-CA 3.11Å; N310-N336 PolarHBondContact ND2-OD1 3.5Å; N310-N336 PolarHBondContact OD1-N 3.39Å; N310-C339 VanDerWaalsContact CB-SG 3.55Å; N310-M370 HydrophobicContact CB-CE 3.82Å
311	Q	82.9	Confident	74.6	Confident	142 Å²	142	73 Å²	73	66%	0.664	42%	0.416	S	S	*	.	H	α-helix	trans	-66	-23.1	172.9	-69.6	166.6	41.3	0	0	113.1	L307 Q308 L309	L307-Q311 WeakPolarHBondContact O-CG 3.35Å; L307-Q311 PolarHBondContact O-N 3.22Å; L307-Q311 PolarHBondContact O-NE2 2.68Å; Q308-Q311 WeakPolarHBondContact O-CB 3.4Å; Q308-Q311 PolarHBondContact O-N 2.96Å; L309-Q311 VanDerWaalsContact C-N 3.28Å; L309-Q311 PolarHBondContact O-N 2.93Å
312	L	78.9	Confident	72.8	Confident	111 Å²	111	76.3 Å²	76.3	58%	0.581	42%	0.424	S	S	*	.	H	α-helix	trans	-80.8	-15.7	172.8	-58.6	175.9	0	0	0	113.1	Q308 L309 N310	Q308-L312 PolarHBondContact O-N 2.94Å; L309-L312 HydrophobicContact CD2-CD1 4.41Å; L309-L312 WeakPolarHBondContact O-CB 3.36Å; L309-L312 PolarHBondContact O-N 2.93Å; N310-L312 PolarHBondContact O-N 2.96Å
313	L	73.8	Confident	71.2	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	43%	0.427	C	S	.	.	H	α-helix	trans	-85.2	-16.8	173.1	-68.6	170.4	0	0	0	112.7	L309 N310 H331 M370 V373 I374 M377	L309-L313 PolarHBondContact O-N 3.16Å; N310-L313 WeakPolarHBondContact O-CB 3.26Å; N310-L313 PolarHBondContact O-N 3.32Å; N310-L313 VanDerWaalsContact O-N 3.08Å; L313-H331 HydrophobicContact CD2-CB 4.15Å; L313-M370 HydrophobicContact CD1-CE 4.45Å; L313-M370 HydrophobicContact CD1-SD 3.52Å; L313-M370 VanDerWaalsContact CD1-SD 3.52Å; L313-V373 HydrophobicContact CD1-CG1 4.23Å; L313-V373 HydrophobicContact CD2-CG1 4.02Å; L313-I374 HydrophobicContact CD1-CG1 4.29Å; L313-I374 HydrophobicContact CD2-CG1 3.75Å; L313-I374 HydrophobicContact CG-CD1 4.37Å; L313-I374 HydrophobicContact CG-CG1 3.87Å; L313-M377 HydrophobicContact CD2-CE 3.83Å
314	E	69.9	Low	69.8	Low	83 Å²	83	78.3 Å²	78.3	39%	0.388	44%	0.441	S	S	.	.	S	Bend	trans	-76.2	150.7	179.5	-74.8	-58.8	118.6	0	0	112.9	N310 S316 S332	N310-E314 PolarHBondContact O-N 3.41Å; E314-S316 PolarHBondContact O-N 3.42Å; E314-S332 PolarHBondContact OE1-OG 3.18Å
315	P	60.3	Low	68.4	Low	88 Å²	88	76.6 Å²	76.6	57%	0.571	45%	0.447	S	S	*	.			trans	-72.5	79.8	-169.7	-19.9	35.1	0	0	0	114.7	A317 L328	P315-A317 PolarHBondContact O-N 3.49Å; P315-L328 HydrophobicContact CB-CD2 4.06Å; P315-L328 HydrophobicContact CG-CD2 4.09Å
316	S	53.1	Low	67.1	Low	65 Å²	65	77.9 Å²	77.9	46%	0.455	47%	0.467	S	S	.	.			trans	-65.2	128.8	167.1	77.2	0	0	0	0	110.4	E314 Q318 A319	E314-S316 PolarHBondContact O-N 3.42Å; S316-Q318 PolarHBondContact O-N 2.83Å; S316-A319 PolarHBondContact O-N 3.34Å; S316-A319 VanDerWaalsContact OG-CB 3.32Å; S316-A319 WeakPolarHBondContact OG-CB 3.36Å
317	A	48.2	Very low	66	Low	109 Å²	109	79 Å²	79	90%	0.901	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	4.6	-170.1	0	0	0	0	0	115.3	P315	P315-A317 PolarHBondContact O-N 3.49Å
318	Q	49.1	Very low	65.1	Low	192 Å²	192	76.3 Å²	76.3	90%	0.897	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.6	-18.6	-172.4	-73.1	167.4	-18.3	0	0	113.9	S316	S316-Q318 PolarHBondContact O-N 2.83Å
319	A	50.9	Low	64.5	Low	70 Å²	70	73.7 Å²	73.7	58%	0.579	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-38.5	177.9	0	0	0	0	0	113.4	S316 A321	S316-A319 PolarHBondContact O-N 3.34Å; S316-A319 VanDerWaalsContact OG-CB 3.32Å; S316-A319 WeakPolarHBondContact OG-CB 3.36Å; A319-A321 PolarHBondContact O-N 2.93Å
320	N	53.6	Low	64.2	Low	35 Å²	35	75.9 Å²	75.9	19%	0.187	48%	0.478	C	S	.	.			trans	-98.6	26.5	-158.1	-64.9	-15.6	0	0	0	115	H322 L328	N320-H322 PolarHBondContact O-N 3.08Å; N320-L328 HydrophobicContact CB-CD2 4.2Å; N320-L328 WeakPolarHBondContact ND2-CD1 3.4Å
321	A	50.5	Low	64	Low	84 Å²	84	76 Å²	76	69%	0.694	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-3.4	-171.6	0	0	0	0	0	116	A319	A319-A321 PolarHBondContact O-N 2.93Å
322	H	54.4	Low	63.9	Low	138 Å²	138	70.1 Å²	70.1	64%	0.639	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	1.6	-173.4	-65.6	-23.8	0	0	0	115	N320	N320-H322 PolarHBondContact O-N 3.08Å
323	L	59.6	Low	64.2	Low	27 Å²	27	70.9 Å²	70.9	14%	0.141	46%	0.456	C	S	.	.	S	Bend	trans	-98	142.7	177.1	-79.2	165.7	0	0	0	111.7	A325 M377 E380 A381	L323-A325 PolarHBondContact O-N 3.27Å; L323-M377 HydrophobicContact CD1-CG 4Å; L323-M377 HydrophobicContact CD1-SD 4.15Å; L323-E380 HydrophobicContact CD2-CB 3.92Å; L323-A381 HydrophobicContact CD1-CB 4.36Å; L323-A381 HydrophobicContact CD2-CB 4.44Å; L323-A381 HydrophobicContact CG-CB 4.35Å
324	P	61.7	Low	64.8	Low	82 Å²	82	75 Å²	75	53%	0.532	47%	0.471	S	S	.	.			trans	-63.7	130.6	171.2	-19.6	32.2	0	0	0	111.1	A326 S327 L328	P324-A326 PolarHBondContact O-N 3.15Å; P324-S327 PolarHBondContact O-N 2.95Å; P324-L328 PolarHBondContact O-N 2.92Å
325	A	60.3	Low	65.6	Low	85 Å²	85	71 Å²	71	70%	0.702	45%	0.453	S	S	*	.	H	α-helix	trans	-54.7	-29.9	-176.8	0	0	0	0	0	114.1	L323 A329	L323-A325 PolarHBondContact O-N 3.27Å; A325-A329 PolarHBondContact O-N 3.36Å; A325-A329 VanDerWaalsContact O-N 3.12Å
326	A	64.9	Low	66.9	Low	82 Å²	82	70.3 Å²	70.3	68%	0.678	44%	0.444	S	S	*	.	H	α-helix	trans	-67.7	-33	175.6	0	0	0	0	0	113.8	P324 S330	P324-A326 PolarHBondContact O-N 3.15Å; A326-S330 PolarHBondContact O-N 3.04Å
327	S	67.1	Low	68.6	Low	26 Å²	26	71.8 Å²	71.8	18%	0.182	44%	0.444	C	S	.	.	H	α-helix	trans	-73.3	-44.8	176	-159.3	0	0	0	0	110.6	P324 A329 S330 H331 E380	P324-S327 PolarHBondContact O-N 2.95Å; S327-A329 VanDerWaalsContact C-N 3.31Å; S327-A329 PolarHBondContact O-N 2.84Å; S327-S330 WeakPolarHBondContact O-CA 3.33Å; S327-S330 WeakPolarHBondContact O-CB 3.49Å; S327-S330 PolarHBondContact O-N 3.22Å; S327-H331 PolarHBondContact O-CD2 3.1Å; S327-H331 PolarHBondContact O-N 3.13Å; S327-H331 PolarHBondContact OG-CD2 2.9Å; S327-H331 PolarHBondContact OG-NE2 3.49Å; S327-H331 VanDerWaalsContact OG-NE2 3.17Å; S327-E380 PolarHBondContact OG-OE2 3.37Å
328	L	69.3	Low	70.6	Confident	22 Å²	22	66.6 Å²	66.6	12%	0.115	40%	0.401	C	S	.	.	H	α-helix	trans	-57.2	-43	177.5	-175.5	62.5	0	0	0	112	P315 N320 P324 S330 H331 S332	P315-L328 HydrophobicContact CB-CD2 4.06Å; P315-L328 HydrophobicContact CG-CD2 4.09Å; N320-L328 HydrophobicContact CB-CD2 4.2Å; N320-L328 WeakPolarHBondContact ND2-CD1 3.4Å; P324-L328 PolarHBondContact O-N 2.92Å; L328-S330 VanDerWaalsContact C-N 3.35Å; L328-S330 PolarHBondContact O-N 2.83Å; L328-H331 PolarHBondContact O-N 2.92Å; L328-S332 PolarHBondContact O-N 3.5Å
329	A	74.6	Confident	72.6	Confident	63 Å²	63	58.1 Å²	58.1	52%	0.521	36%	0.363	S	S	.	.	H	α-helix	trans	-63.4	-36.8	174.6	0	0	0	0	0	113.1	A325 S327 L333	A325-A329 PolarHBondContact O-N 3.36Å; A325-A329 VanDerWaalsContact O-N 3.12Å; S327-A329 VanDerWaalsContact C-N 3.31Å; S327-A329 PolarHBondContact O-N 2.84Å; A329-L333 VanDerWaalsContact O-CB 3.31Å; A329-L333 WeakPolarHBondContact O-CB 3.34Å; A329-L333 PolarHBondContact O-N 2.84Å
330	S	80.4	Confident	74.4	Confident	73 Å²	73	58 Å²	58	51%	0.51	36%	0.358	S	S	.	.	H	α-helix	trans	-67.5	-41.5	176.2	-171.1	0	0	0	0	112	A326 S327 L328 L333 R334	A326-S330 PolarHBondContact O-N 3.04Å; S327-S330 WeakPolarHBondContact O-CA 3.33Å; S327-S330 WeakPolarHBondContact O-CB 3.49Å; S327-S330 PolarHBondContact O-N 3.22Å; L328-S330 VanDerWaalsContact C-N 3.35Å; L328-S330 PolarHBondContact O-N 2.83Å; S330-L333 PolarHBondContact O-N 3.38Å; S330-R334 PolarHBondContact O-N 2.92Å; S330-R334 VanDerWaalsContact O-N 3.08Å
331	H	80.6	Confident	76.2	Confident	18 Å²	18	59.5 Å²	59.5	8%	0.083	36%	0.364	C	S	.	.	H	α-helix	trans	-69.4	-43.7	179.3	-67.1	-53.2	0	0	0	112.1	L313 S327 L328 R334 G335 V373 E380	L313-H331 HydrophobicContact CD2-CB 4.15Å; S327-H331 PolarHBondContact O-CD2 3.1Å; S327-H331 PolarHBondContact O-N 3.13Å; S327-H331 PolarHBondContact OG-CD2 2.9Å; S327-H331 PolarHBondContact OG-NE2 3.49Å; S327-H331 VanDerWaalsContact OG-NE2 3.17Å; L328-H331 PolarHBondContact O-N 2.92Å; H331-R334 PolarHBondContact O-N 3.05Å; H331-G335 PolarHBondContact O-N 3.13Å; H331-V373 HydrophobicContact CB-CG1 4.06Å; H331-E380 IonicContact CD2-OE2 2.95Å; H331-E380 IonicContact CE1-OE2 3.89Å; H331-E380 IonicContact NE2-OE1 3.87Å; H331-E380 IonicContact NE2-OE2 3.96Å; H331-E380 PolarHBondContact NE2-OE2 2.99Å
332	S	81.8	Confident	78.1	Confident	19 Å²	19	55.6 Å²	55.6	13%	0.133	33%	0.331	C	S	.	.	H	α-helix	trans	-62.2	-41.1	172.4	163.8	0	0	0	0	111.9	E314 L328 R334 G335 N336	E314-S332 PolarHBondContact OE1-OG 3.18Å; L328-S332 PolarHBondContact O-N 3.5Å; S332-R334 VanDerWaalsContact C-N 3.34Å; S332-R334 PolarHBondContact O-N 3.46Å; S332-G335 PolarHBondContact O-N 3.23Å; S332-N336 WeakPolarHBondContact O-CB 3.39Å; S332-N336 PolarHBondContact O-N 3.34Å; S332-N336 PolarHBondContact O-ND2 2.93Å; S332-N336 PolarHBondContact OG-ND2 2.67Å; S332-N336 VanDerWaalsContact OG-ND2 3.16Å
333	L	84.8	Confident	79.8	Confident	128 Å²	128	51.5 Å²	51.5	67%	0.67	32%	0.318	S	S	*	.	H	α-helix	trans	-61	-40.9	176.1	-178.5	61.8	0	0	0	112.2	A329 S330 Q337	A329-L333 VanDerWaalsContact O-CB 3.31Å; A329-L333 WeakPolarHBondContact O-CB 3.34Å; A329-L333 PolarHBondContact O-N 2.84Å; S330-L333 PolarHBondContact O-N 3.38Å; L333-Q337 PolarHBondContact O-N 3.12Å; L333-Q337 VanDerWaalsContact O-N 3.11Å
334	R	86.2	Confident	81.2	Confident	85 Å²	85	55.1 Å²	55.1	32%	0.321	33%	0.334	S	S	.	.	H	α-helix	trans	-69.2	-40.2	175.4	-177.5	56.3	177.1	-169.3	-1.6	112.1	S330 H331 S332 Q337 L338 E369 V373	S330-R334 PolarHBondContact O-N 2.92Å; S330-R334 VanDerWaalsContact O-N 3.08Å; H331-R334 PolarHBondContact O-N 3.05Å; S332-R334 VanDerWaalsContact C-N 3.34Å; S332-R334 PolarHBondContact O-N 3.46Å; R334-Q337 WeakPolarHBondContact O-CB 3.22Å; R334-Q337 PolarHBondContact O-N 3.44Å; R334-L338 HydrophobicContact CG-CD1 4.4Å; R334-L338 WeakPolarHBondContact O-CG 3.48Å; R334-L338 PolarHBondContact O-N 3.44Å; R334-L338 VanDerWaalsContact O-N 3.08Å; R334-E369 IonicContact CZ-OE2 2.78Å; R334-E369 IonicContact NE-OE2 2.76Å; R334-E369 IonicContact NH2-OE2 2.77Å; R334-E369 PolarHBondContact NH2-OE2 3.33Å; R334-V373 HydrophobicContact CG-CG2 3.95Å
335	G	86.3	Confident	82.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-56.5	-52.1	174.4	0	0	0	0	0	111.9	N310 H331 S332 Q337 L338 C339 M370	N310-G335 WeakPolarHBondContact OD1-CA 3.11Å; H331-G335 PolarHBondContact O-N 3.13Å; S332-G335 PolarHBondContact O-N 3.23Å; G335-Q337 VanDerWaalsContact C-N 3.27Å; G335-Q337 PolarHBondContact O-N 2.68Å; G335-L338 WeakPolarHBondContact O-CB 3.35Å; G335-L338 PolarHBondContact O-N 2.86Å; G335-C339 PolarHBondContact O-N 3.18Å; G335-C339 PolarHBondContact O-SG 2.96Å; G335-C339 VanDerWaalsContact O-SG 3.37Å; G335-M370 WeakPolarHBondContact O-CE 3.42Å
336	N	87.6	Confident	83.8	Confident	73 Å²	73	48.7 Å²	48.7	39%	0.39	29%	0.285	S	S	.	.	H	α-helix	trans	-60.6	-32.9	177.2	-74.2	-63.5	0	0	0	113	N310 S332 S340	N310-N336 PolarHBondContact ND2-OD1 3.5Å; N310-N336 PolarHBondContact OD1-N 3.39Å; S332-N336 WeakPolarHBondContact O-CB 3.39Å; S332-N336 PolarHBondContact O-N 3.34Å; S332-N336 PolarHBondContact O-ND2 2.93Å; S332-N336 PolarHBondContact OG-ND2 2.67Å; S332-N336 VanDerWaalsContact OG-ND2 3.16Å; N336-S340 PolarHBondContact O-N 3.21Å; N336-S340 VanDerWaalsContact O-N 3.08Å
337	Q	89.4	Confident	84.8	Confident	97 Å²	97	50.8 Å²	50.8	45%	0.453	28%	0.275	S	S	.	.	H	α-helix	trans	-64.9	-41	172.1	-170.2	-179.7	25.8	0	0	112.4	L333 R334 G335 S340 Q341	L333-Q337 PolarHBondContact O-N 3.12Å; L333-Q337 VanDerWaalsContact O-N 3.11Å; R334-Q337 WeakPolarHBondContact O-CB 3.22Å; R334-Q337 PolarHBondContact O-N 3.44Å; G335-Q337 VanDerWaalsContact C-N 3.27Å; G335-Q337 PolarHBondContact O-N 2.68Å; Q337-S340 WeakPolarHBondContact O-CB 3.49Å; Q337-S340 PolarHBondContact O-N 2.82Å; Q337-Q341 WeakPolarHBondContact O-CG 3.48Å; Q337-Q341 PolarHBondContact O-N 2.93Å; Q337-Q341 VanDerWaalsContact O-N 3.13Å
338	L	90.2	Very high	85.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-69.4	-38.2	177.4	-64.6	169.8	0	0	0	111.6	R334 G335 S340 Q341 V342 A366 E369 M370	R334-L338 HydrophobicContact CG-CD1 4.4Å; R334-L338 WeakPolarHBondContact O-CG 3.48Å; R334-L338 PolarHBondContact O-N 3.44Å; R334-L338 VanDerWaalsContact O-N 3.08Å; G335-L338 WeakPolarHBondContact O-CB 3.35Å; G335-L338 PolarHBondContact O-N 2.86Å; L338-S340 VanDerWaalsContact C-N 3.29Å; L338-S340 PolarHBondContact O-N 3.19Å; L338-Q341 PolarHBondContact O-N 3.02Å; L338-V342 PolarHBondContact O-N 3.16Å; L338-A366 HydrophobicContact CD2-CB 4.23Å; L338-E369 HydrophobicContact CD1-CB 3.92Å; L338-E369 HydrophobicContact CD2-CB 4.07Å; L338-M370 HydrophobicContact CB-CE 4.27Å; L338-M370 HydrophobicContact CD1-CB 4.05Å
339	C	90.3	Very high	86.1	Confident	13 Å²	13	54.1 Å²	54.1	9%	0.088	29%	0.287	C	S	.	.	H	α-helix	trans	-57.7	-41.2	170.1	-64.5	0	0	0	0	112	I306 N310 G335 S343	I306-C339 HydrophobicContact CG2-CB 4.39Å; N310-C339 VanDerWaalsContact CB-SG 3.55Å; G335-C339 PolarHBondContact O-N 3.18Å; G335-C339 PolarHBondContact O-SG 2.96Å; G335-C339 VanDerWaalsContact O-SG 3.37Å; C339-S343 WeakPolarHBondContact O-CB 3.45Å; C339-S343 PolarHBondContact O-N 3.06Å; C339-S343 PolarHBondContact O-OG 2.91Å
340	S	89.8	Confident	86.1	Confident	68 Å²	68	55.1 Å²	55.1	48%	0.476	30%	0.295	S	S	.	.	H	α-helix	trans	-62.9	-46.1	176.6	-166.9	0	0	0	0	111.8	N336 Q337 L338 V342 S343 E344	N336-S340 PolarHBondContact O-N 3.21Å; N336-S340 VanDerWaalsContact O-N 3.08Å; Q337-S340 WeakPolarHBondContact O-CB 3.49Å; Q337-S340 PolarHBondContact O-N 2.82Å; L338-S340 VanDerWaalsContact C-N 3.29Å; L338-S340 PolarHBondContact O-N 3.19Å; S340-V342 PolarHBondContact O-N 3.43Å; S340-S343 CarbonylContact O-C 3.59Å; S340-S343 WeakPolarHBondContact O-CB 3.39Å; S340-S343 PolarHBondContact O-N 2.94Å; S340-S343 VanDerWaalsContact O-N 3.11Å; S340-E344 PolarHBondContact O-N 3.45Å
341	Q	89.4	Confident	85.9	Confident	67 Å²	67	58.1 Å²	58.1	31%	0.313	30%	0.301	S	S	.	.	H	α-helix	trans	-58.3	-44.2	179.3	-71.7	175.8	-4.6	0	0	112.9	Q337 L338 E344 V345	Q337-Q341 WeakPolarHBondContact O-CG 3.48Å; Q337-Q341 PolarHBondContact O-N 2.93Å; Q337-Q341 VanDerWaalsContact O-N 3.13Å; L338-Q341 PolarHBondContact O-N 3.02Å; Q341-E344 PolarHBondContact O-N 3.46Å; Q341-V345 PolarHBondContact O-N 3.05Å
342	V	90.8	Very high	85.2	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.006	33%	0.332	C	S	.	.	H	α-helix	trans	-73.1	-32.1	177.2	179.7	0	0	0	0	111.7	L299 I302 Q303 I306 L338 S340 E344 V345 V346 A363 A366	L299-V342 HydrophobicContact CD1-CG1 4.27Å; I302-V342 HydrophobicContact CG2-CG1 4.38Å; Q303-V342 HydrophobicContact CB-CG1 4.26Å; I306-V342 HydrophobicContact CD1-CB 4.12Å; I306-V342 HydrophobicContact CD1-CG1 4.36Å; I306-V342 HydrophobicContact CD1-CG2 3.42Å; I306-V342 VanDerWaalsContact CD1-CG2 3.42Å; L338-V342 PolarHBondContact O-N 3.16Å; S340-V342 PolarHBondContact O-N 3.43Å; V342-E344 VanDerWaalsContact C-N 3.33Å; V342-E344 PolarHBondContact O-N 3.5Å; V342-V345 PolarHBondContact O-N 2.91Å; V342-V346 HydrophobicContact CG1-CG2 4.45Å; V342-V346 WeakPolarHBondContact O-CG2 3.47Å; V342-V346 PolarHBondContact O-N 3.38Å; V342-A363 HydrophobicContact CG1-CB 4.36Å; V342-A363 HydrophobicContact CG2-CB 4.26Å; V342-A366 HydrophobicContact CG2-CB 3.56Å
343	S	90.3	Very high	84.8	Confident	53 Å²	53	67.6 Å²	67.6	37%	0.371	36%	0.363	S	S	.	.	H	α-helix	trans	-64.8	-34.9	172.3	-57.6	0	0	0	0	112.5	C339 S340 R347	C339-S343 WeakPolarHBondContact O-CB 3.45Å; C339-S343 PolarHBondContact O-N 3.06Å; C339-S343 PolarHBondContact O-OG 2.91Å; S340-S343 CarbonylContact O-C 3.59Å; S340-S343 WeakPolarHBondContact O-CB 3.39Å; S340-S343 PolarHBondContact O-N 2.94Å; S340-S343 VanDerWaalsContact O-N 3.11Å; S343-R347 WeakPolarHBondContact O-CB 3.38Å; S343-R347 PolarHBondContact O-N 3.41Å
344	E	88.5	Confident	84.8	Confident	102 Å²	102	65.8 Å²	65.8	48%	0.477	35%	0.349	S	S	.	.	H	α-helix	trans	-66.4	-41.7	171.9	-71.3	-159.1	117.5	0	0	112.4	S340 Q341 V342 R347 K348	S340-E344 PolarHBondContact O-N 3.45Å; Q341-E344 PolarHBondContact O-N 3.46Å; V342-E344 VanDerWaalsContact C-N 3.33Å; V342-E344 PolarHBondContact O-N 3.5Å; E344-R347 PolarHBondContact O-N 2.97Å; E344-K348 WeakPolarHBondContact O-CG 3.43Å; E344-K348 PolarHBondContact O-N 3.08Å; E344-K348 VanDerWaalsContact O-N 3.1Å
345	V	89	Confident	84.8	Confident	4 Å²	4	61.9 Å²	61.9	2%	0.024	34%	0.335	C	S	.	.	H	α-helix	trans	-61.5	-48.6	175	172.3	0	0	0	0	110.8	L299 Q341 V342 R347 K348 T349 D359 V362	L299-V345 HydrophobicContact CD1-CG1 3.81Å; L299-V345 HydrophobicContact CD2-CG1 3.95Å; Q341-V345 PolarHBondContact O-N 3.05Å; V342-V345 PolarHBondContact O-N 2.91Å; V345-R347 VanDerWaalsContact C-N 3.31Å; V345-R347 PolarHBondContact O-N 3.38Å; V345-K348 PolarHBondContact O-N 3.36Å; V345-T349 PolarHBondContact O-N 2.91Å; V345-D359 HydrophobicContact CG1-CB 3.74Å; V345-V362 HydrophobicContact CG2-CB 4.35Å; V345-V362 HydrophobicContact CG2-CG1 3.93Å
346	V	88.4	Confident	84.8	Confident	28 Å²	28	63.7 Å²	63.7	17%	0.17	35%	0.348	C	S	.	.	H	α-helix	trans	-57.5	-43.9	175.7	171	0	0	0	0	111.1	L299 Q303 V342 K348 T349 A350	L299-V346 HydrophobicContact CD1-CG2 4.15Å; L299-V346 HydrophobicContact CD2-CG2 3.9Å; L299-V346 HydrophobicContact CG-CG2 3.79Å; Q303-V346 HydrophobicContact CB-CG2 4.44Å; Q303-V346 HydrophobicContact CG-CG2 4.49Å; V342-V346 HydrophobicContact CG1-CG2 4.45Å; V342-V346 WeakPolarHBondContact O-CG2 3.47Å; V342-V346 PolarHBondContact O-N 3.38Å; V346-K348 PolarHBondContact O-N 3.3Å; V346-T349 PolarHBondContact O-N 3.21Å; V346-T349 VanDerWaalsContact O-N 3.14Å; V346-T349 PolarHBondContact O-OG1 3.19Å; V346-A350 PolarHBondContact O-N 3.41Å; V346-A350 VanDerWaalsContact O-N 3.1Å
347	R	86.6	Confident	84.8	Confident	127 Å²	127	64.6 Å²	64.6	48%	0.479	36%	0.356	S	S	.	.	H	α-helix	trans	-57.7	-47.2	177.1	-176.1	-178	58.1	72.7	-4.2	112.5	S343 E344 V345 T349 A350 E351	S343-R347 WeakPolarHBondContact O-CB 3.38Å; S343-R347 PolarHBondContact O-N 3.41Å; E344-R347 PolarHBondContact O-N 2.97Å; V345-R347 VanDerWaalsContact C-N 3.31Å; V345-R347 PolarHBondContact O-N 3.38Å; R347-T349 VanDerWaalsContact C-N 3.26Å; R347-T349 PolarHBondContact O-N 2.92Å; R347-A350 WeakPolarHBondContact O-CB 3.44Å; R347-A350 PolarHBondContact O-N 3.23Å; R347-A350 VanDerWaalsContact O-N 3.1Å; R347-E351 IonicContact CZ-OE1 3.81Å; R347-E351 IonicContact NH1-OE1 2.69Å; R347-E351 PolarHBondContact NH1-OE1 3.35Å
348	K	82.5	Confident	84.6	Confident	100 Å²	100	66.6 Å²	66.6	44%	0.435	37%	0.365	S	S	.	.	H	α-helix	trans	-56	-42.6	176.3	-63.8	176.2	-160.3	169.1	0	111.6	E344 V345 V346 A350 E351 D359	E344-K348 WeakPolarHBondContact O-CG 3.43Å; E344-K348 PolarHBondContact O-N 3.08Å; E344-K348 VanDerWaalsContact O-N 3.1Å; V345-K348 PolarHBondContact O-N 3.36Å; V346-K348 PolarHBondContact O-N 3.3Å; K348-A350 VanDerWaalsContact C-N 3.25Å; K348-A350 PolarHBondContact O-N 3.42Å; K348-E351 WeakPolarHBondContact O-CB 3.24Å; K348-E351 PolarHBondContact O-N 2.9Å; K348-D359 IonicContact NZ-OD1 3.66Å; K348-D359 PolarHBondContact NZ-OD1 2.81Å
349	T	81.8	Confident	84.5	Confident	17 Å²	17	67.8 Å²	67.8	10%	0.104	37%	0.371	C	S	.	.	H	α-helix	trans	-71.8	-20.1	-178.3	64.6	0	0	0	0	113.3	L299 V345 V346 R347 E351 E353 P355	L299-T349 HydrophobicContact CD2-CG2 4Å; V345-T349 PolarHBondContact O-N 2.91Å; V346-T349 PolarHBondContact O-N 3.21Å; V346-T349 VanDerWaalsContact O-N 3.14Å; V346-T349 PolarHBondContact O-OG1 3.19Å; R347-T349 VanDerWaalsContact C-N 3.26Å; R347-T349 PolarHBondContact O-N 2.92Å; T349-E351 VanDerWaalsContact C-N 3.27Å; T349-E351 PolarHBondContact O-N 3.17Å; T349-E353 WeakPolarHBondContact CA-O 3.25Å; T349-P355 HydrophobicContact CG2-CB 3.79Å; T349-P355 HydrophobicContact CG2-CG 3.72Å
350	A	74.3	Confident	84.6	Confident	84 Å²	84	67.9 Å²	67.9	69%	0.694	37%	0.371	S	S	*	.	H	α-helix	trans	-75.4	-13.3	170.8	0	0	0	0	0	113.3	V346 R347 K348 G352	V346-A350 PolarHBondContact O-N 3.41Å; V346-A350 VanDerWaalsContact O-N 3.1Å; R347-A350 WeakPolarHBondContact O-CB 3.44Å; R347-A350 PolarHBondContact O-N 3.23Å; R347-A350 VanDerWaalsContact O-N 3.1Å; K348-A350 VanDerWaalsContact C-N 3.25Å; K348-A350 PolarHBondContact O-N 3.42Å; A350-G352 VanDerWaalsContact C-N 3.27Å; A350-G352 PolarHBondContact O-N 2.9Å
351	E	76.1	Confident	84.6	Confident	137 Å²	137	66.3 Å²	66.3	64%	0.64	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-3.9	179.5	-65.7	164.4	-159.9	0	0	112.7	R347 K348 T349	R347-E351 IonicContact CZ-OE1 3.81Å; R347-E351 IonicContact NH1-OE1 2.69Å; R347-E351 PolarHBondContact NH1-OE1 3.35Å; K348-E351 WeakPolarHBondContact O-CB 3.24Å; K348-E351 PolarHBondContact O-N 2.9Å; T349-E351 VanDerWaalsContact C-N 3.27Å; T349-E351 PolarHBondContact O-N 3.17Å
352	G	64.6	Low	84.6	Confident	71 Å²	71	65.6 Å²	65.6	73%	0.732	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	131.6	-12.5	162.6	0	0	0	0	0	116	A350	A350-G352 VanDerWaalsContact C-N 3.27Å; A350-G352 PolarHBondContact O-N 2.9Å
353	E	74.8	Confident	84.6	Confident	165 Å²	165	65.5 Å²	65.5	77%	0.771	36%	0.362	S	S	*	.	S	Bend	trans	-103	147.7	-178.3	-61.5	-170.4	165.2	0	0	112.2	T349	T349-E353 WeakPolarHBondContact CA-O 3.25Å
354	F	84.4	Confident	84.6	Confident	90 Å²	90	67.9 Å²	67.9	40%	0.395	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-68.6	150.5	175.1	-68.1	-64.3	0	0	0	111.4	Q289 G292 R293 S356	Q289-F354 HydrophobicContact CB-CE2 4.38Å; Q289-F354 HydrophobicContact CG-CE2 4.33Å; G292-F354 VanDerWaalsContact CA-CG 3.45Å; G292-F354 WeakPolarHBondContact O-CD1 3.27Å; R293-F354 HydrophobicContact CB-CE1 4.5Å; R293-F354 HydrophobicContact CG-CE1 3.7Å; R293-F354 HydrophobicContact CG-CZ 3.94Å; F354-S356 PolarHBondContact O-N 3.37Å
355	P	86.6	Confident	84.7	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.013	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-55.5	130	178.6	-10.9	15.4	0	0	0	112.1	R295 L296 L299 T349 M360	R295-P355 HydrophobicContact CB-CB 4.21Å; R295-P355 HydrophobicContact CB-CG 4.02Å; R295-P355 WeakPolarHBondContact CD-O 3.26Å; L296-P355 HydrophobicContact CB-CG 4.18Å; L296-P355 HydrophobicContact CD1-CG 4.26Å; L299-P355 HydrophobicContact CB-CG 4.48Å; L299-P355 HydrophobicContact CD2-CB 4.29Å; L299-P355 HydrophobicContact CD2-CG 3.94Å; T349-P355 HydrophobicContact CG2-CB 3.79Å; T349-P355 HydrophobicContact CG2-CG 3.72Å; P355-M360 HydrophobicContact CB-CG 4.12Å; P355-M360 HydrophobicContact CB-SD 3.91Å; P355-M360 HydrophobicContact CG-SD 4.35Å
356	S	85.8	Confident	84.7	Confident	39 Å²	39	69.7 Å²	69.7	27%	0.273	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-67.9	167.3	172.8	70.7	0	0	0	0	111.4	F354 E358 D359 M360	F354-S356 PolarHBondContact O-N 3.37Å; S356-E358 PolarHBondContact O-N 3.41Å; S356-D359 WeakPolarHBondContact CB-OD2 3.45Å; S356-D359 PolarHBondContact O-N 3.02Å; S356-D359 VanDerWaalsContact OG-CB 3.31Å; S356-D359 WeakPolarHBondContact OG-CB 3.45Å; S356-D359 PolarHBondContact OG-N 2.84Å; S356-D359 PolarHBondContact OG-OD2 2.89Å; S356-M360 WeakPolarHBondContact O-CG 3.45Å; S356-M360 PolarHBondContact O-N 3.21Å
357	V	86.7	Confident	84.8	Confident	92 Å²	92	68.9 Å²	68.9	56%	0.558	36%	0.364	S	S	*	.	H	α-helix	trans	-67.7	-34.3	175.6	-178.8	0	0	0	0	109.9	A361	V357-A361 WeakPolarHBondContact O-CB 3.11Å; V357-A361 PolarHBondContact O-N 3.2Å
358	E	86.3	Confident	84.8	Confident	138 Å²	138	66.6 Å²	66.6	65%	0.645	37%	0.366	S	S	*	.	H	α-helix	trans	-65	-45.7	175	-65.2	74.4	-170.6	0	0	112	S356 A361 V362	S356-E358 PolarHBondContact O-N 3.41Å; E358-A361 PolarHBondContact O-N 3.32Å; E358-V362 WeakPolarHBondContact O-CG2 3.33Å; E358-V362 PolarHBondContact O-N 2.78Å
359	D	88.7	Confident	85.1	Confident	26 Å²	26	65.5 Å²	65.5	14%	0.139	36%	0.363	C	S	.	.	H	α-helix	trans	-64.4	-43.3	176.6	-76.1	-57.8	0	0	0	111.5	V345 K348 S356 A361 V362 A363	V345-D359 HydrophobicContact CG1-CB 3.74Å; K348-D359 IonicContact NZ-OD1 3.66Å; K348-D359 PolarHBondContact NZ-OD1 2.81Å; S356-D359 WeakPolarHBondContact CB-OD2 3.45Å; S356-D359 PolarHBondContact O-N 3.02Å; S356-D359 VanDerWaalsContact OG-CB 3.31Å; S356-D359 WeakPolarHBondContact OG-CB 3.45Å; S356-D359 PolarHBondContact OG-N 2.84Å; S356-D359 PolarHBondContact OG-OD2 2.89Å; D359-A361 PolarHBondContact O-N 2.74Å; D359-V362 WeakPolarHBondContact O-CB 3.35Å; D359-V362 PolarHBondContact O-N 2.81Å; D359-A363 PolarHBondContact O-N 3.31Å
360	M	90.9	Very high	85.3	Confident	14 Å²	14	64.7 Å²	64.7	7%	0.069	36%	0.358	C	S	.	.	H	α-helix	trans	-59.4	-46.2	172.4	-72.2	-55.5	-53.9	0	0	111.3	R295 L299 I302 P355 S356 V362 A363 E364	R295-M360 HydrophobicContact CB-CG 4Å; R295-M360 HydrophobicContact CB-SD 3.96Å; R295-M360 HydrophobicContact CG-CG 4.09Å; R295-M360 VanDerWaalsContact O-SD 3.32Å; L299-M360 HydrophobicContact CB-CE 4.49Å; L299-M360 HydrophobicContact CB-SD 3.91Å; I302-M360 HydrophobicContact CD1-CE 3.9Å; P355-M360 HydrophobicContact CB-CG 4.12Å; P355-M360 HydrophobicContact CB-SD 3.91Å; P355-M360 HydrophobicContact CG-SD 4.35Å; S356-M360 WeakPolarHBondContact O-CG 3.45Å; S356-M360 PolarHBondContact O-N 3.21Å; M360-V362 VanDerWaalsContact C-N 3.26Å; M360-V362 PolarHBondContact O-N 2.92Å; M360-A363 PolarHBondContact O-N 3.02Å; M360-A363 VanDerWaalsContact O-N 3.12Å; M360-E364 WeakPolarHBondContact O-CB 3.23Å; M360-E364 WeakPolarHBondContact O-CG 3.43Å; M360-E364 PolarHBondContact O-N 3.12Å
361	A	89.4	Confident	86	Confident	35 Å²	35	66.5 Å²	66.5	29%	0.289	35%	0.347	S	S	.	.	H	α-helix	trans	-65.1	-27	176.9	0	0	0	0	0	112.9	V357 E358 D359 R365	V357-A361 WeakPolarHBondContact O-CB 3.11Å; V357-A361 PolarHBondContact O-N 3.2Å; E358-A361 PolarHBondContact O-N 3.32Å; D359-A361 PolarHBondContact O-N 2.74Å; A361-R365 WeakPolarHBondContact O-CB 3.35Å; A361-R365 VanDerWaalsContact O-CG 3.3Å; A361-R365 WeakPolarHBondContact O-CG 3.42Å; A361-R365 PolarHBondContact O-N 2.84Å; A361-R365 PolarHBondContact O-NE 3.42Å
362	V	90.3	Very high	86.5	Confident	52 Å²	52	61.6 Å²	61.6	32%	0.315	33%	0.327	S	S	.	.	H	α-helix	trans	-69	-47.7	169.3	169.4	0	0	0	0	110.6	V345 E358 D359 M360 R365 A366	V345-V362 HydrophobicContact CG2-CB 4.35Å; V345-V362 HydrophobicContact CG2-CG1 3.93Å; E358-V362 WeakPolarHBondContact O-CG2 3.33Å; E358-V362 PolarHBondContact O-N 2.78Å; D359-V362 WeakPolarHBondContact O-CB 3.35Å; D359-V362 PolarHBondContact O-N 2.81Å; M360-V362 VanDerWaalsContact C-N 3.26Å; M360-V362 PolarHBondContact O-N 2.92Å; V362-R365 PolarHBondContact O-N 3.18Å; V362-A366 PolarHBondContact O-N 2.99Å
363	A	90.9	Very high	87.5	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.2	-43.7	179.8	0	0	0	0	0	112.7	L299 I302 V342 D359 M360 R365 A366 L367	L299-A363 HydrophobicContact CD1-CB 3.58Å; I302-A363 HydrophobicContact CD1-CB 4.27Å; I302-A363 HydrophobicContact CG2-CB 4Å; V342-A363 HydrophobicContact CG1-CB 4.36Å; V342-A363 HydrophobicContact CG2-CB 4.26Å; D359-A363 PolarHBondContact O-N 3.31Å; M360-A363 PolarHBondContact O-N 3.02Å; M360-A363 VanDerWaalsContact O-N 3.12Å; A363-R365 PolarHBondContact O-N 3.41Å; A363-A366 PolarHBondContact O-N 3.27Å; A363-L367 PolarHBondContact O-N 3.48Å
364	E	90.6	Very high	87.8	Confident	102 Å²	102	52.6 Å²	52.6	48%	0.477	27%	0.268	S	S	.	.	H	α-helix	trans	-64.9	-37.2	176.3	-71.6	175.5	-176.3	0	0	112.7	I302 M360 L367 C368	I302-E364 HydrophobicContact CD1-CG 3.76Å; M360-E364 WeakPolarHBondContact O-CB 3.23Å; M360-E364 WeakPolarHBondContact O-CG 3.43Å; M360-E364 PolarHBondContact O-N 3.12Å; E364-L367 PolarHBondContact O-N 3.46Å; E364-C368 WeakPolarHBondContact O-CB 3.29Å; E364-C368 PolarHBondContact O-N 3.44Å; E364-C368 PolarHBondContact O-SG 2.84Å
365	R	89.9	Confident	87.8	Confident	143 Å²	143	54.5 Å²	54.5	54%	0.54	27%	0.272	S	S	.	.	H	α-helix	trans	-65.8	-45.3	172.3	-82.1	177	-69.7	177.8	-1.6	111.4	A361 V362 A363 L367 C368 E369	A361-R365 WeakPolarHBondContact O-CB 3.35Å; A361-R365 VanDerWaalsContact O-CG 3.3Å; A361-R365 WeakPolarHBondContact O-CG 3.42Å; A361-R365 PolarHBondContact O-N 2.84Å; A361-R365 PolarHBondContact O-NE 3.42Å; V362-R365 PolarHBondContact O-N 3.18Å; A363-R365 PolarHBondContact O-N 3.41Å; R365-L367 VanDerWaalsContact C-N 3.28Å; R365-L367 PolarHBondContact O-N 3.42Å; R365-C368 PolarHBondContact O-N 3.26Å; R365-E369 WeakPolarHBondContact O-CB 3.45Å; R365-E369 WeakPolarHBondContact O-CG 3.42Å; R365-E369 PolarHBondContact O-N 3.31Å
366	A	89.8	Confident	87.4	Confident	2 Å²	2	58.5 Å²	58.5	2%	0.017	29%	0.291	C	S	.	.	H	α-helix	trans	-61	-36.7	177	0	0	0	0	0	112.2	I306 L338 V342 V362 A363 M370	I306-A366 HydrophobicContact CD1-CB 4.28Å; L338-A366 HydrophobicContact CD2-CB 4.23Å; V342-A366 HydrophobicContact CG2-CB 3.56Å; V362-A366 PolarHBondContact O-N 2.99Å; A363-A366 PolarHBondContact O-N 3.27Å; A366-M370 VanDerWaalsContact O-CB 3.31Å; A366-M370 WeakPolarHBondContact O-CB 3.41Å; A366-M370 PolarHBondContact O-N 2.77Å
367	L	89.5	Confident	87	Confident	11 Å²	11	57.6 Å²	57.6	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-66.9	-45.5	172.5	177.9	57.5	0	0	0	112.5	I302 E305 I306 L309 A363 E364 R365 E369 M370 R371	I302-L367 HydrophobicContact CG1-CD2 4.07Å; I302-L367 HydrophobicContact CG2-CB 4.08Å; I302-L367 HydrophobicContact CG2-CD2 4.28Å; E305-L367 HydrophobicContact CB-CD1 4.23Å; E305-L367 HydrophobicContact CG-CD1 4.07Å; I306-L367 HydrophobicContact CD1-CB 3.97Å; I306-L367 HydrophobicContact CG1-CB 4.06Å; I306-L367 HydrophobicContact CG1-CD1 3.75Å; I306-L367 HydrophobicContact CG1-CG 4.48Å; L309-L367 HydrophobicContact CD1-CD1 3.64Å; A363-L367 PolarHBondContact O-N 3.48Å; E364-L367 PolarHBondContact O-N 3.46Å; R365-L367 VanDerWaalsContact C-N 3.28Å; R365-L367 PolarHBondContact O-N 3.42Å; L367-E369 VanDerWaalsContact C-N 3.32Å; L367-E369 PolarHBondContact O-N 2.96Å; L367-M370 PolarHBondContact O-N 2.62Å; L367-R371 HydrophobicContact CD1-CG 4.22Å; L367-R371 WeakPolarHBondContact O-CB 3.45Å; L367-R371 WeakPolarHBondContact O-CG 3.47Å; L367-R371 PolarHBondContact O-N 3.3Å
368	C	88.2	Confident	86.2	Confident	78 Å²	78	54.6 Å²	54.6	53%	0.527	27%	0.271	S	S	.	.	H	α-helix	trans	-62.3	-39.2	176.3	-69.7	0	0	0	0	112	E364 R365 S372	E364-C368 WeakPolarHBondContact O-CB 3.29Å; E364-C368 PolarHBondContact O-N 3.44Å; E364-C368 PolarHBondContact O-SG 2.84Å; R365-C368 PolarHBondContact O-N 3.26Å; C368-S372 WeakPolarHBondContact O-CB 3.36Å; C368-S372 PolarHBondContact O-N 3Å
369	E	87.5	Confident	85.5	Confident	78 Å²	78	51.8 Å²	51.8	36%	0.364	26%	0.258	S	S	.	.	H	α-helix	trans	-65.6	-44.4	172.7	-74.7	-170.2	-140.7	0	0	111.8	R334 L338 R365 L367 R371 S372 V373	R334-E369 IonicContact CZ-OE2 2.78Å; R334-E369 IonicContact NE-OE2 2.76Å; R334-E369 IonicContact NH2-OE2 2.77Å; R334-E369 PolarHBondContact NH2-OE2 3.33Å; L338-E369 HydrophobicContact CD1-CB 3.92Å; L338-E369 HydrophobicContact CD2-CB 4.07Å; R365-E369 WeakPolarHBondContact O-CB 3.45Å; R365-E369 WeakPolarHBondContact O-CG 3.42Å; R365-E369 PolarHBondContact O-N 3.31Å; L367-E369 VanDerWaalsContact C-N 3.32Å; L367-E369 PolarHBondContact O-N 2.96Å; E369-R371 PolarHBondContact O-N 3.2Å; E369-S372 CarbonylContact O-C 3.49Å; E369-S372 WeakPolarHBondContact O-CA 3.42Å; E369-S372 WeakPolarHBondContact O-CB 3.17Å; E369-S372 PolarHBondContact O-N 2.9Å; E369-V373 WeakPolarHBondContact O-CG2 3.31Å; E369-V373 PolarHBondContact O-N 3.12Å
370	M	86.9	Confident	84.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.2	-47.8	177.2	-179.3	65.3	93	0	0	111.5	I306 L309 N310 L313 G335 L338 A366 L367 S372 V373 I374	I306-M370 HydrophobicContact CG2-CE 3.86Å; L309-M370 HydrophobicContact CB-CG 3.62Å; L309-M370 HydrophobicContact CB-SD 4.41Å; L309-M370 HydrophobicContact CD1-CB 4.49Å; L309-M370 HydrophobicContact CD1-CG 3.89Å; L309-M370 HydrophobicContact CG-CG 4.42Å; N310-M370 HydrophobicContact CB-CE 3.82Å; L313-M370 HydrophobicContact CD1-CE 4.45Å; L313-M370 HydrophobicContact CD1-SD 3.52Å; L313-M370 VanDerWaalsContact CD1-SD 3.52Å; G335-M370 WeakPolarHBondContact O-CE 3.42Å; L338-M370 HydrophobicContact CB-CE 4.27Å; L338-M370 HydrophobicContact CD1-CB 4.05Å; A366-M370 VanDerWaalsContact O-CB 3.31Å; A366-M370 WeakPolarHBondContact O-CB 3.41Å; A366-M370 PolarHBondContact O-N 2.77Å; L367-M370 PolarHBondContact O-N 2.62Å; M370-S372 VanDerWaalsContact C-N 3.25Å; M370-S372 PolarHBondContact O-N 3.47Å; M370-V373 PolarHBondContact O-N 3.19Å; M370-I374 HydrophobicContact CG-CD1 4.42Å; M370-I374 PolarHBondContact O-N 2.86Å; M370-I374 VanDerWaalsContact O-N 3.08Å
371	R	88.8	Confident	83.2	Confident	121 Å²	121	54.7 Å²	54.7	46%	0.457	28%	0.276	S	S	.	.	H	α-helix	trans	-59.1	-36.3	172.7	-69.8	172.3	176.7	171.1	-1.9	111.7	E305 L309 L367 E369 R375	E305-R371 IonicContact OE1-CZ 2.8Å; E305-R371 IonicContact OE1-NE 3.74Å; E305-R371 PolarHBondContact OE1-NE 3.2Å; E305-R371 IonicContact OE1-NH2 3.46Å; E305-R371 PolarHBondContact OE1-NH2 3.41Å; E305-R371 IonicContact OE2-CZ 3.36Å; E305-R371 IonicContact OE2-NH2 3.35Å; E305-R371 PolarHBondContact OE2-NH2 3.13Å; L309-R371 HydrophobicContact CD1-CG 3.72Å; L367-R371 HydrophobicContact CD1-CG 4.22Å; L367-R371 WeakPolarHBondContact O-CB 3.45Å; L367-R371 WeakPolarHBondContact O-CG 3.47Å; L367-R371 PolarHBondContact O-N 3.3Å; E369-R371 PolarHBondContact O-N 3.2Å; R371-R375 WeakPolarHBondContact O-CB 3.37Å; R371-R375 PolarHBondContact O-N 3.03Å
372	S	85.2	Confident	82	Confident	34 Å²	34	57.6 Å²	57.6	24%	0.238	29%	0.287	C	S	.	.	H	α-helix	trans	-73.1	-34.7	176.7	-166.4	0	0	0	0	113.4	C368 E369 M370 R375 Q376	C368-S372 WeakPolarHBondContact O-CB 3.36Å; C368-S372 PolarHBondContact O-N 3Å; E369-S372 CarbonylContact O-C 3.49Å; E369-S372 WeakPolarHBondContact O-CA 3.42Å; E369-S372 WeakPolarHBondContact O-CB 3.17Å; E369-S372 PolarHBondContact O-N 2.9Å; M370-S372 VanDerWaalsContact C-N 3.25Å; M370-S372 PolarHBondContact O-N 3.47Å; S372-R375 PolarHBondContact O-N 3.3Å; S372-R375 PolarHBondContact OG-NH2 2.92Å; S372-Q376 WeakPolarHBondContact O-CB 3.29Å; S372-Q376 WeakPolarHBondContact O-CG 3.44Å; S372-Q376 PolarHBondContact O-N 2.9Å
373	V	85.6	Confident	80.8	Confident	12 Å²	12	63.4 Å²	63.4	7%	0.073	30%	0.303	C	S	.	.	H	α-helix	trans	-64.5	-44.4	173.7	171	0	0	0	0	110.3	L313 H331 R334 E369 M370 Q376 M377	L313-V373 HydrophobicContact CD1-CG1 4.23Å; L313-V373 HydrophobicContact CD2-CG1 4.02Å; H331-V373 HydrophobicContact CB-CG1 4.06Å; R334-V373 HydrophobicContact CG-CG2 3.95Å; E369-V373 WeakPolarHBondContact O-CG2 3.31Å; E369-V373 PolarHBondContact O-N 3.12Å; M370-V373 PolarHBondContact O-N 3.19Å; V373-Q376 PolarHBondContact O-N 3.27Å; V373-M377 WeakPolarHBondContact O-CB 3.47Å; V373-M377 PolarHBondContact O-N 3.22Å
374	I	82.3	Confident	79.2	Confident	35 Å²	35	66.2 Å²	66.2	18%	0.179	32%	0.32	C	S	.	.	H	α-helix	trans	-65.2	-42.1	176.1	-70.1	163.9	0	0	0	111.3	L309 L313 M370 Q376 M377 G378	L309-I374 HydrophobicContact CB-CD1 3.55Å; L309-I374 HydrophobicContact CD2-CD1 3.66Å; L309-I374 HydrophobicContact CG-CD1 4.1Å; L309-I374 WeakPolarHBondContact O-CD1 3.47Å; L313-I374 HydrophobicContact CD1-CG1 4.29Å; L313-I374 HydrophobicContact CD2-CG1 3.75Å; L313-I374 HydrophobicContact CG-CD1 4.37Å; L313-I374 HydrophobicContact CG-CG1 3.87Å; M370-I374 HydrophobicContact CG-CD1 4.42Å; M370-I374 PolarHBondContact O-N 2.86Å; M370-I374 VanDerWaalsContact O-N 3.08Å; I374-Q376 VanDerWaalsContact C-N 3.33Å; I374-Q376 PolarHBondContact O-N 3.3Å; I374-M377 PolarHBondContact O-N 2.88Å; I374-G378 PolarHBondContact O-N 3.48Å
375	R	83.1	Confident	77.3	Confident	130 Å²	130	67 Å²	67	49%	0.491	32%	0.324	S	S	.	.	H	α-helix	trans	-60.9	-41.1	172.7	-176.9	179	59.7	85.5	6.4	111.8	R371 S372 G378 E379	R371-R375 WeakPolarHBondContact O-CB 3.37Å; R371-R375 PolarHBondContact O-N 3.03Å; S372-R375 PolarHBondContact O-N 3.3Å; S372-R375 PolarHBondContact OG-NH2 2.92Å; R375-G378 PolarHBondContact O-N 3.17Å; R375-E379 WeakPolarHBondContact CD-OE1 3.46Å; R375-E379 HydrophobicContact CG-CG 4.31Å; R375-E379 VanDerWaalsContact CG-OE1 3.26Å; R375-E379 WeakPolarHBondContact CG-OE1 3.49Å; R375-E379 IonicContact CZ-OE1 2.87Å; R375-E379 IonicContact NE-OE1 3.17Å; R375-E379 VanDerWaalsContact NH1-CD 3.28Å; R375-E379 IonicContact NH1-OE1 3.77Å; R375-E379 PolarHBondContact NH1-OE1 3.15Å; R375-E379 IonicContact NH1-OE2 2.75Å; R375-E379 PolarHBondContact NH1-OE2 2.76Å; R375-E379 VanDerWaalsContact NH1-OE2 3.15Å; R375-E379 WeakPolarHBondContact O-CB 3.47Å; R375-E379 VanDerWaalsContact O-CG 3.3Å; R375-E379 WeakPolarHBondContact O-CG 3.41Å; R375-E379 PolarHBondContact O-N 3.35Å
376	Q	79.9	Confident	75.5	Confident	86 Å²	86	64 Å²	64	40%	0.402	32%	0.316	S	S	.	.	H	α-helix	trans	-66.6	-37.7	176.5	-76.3	169.3	2.3	0	0	112.4	S372 V373 I374 E379 E380	S372-Q376 WeakPolarHBondContact O-CB 3.29Å; S372-Q376 WeakPolarHBondContact O-CG 3.44Å; S372-Q376 PolarHBondContact O-N 2.9Å; V373-Q376 PolarHBondContact O-N 3.27Å; I374-Q376 VanDerWaalsContact C-N 3.33Å; I374-Q376 PolarHBondContact O-N 3.3Å; Q376-E379 CarbonylContact O-C 3.58Å; Q376-E379 PolarHBondContact O-N 2.95Å; Q376-E380 WeakPolarHBondContact O-CB 3.34Å; Q376-E380 WeakPolarHBondContact O-CG 3.42Å; Q376-E380 PolarHBondContact O-N 2.65Å
377	M	76.4	Confident	73.6	Confident	20 Å²	20	71.8 Å²	71.8	10%	0.099	35%	0.349	C	S	.	.	H	α-helix	trans	-66	-39.9	174.5	-178	-100.2	-77.4	0	0	111.8	L313 L323 V373 I374 E380 A381	L313-M377 HydrophobicContact CD2-CE 3.83Å; L323-M377 HydrophobicContact CD1-CG 4Å; L323-M377 HydrophobicContact CD1-SD 4.15Å; V373-M377 WeakPolarHBondContact O-CB 3.47Å; V373-M377 PolarHBondContact O-N 3.22Å; I374-M377 PolarHBondContact O-N 2.88Å; M377-E380 PolarHBondContact O-N 3Å; M377-A381 PolarHBondContact O-N 3Å; M377-A381 VanDerWaalsContact O-N 3.08Å
378	G	71.1	Confident	71.6	Confident	30 Å²	30	79.6 Å²	79.6	31%	0.309	38%	0.383	S	S	.	.	H	α-helix	trans	-63.6	-48.8	169.6	0	0	0	0	0	112.7	I374 R375 E380 A381 D382	I374-G378 PolarHBondContact O-N 3.48Å; R375-G378 PolarHBondContact O-N 3.17Å; G378-E380 PolarHBondContact O-N 2.66Å; G378-A381 WeakPolarHBondContact O-CB 3.45Å; G378-A381 PolarHBondContact O-N 3.33Å; G378-A381 VanDerWaalsContact O-N 3.1Å; G378-D382 PolarHBondContact O-N 2.79Å
379	E	71.3	Confident	69.6	Low	79 Å²	79	82.6 Å²	82.6	37%	0.369	39%	0.387	S	S	.	.	H	α-helix	trans	-63	-26.5	175.7	-75.8	171.6	-169.4	0	0	112.6	R375 Q376 R383	R375-E379 WeakPolarHBondContact CD-OE1 3.46Å; R375-E379 HydrophobicContact CG-CG 4.31Å; R375-E379 VanDerWaalsContact CG-OE1 3.26Å; R375-E379 WeakPolarHBondContact CG-OE1 3.49Å; R375-E379 IonicContact CZ-OE1 2.87Å; R375-E379 IonicContact NE-OE1 3.17Å; R375-E379 VanDerWaalsContact NH1-CD 3.28Å; R375-E379 IonicContact NH1-OE1 3.77Å; R375-E379 PolarHBondContact NH1-OE1 3.15Å; R375-E379 IonicContact NH1-OE2 2.75Å; R375-E379 PolarHBondContact NH1-OE2 2.76Å; R375-E379 VanDerWaalsContact NH1-OE2 3.15Å; R375-E379 WeakPolarHBondContact O-CB 3.47Å; R375-E379 VanDerWaalsContact O-CG 3.3Å; R375-E379 WeakPolarHBondContact O-CG 3.41Å; R375-E379 PolarHBondContact O-N 3.35Å; Q376-E379 CarbonylContact O-C 3.58Å; Q376-E379 PolarHBondContact O-N 2.95Å; E379-R383 WeakPolarHBondContact O-CB 3.2Å; E379-R383 VanDerWaalsContact O-CD 3.31Å; E379-R383 WeakPolarHBondContact O-CD 3.45Å; E379-R383 WeakPolarHBondContact O-CG 3.43Å; E379-R383 PolarHBondContact O-N 3.26Å
380	E	68.1	Low	67.6	Low	66 Å²	66	82.7 Å²	82.7	31%	0.308	39%	0.386	S	S	.	.	H	α-helix	trans	-73.3	-41.7	170.7	-82.2	-175.1	176.3	0	0	112.1	L323 S327 H331 Q376 M377 G378 R383 V384	L323-E380 HydrophobicContact CD2-CB 3.92Å; S327-E380 PolarHBondContact OG-OE2 3.37Å; H331-E380 IonicContact CD2-OE2 2.95Å; H331-E380 IonicContact CE1-OE2 3.89Å; H331-E380 IonicContact NE2-OE1 3.87Å; H331-E380 IonicContact NE2-OE2 3.96Å; H331-E380 PolarHBondContact NE2-OE2 2.99Å; Q376-E380 WeakPolarHBondContact O-CB 3.34Å; Q376-E380 WeakPolarHBondContact O-CG 3.42Å; Q376-E380 PolarHBondContact O-N 2.65Å; M377-E380 PolarHBondContact O-N 3Å; G378-E380 PolarHBondContact O-N 2.66Å; E380-R383 PolarHBondContact O-N 3.08Å; E380-V384 WeakPolarHBondContact O-CG2 3.44Å; E380-V384 PolarHBondContact O-N 3.38Å
381	A	63.5	Low	65.6	Low	35 Å²	35	89.9 Å²	89.9	29%	0.289	43%	0.425	S	S	.	.	H	α-helix	trans	-62.5	-47.9	172.9	0	0	0	0	0	111	L323 M377 G378 R383 V384 Q385	L323-A381 HydrophobicContact CD1-CB 4.36Å; L323-A381 HydrophobicContact CD2-CB 4.44Å; L323-A381 HydrophobicContact CG-CB 4.35Å; M377-A381 PolarHBondContact O-N 3Å; M377-A381 VanDerWaalsContact O-N 3.08Å; G378-A381 WeakPolarHBondContact O-CB 3.45Å; G378-A381 PolarHBondContact O-N 3.33Å; G378-A381 VanDerWaalsContact O-N 3.1Å; A381-R383 VanDerWaalsContact C-N 3.32Å; A381-R383 PolarHBondContact O-N 2.86Å; A381-V384 PolarHBondContact O-N 3.3Å; A381-Q385 PolarHBondContact O-N 3.34Å; A381-Q385 VanDerWaalsContact O-N 3.08Å
382	D	64.3	Low	63.5	Low	96 Å²	96	92.5 Å²	92.5	51%	0.513	44%	0.442	S	S	.	.	H	α-helix	trans	-63.1	-35.4	174.6	-78.5	-32.1	0	0	0	111.8	G378 Q385 E386	G378-D382 PolarHBondContact O-N 2.79Å; D382-Q385 CarbonylContact O-C 3.56Å; D382-Q385 WeakPolarHBondContact O-CA 3.41Å; D382-Q385 WeakPolarHBondContact O-CB 3.32Å; D382-Q385 PolarHBondContact O-N 2.76Å; D382-Q385 VanDerWaalsContact O-N 3.13Å; D382-E386 WeakPolarHBondContact O-CB 3.45Å; D382-E386 WeakPolarHBondContact O-CG 3.24Å; D382-E386 PolarHBondContact O-N 3.44Å
383	R	64.1	Low	61.8	Low	173 Å²	173	97.8 Å²	97.8	65%	0.653	46%	0.463	S	S	*	.	H	α-helix	trans	-70.2	-31	173.6	-83.5	167.8	153.4	-165.7	-5.5	113.8	E379 E380 A381 K387	E379-R383 WeakPolarHBondContact O-CB 3.2Å; E379-R383 VanDerWaalsContact O-CD 3.31Å; E379-R383 WeakPolarHBondContact O-CD 3.45Å; E379-R383 WeakPolarHBondContact O-CG 3.43Å; E379-R383 PolarHBondContact O-N 3.26Å; E380-R383 PolarHBondContact O-N 3.08Å; A381-R383 VanDerWaalsContact C-N 3.32Å; A381-R383 PolarHBondContact O-N 2.86Å; R383-K387 VanDerWaalsContact O-CB 3.29Å; R383-K387 WeakPolarHBondContact O-CB 3.23Å; R383-K387 WeakPolarHBondContact O-CG 3.42Å; R383-K387 PolarHBondContact O-N 3.48Å
384	V	58	Low	59.9	Low	60 Å²	60	105.3 Å²	105.3	36%	0.364	50%	0.497	S	S	.	.	H	α-helix	trans	-67.3	-30	169.2	169.8	0	0	0	0	110.6	E380 A381	E380-V384 WeakPolarHBondContact O-CG2 3.44Å; E380-V384 PolarHBondContact O-N 3.38Å; A381-V384 PolarHBondContact O-N 3.3Å
385	Q	50.5	Low	58.1	Low	119 Å²	119	112.2 Å²	112.2	56%	0.556	53%	0.529	S	S	*	.	H	α-helix	trans	-82.2	-35.4	176.6	-159.2	151	-78.8	0	0	113	A381 D382 K388	A381-Q385 PolarHBondContact O-N 3.34Å; A381-Q385 VanDerWaalsContact O-N 3.08Å; D382-Q385 CarbonylContact O-C 3.56Å; D382-Q385 WeakPolarHBondContact O-CA 3.41Å; D382-Q385 WeakPolarHBondContact O-CB 3.32Å; D382-Q385 PolarHBondContact O-N 2.76Å; D382-Q385 VanDerWaalsContact O-N 3.13Å; Q385-K388 PolarHBondContact O-N 3.26Å
386	E	52.3	Low	56.4	Low	79 Å²	79	114.4 Å²	114.4	37%	0.369	55%	0.545	S	S	.	.	H	α-helix	trans	-81.8	-25.5	176.8	-78	-150.1	128.9	0	0	113.6	D382 K388 K389 K390	D382-E386 WeakPolarHBondContact O-CB 3.45Å; D382-E386 WeakPolarHBondContact O-CG 3.24Å; D382-E386 PolarHBondContact O-N 3.44Å; E386-K388 PolarHBondContact O-N 3.37Å; E386-K389 CarbonylContact O-C 3.46Å; E386-K389 WeakPolarHBondContact O-CA 3.26Å; E386-K389 PolarHBondContact O-N 3.46Å; E386-K390 HydrophobicContact CB-CD 4.44Å; E386-K390 PolarHBondContact O-N 2.95Å; E386-K390 WeakPolarHBondContact OE1-CE 3.35Å; E386-K390 IonicContact OE1-NZ 2.86Å; E386-K390 PolarHBondContact OE1-NZ 3.19Å; E386-K390 WeakPolarHBondContact OE2-CD 3.27Å; E386-K390 WeakPolarHBondContact OE2-CE 3.29Å; E386-K390 IonicContact OE2-NZ 2.64Å; E386-K390 PolarHBondContact OE2-NZ 2.96Å
387	K	50.1	Low	54.9	Low	165 Å²	165	119.6 Å²	119.6	72%	0.717	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-7.1	167.2	-86.2	-173.3	171	-174.7	0	113.4	R383	R383-K387 VanDerWaalsContact O-CB 3.29Å; R383-K387 WeakPolarHBondContact O-CB 3.23Å; R383-K387 WeakPolarHBondContact O-CG 3.42Å; R383-K387 PolarHBondContact O-N 3.48Å
388	K	46.9	Very low	53.6	Low	176 Å²	176	130 Å²	130	77%	0.765	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	4	167.9	-61.8	177.8	178.7	174.1	0	113.7	Q385 E386	Q385-K388 PolarHBondContact O-N 3.26Å; E386-K388 PolarHBondContact O-N 3.37Å
389	K	46.9	Very low	52.6	Low	141 Å²	141	139.4 Å²	139.4	61%	0.613	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.2	-38.9	-179.2	-66.5	-172	175.6	-175.4	0	113.6	E386 D391 Q392	E386-K389 CarbonylContact O-C 3.46Å; E386-K389 WeakPolarHBondContact O-CA 3.26Å; E386-K389 PolarHBondContact O-N 3.46Å; K389-D391 VanDerWaalsContact C-N 3.29Å; K389-D391 PolarHBondContact O-N 3.05Å; K389-Q392 PolarHBondContact O-N 3.06Å
390	K	44.4	Very low	51.5	Low	79 Å²	79	145.1 Å²	145.1	34%	0.343	66%	0.657	S	S	.	*	G	3₁₀ helix	trans	-82.8	4.8	-173.1	-75	-175.9	173.1	163	0	115.9	E386 Q392	E386-K390 HydrophobicContact CB-CD 4.44Å; E386-K390 PolarHBondContact O-N 2.95Å; E386-K390 WeakPolarHBondContact OE1-CE 3.35Å; E386-K390 IonicContact OE1-NZ 2.86Å; E386-K390 PolarHBondContact OE1-NZ 3.19Å; E386-K390 WeakPolarHBondContact OE2-CD 3.27Å; E386-K390 WeakPolarHBondContact OE2-CE 3.29Å; E386-K390 IonicContact OE2-NZ 2.64Å; E386-K390 PolarHBondContact OE2-NZ 2.96Å; K390-Q392 PolarHBondContact O-N 3.4Å
391	D	45.8	Very low	50.1	Low	151 Å²	151	148.5 Å²	148.5	81%	0.807	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-69.9	-1.7	159.3	-74.4	-4.9	0	0	0	112.4	K389	K389-D391 VanDerWaalsContact C-N 3.29Å; K389-D391 PolarHBondContact O-N 3.05Å
392	Q	44.7	Very low	49.5	Very low	176 Å²	176	155.2 Å²	155.2	82%	0.822	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-116.9	-7.7	-176.9	-62	-170.7	-40.6	0	0	115.9	K389 K390	K389-Q392 PolarHBondContact O-N 3.06Å; K390-Q392 PolarHBondContact O-N 3.4Å
393	E	49.6	Very low	48.6	Very low	146 Å²	146	154.9 Å²	154.9	68%	0.682	71%	0.708	S	S	*	*	S	Bend	trans	-131.2	6.7	-166.5	-65.8	-178	148.6	0	0	115.7	E395	E393-E395 PolarHBondContact O-N 3.3Å
394	Q	43.9	Very low	47.7	Very low	169 Å²	169	154.7 Å²	154.7	79%	0.79	72%	0.719	S	S	*	*			trans	-99.4	43.9	-174.5	-67.8	-150.8	-35.3	0	0	116.4
395	E	45.9	Very low	47.2	Very low	181 Å²	181	161.4 Å²	161.4	85%	0.846	75%	0.747	S	S	*	*	S	Bend	trans	-114.3	-32.1	173.4	-171.3	60.3	-151.9	0	0	114.2	E393	E393-E395 PolarHBondContact O-N 3.3Å
396	E	45.8	Very low	47.2	Very low	175 Å²	175	160.5 Å²	160.5	82%	0.818	76%	0.76	S	S	*	*	S	Bend	trans	-96.6	-35.1	-158.4	-156.1	168.8	173.5	0	0	116.7	R398	E396-R398 PolarHBondContact O-N 3.04Å
397	E	50.3	Low	46.6	Very low	195 Å²	195	165.1 Å²	165.1	91%	0.911	78%	0.781	S	S	*	*	S	Bend	trans	-89	10	-167.7	-69.3	-149.8	116.9	0	0	116.7	R399	E397-R399 VanDerWaalsContact C-N 3.31Å; E397-R399 PolarHBondContact O-N 2.73Å
398	R	48.2	Very low	46.2	Very low	240 Å²	240	165.9 Å²	165.9	91%	0.906	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	22.4	178.7	-126.5	178.2	74.8	-135.5	3	115.2	E396	E396-R398 PolarHBondContact O-N 3.04Å
399	R	50.8	Low	46	Very low	226 Å²	226	167.1 Å²	167.1	85%	0.853	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.7	17.7	-173.6	-81.3	-170.6	170.8	-165.3	-0.2	116.4	E397	E397-R399 VanDerWaalsContact C-N 3.31Å; E397-R399 PolarHBondContact O-N 2.73Å
400	K	47.3	Very low	45.9	Very low	200 Å²	200	164.5 Å²	164.5	87%	0.87	80%	0.8	S	S	*	*			trans	-139.5	56.5	173.6	-63.1	176.1	-172.3	161	0	110.8
401	Q	39	Very low	45.6	Very low	136 Å²	136	169.3 Å²	169.3	64%	0.636	82%	0.824	S	S	*	*				44.3	106.5	100.3	-65	-141.8	-83.3	0	0	113.2	A403	Q401-A403 PolarHBondContact O-N 2.95Å
402	E	51.3	Low	45.6	Very low	177 Å²	177	171.7 Å²	171.7	83%	0.827	83%	0.827	S	S	*	*				65.2	2.9	80.6	-62.2	166.8	145.4	0	0	114.7
403	A	45.4	Very low	45.3	Very low	88 Å²	88	172.1 Å²	172.1	73%	0.727	83%	0.826	S	S	*	*			trans	-97.4	17.9	-170.4	0	0	0	0	0	116.2	Q401	Q401-A403 PolarHBondContact O-N 2.95Å
404	L	45.2	Very low	45.2	Very low	169 Å²	169	170.1 Å²	170.1	89%	0.885	84%	0.835	S	S	*	*	S	Bend	trans	-147.9	39.5	-174.1	-146.2	75.6	0	0	0	117.3
405	Q	46.2	Very low	45.3	Very low	202 Å²	202	170.8 Å²	170.8	94%	0.944	84%	0.838	S	S	*	*	S	Bend	trans	-128.3	53.7	166.7	-79.1	-166.6	-25.4	0	0	112.3
406	A	51.6	Low	45.2	Very low	99 Å²	99	171.3 Å²	171.3	82%	0.818	84%	0.841	S	S	*	*	S	Bend	trans	-146	39.5	-178.3	0	0	0	0	0	114.1
407	Q	38.9	Very low	45.3	Very low	177 Å²	177	168 Å²	168	83%	0.827	84%	0.843	S	S	*	*	S	Bend	trans	-155.1	154.4	169.7	-128.2	177.9	37	0	0	113.8
408	Q	42	Very low	45	Very low	181 Å²	181	163 Å²	163	85%	0.846	84%	0.835	S	S	*	*	S	Bend	trans	82.7	17.4	169.9	-51.3	-168.7	17.6	0	0	120
409	E	43.1	Very low	44.9	Very low	201 Å²	201	161.6 Å²	161.6	94%	0.939	84%	0.835	S	S	*	*	S	Bend	trans	-100.7	52.1	159.1	-161	173.8	-146.7	0	0	112.1
410	A	43.4	Very low	44.6	Very low	86 Å²	86	157.9 Å²	157.9	71%	0.711	83%	0.828	S	S	*	*			trans	-158	40.2	-176	0	0	0	0	0	117.1
411	Q	39.5	Very low	44.2	Very low	181 Å²	181	157.7 Å²	157.7	85%	0.846	83%	0.827	S	S	*	*			trans	-161.7	138.4	163.9	-114.7	151.4	72.9	0	0	113.9
412	K	44.8	Very low	44.3	Very low	200 Å²	200	160.6 Å²	160.6	87%	0.87	84%	0.841	S	S	*	*			trans	83.5	70.1	-163.3	-57.2	169.3	179.7	174.3	0	112.9
413	K	39.2	Very low	44	Very low	185 Å²	185	160.4 Å²	160.4	80%	0.804	84%	0.844	S	S	*	*				41.9	107.3	54.7	-74.8	-168.5	174.2	-177.3	0	111.7
414	A	47.3	Very low	43.8	Very low	104 Å²	104	165.7 Å²	165.7	86%	0.86	85%	0.845	S	S	*	*				64.9	42.1	67.1	0	0	0	0	0	113.8
415	E	46.1	Very low	43.7	Very low	184 Å²	184	167.5 Å²	167.5	86%	0.86	85%	0.846	S	S	*	*			trans	-115.1	16.5	-177.1	-156.1	160.8	-118.6	0	0	113.5
416	Q	44	Very low	44	Very low	192 Å²	192	160.6 Å²	160.6	90%	0.897	83%	0.829	S	S	*	*	S	Bend	trans	-113.1	-11.4	-178.5	-72.7	-177.1	-22.8	0	0	115.1	A418	Q416-A418 VanDerWaalsContact C-N 3.31Å; Q416-A418 PolarHBondContact O-N 3.43Å
417	A	47.1	Very low	44.7	Very low	104 Å²	104	157.9 Å²	157.9	86%	0.86	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	4.1	-175.7	0	0	0	0	0	115.3
418	A	45.1	Very low	45.9	Very low	91 Å²	91	155.9 Å²	155.9	75%	0.752	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-4.6	-166.8	0	0	0	0	0	115.7	Q416	Q416-A418 VanDerWaalsContact C-N 3.31Å; Q416-A418 PolarHBondContact O-N 3.43Å
419	K	45	Very low	46.9	Very low	210 Å²	210	151 Å²	151	91%	0.913	77%	0.771	S	S	*	*	S	Bend	trans	-106.7	-2.3	-174.3	-74.5	-172.7	174.5	-179.9	0	116
420	E	44.9	Very low	47.7	Very low	149 Å²	149	145.3 Å²	145.3	70%	0.696	75%	0.747	S	S	*	*	S	Bend	trans	-96.6	12.1	-178	-146.7	-160.4	132.4	0	0	114.2	R424	E420-R424 IonicContact OE1-NH2 3.45Å
421	K	40	Very low	48.6	Very low	196 Å²	196	141.6 Å²	141.6	85%	0.852	72%	0.716	S	S	*	*	S	Bend	trans	-116.7	5.6	-167.4	-140.4	175.1	-177.8	177.8	0	117.4
422	E	40.3	Very low	50.2	Low	197 Å²	197	138.2 Å²	138.2	92%	0.921	70%	0.7	S	S	*	*	S	Bend	trans	-101.4	-14.4	171.4	-68.8	-157.1	116	0	0	114.3	R424	E422-R424 PolarHBondContact O-N 2.99Å
423	L	44	Very low	51.7	Low	172 Å²	172	135 Å²	135	90%	0.901	69%	0.688	S	S	*	*	S	Bend	trans	-94	35.5	-177	-156.5	74.3	0	0	0	114.1
424	R	41.5	Very low	53.7	Low	199 Å²	199	128.5 Å²	128.5	75%	0.751	67%	0.666	S	S	*	*			trans	-135.4	66.4	176.2	-66.5	-164.1	-168.4	-161.9	7.2	114.1	E420 E422 G426	E420-R424 IonicContact OE1-NH2 3.45Å; E422-R424 PolarHBondContact O-N 2.99Å; R424-G426 VanDerWaalsContact C-N 3.28Å; R424-G426 PolarHBondContact O-N 3.38Å
425	K	42.9	Very low	55.4	Low	208 Å²	208	123.8 Å²	123.8	90%	0.904	63%	0.627	S	S	*	*			trans	-84.1	79.9	144.2	-73.5	-176.7	178.8	177.3	0	107.7
426	G	54.2	Low	57.2	Low	56 Å²	56	116.5 Å²	116.5	58%	0.577	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-70.8	156.5	-178.5	0	0	0	0	0	112.8	R424	R424-G426 VanDerWaalsContact C-N 3.28Å; R424-G426 PolarHBondContact O-N 3.38Å
427	L	64.4	Low	59.3	Low	42 Å²	42	112.3 Å²	112.3	22%	0.22	57%	0.572	C	S	.	*	P	Polyproline II helix	trans	-77.6	169.2	164.4	-65.8	100.6	0	0	0	109.4	L658 E661 Y701 R704	L427-L658 WeakPolarHBondContact CD2-O 3.5Å; L427-E661 HydrophobicContact CB-CG 4.03Å; L427-Y701 HydrophobicContact CD2-CE2 4.34Å; L427-R704 VanDerWaalsContact CD1-NH1 3.27Å
428	Q	65.9	Low	61.2	Low	135 Å²	135	111.4 Å²	111.4	63%	0.631	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-96.9	133.3	-178.5	-64	-174.5	5.3	0	0	110.5	N430 N659 M660	Q428-N430 PolarHBondContact O-N 3.15Å; Q428-N659 PolarHBondContact N-O 3.45Å; Q428-M660 VanDerWaalsContact O-CA 3.25Å; Q428-M660 WeakPolarHBondContact O-CA 3.45Å; Q428-M660 VanDerWaalsContact O-CB 3.3Å; Q428-M660 WeakPolarHBondContact O-CB 3.3Å; Q428-M660 VanDerWaalsContact O-CG 3.23Å; Q428-M660 WeakPolarHBondContact O-CG 3.49Å
429	N	61.9	Low	63.2	Low	79 Å²	79	109.7 Å²	109.7	42%	0.422	52%	0.521	S	S	.	.	S	Bend	trans	-87.3	14.4	-178.6	-64.5	1.5	0	0	0	112.8	E661	N429-E661 PolarHBondContact ND2-OE2 2.75Å; N429-E661 WeakPolarHBondContact OD1-CB 3.42Å; N429-E661 VanDerWaalsContact OD1-CG 3.24Å; N429-E661 WeakPolarHBondContact OD1-CG 3.49Å; N429-E661 PolarHBondContact OD1-OE2 3.12Å
430	N	59.9	Low	65.3	Low	82 Å²	82	105.6 Å²	105.6	44%	0.439	50%	0.503	S	S	.	.	S	Bend	trans	-132.2	152	178.6	-78.3	-68.1	0	0	0	110.8	Q428 H583	Q428-N430 PolarHBondContact O-N 3.15Å; N430-H583 PolarHBondContact OD1-CE1 3Å; N430-H583 VanDerWaalsContact OD1-CE1 3.27Å
431	A	61.8	Low	67.4	Low	8 Å²	8	104.3 Å²	104.3	7%	0.066	50%	0.497	C	S	.	.			trans	-60.4	153.6	165.9	0	0	0	0	0	111.6	T435 M436 P582 H583	A431-T435 HydrophobicContact CB-CG2 4.34Å; A431-M436 HydrophobicContact CB-CG 3.75Å; A431-M436 HydrophobicContact CB-SD 3.74Å; A431-P582 WeakPolarHBondContact CB-O 3.44Å; A431-H583 HydrophobicContact CB-CB 4.04Å
432	E	73.1	Confident	69.8	Low	109 Å²	109	95.5 Å²	95.5	51%	0.509	46%	0.459	S	S	.	.			trans	-54.5	142.9	173.1	-161.7	-156.7	120.4	0	0	111.1	S434 T435 M436 R652	E432-S434 VanDerWaalsContact CD-OG 3.28Å; E432-S434 PolarHBondContact O-N 3.07Å; E432-S434 VanDerWaalsContact O-N 3.11Å; E432-S434 VanDerWaalsContact OE1-CB 3.28Å; E432-S434 WeakPolarHBondContact OE1-CB 3.39Å; E432-S434 PolarHBondContact OE1-OG 3.48Å; E432-T435 WeakPolarHBondContact O-CA 3.26Å; E432-T435 WeakPolarHBondContact O-CB 3.3Å; E432-T435 PolarHBondContact O-N 3.09Å; E432-M436 PolarHBondContact O-N 3.12Å; E432-R652 IonicContact OE2-NH2 3.05Å
433	E	77.4	Confident	72.2	Confident	133 Å²	133	87.6 Å²	87.6	62%	0.621	42%	0.422	S	S	*	.	H	α-helix	trans	-57.7	-32.2	-175.6	-158.9	-164.8	147.7	0	0	112.6	M436 K437	E433-M436 PolarHBondContact O-N 2.89Å; E433-K437 WeakPolarHBondContact O-CG 3.34Å; E433-K437 PolarHBondContact O-N 3.36Å; E433-K437 WeakPolarHBondContact OE1-CE 3.37Å; E433-K437 IonicContact OE1-NZ 3.47Å; E433-K437 PolarHBondContact OE1-NZ 2.97Å
434	S	81.8	Confident	74.4	Confident	49 Å²	49	84.2 Å²	84.2	34%	0.343	41%	0.405	S	S	.	.	H	α-helix	trans	-67.3	-39.7	174.3	77.5	0	0	0	0	112.6	E432 M436 K437 W438 R652	E432-S434 VanDerWaalsContact CD-OG 3.28Å; E432-S434 PolarHBondContact O-N 3.07Å; E432-S434 VanDerWaalsContact O-N 3.11Å; E432-S434 VanDerWaalsContact OE1-CB 3.28Å; E432-S434 WeakPolarHBondContact OE1-CB 3.39Å; E432-S434 PolarHBondContact OE1-OG 3.48Å; S434-M436 VanDerWaalsContact C-N 3.31Å; S434-M436 PolarHBondContact O-N 2.81Å; S434-K437 PolarHBondContact O-N 2.75Å; S434-W438 PolarHBondContact O-N 2.98Å; S434-R652 PolarHBondContact OG-NH2 3.28Å
435	T	83	Confident	76.6	Confident	5 Å²	5	77.5 Å²	77.5	3%	0.031	39%	0.389	C	S	.	.	H	α-helix	trans	-62.2	-41.4	173.3	-52.1	0	0	0	0	110.4	A431 E432 Y439 V581 R652 Q656	A431-T435 HydrophobicContact CB-CG2 4.34Å; E432-T435 WeakPolarHBondContact O-CA 3.26Å; E432-T435 WeakPolarHBondContact O-CB 3.3Å; E432-T435 PolarHBondContact O-N 3.09Å; T435-Y439 WeakPolarHBondContact O-CB 3.27Å; T435-Y439 PolarHBondContact O-N 3.1Å; T435-V581 HydrophobicContact CG2-CG1 3.73Å; T435-R652 PolarHBondContact OG1-NE 2.87Å; T435-R652 PolarHBondContact OG1-NH2 3.12Å; T435-Q656 PolarHBondContact OG1-OE1 3.05Å
436	M	83.4	Confident	78.8	Confident	31 Å²	31	68.1 Å²	68.1	15%	0.153	35%	0.35	C	S	.	.	H	α-helix	trans	-73.2	-26.4	-178	-70.2	-56.6	-69.6	0	0	114.4	A431 E432 E433 S434 Y439 K440 H583	A431-M436 HydrophobicContact CB-CG 3.75Å; A431-M436 HydrophobicContact CB-SD 3.74Å; E432-M436 PolarHBondContact O-N 3.12Å; E433-M436 PolarHBondContact O-N 2.89Å; S434-M436 VanDerWaalsContact C-N 3.31Å; S434-M436 PolarHBondContact O-N 2.81Å; M436-Y439 HydrophobicContact CE-CD1 4.28Å; M436-K440 WeakPolarHBondContact O-CD 3.39Å; M436-K440 VanDerWaalsContact O-CG 3.27Å; M436-K440 WeakPolarHBondContact O-CG 3.29Å; M436-K440 PolarHBondContact O-N 3.15Å; M436-H583 VanDerWaalsContact CE-CD2 3.45Å; M436-H583 WeakPolarHBondContact CE-CD2 3.31Å; M436-H583 WeakPolarHBondContact CE-NE2 3.47Å; M436-H583 HydrophobicContact SD-CB 4.08Å
437	K	87.4	Confident	80.5	Confident	103 Å²	103	67.6 Å²	67.6	45%	0.448	34%	0.34	S	S	.	.	H	α-helix	trans	-69.7	-53.6	170.5	-74.7	169.5	-176.8	166.6	0	110.6	E433 S434 Y439 K440 E441	E433-K437 WeakPolarHBondContact O-CG 3.34Å; E433-K437 PolarHBondContact O-N 3.36Å; E433-K437 WeakPolarHBondContact OE1-CE 3.37Å; E433-K437 IonicContact OE1-NZ 3.47Å; E433-K437 PolarHBondContact OE1-NZ 2.97Å; S434-K437 PolarHBondContact O-N 2.75Å; K437-Y439 VanDerWaalsContact C-N 3.33Å; K437-Y439 PolarHBondContact O-N 2.96Å; K437-K440 WeakPolarHBondContact O-CB 3.5Å; K437-K440 PolarHBondContact O-N 3.4Å; K437-E441 WeakPolarHBondContact O-CG 3.09Å; K437-E441 PolarHBondContact O-N 2.79Å
438	W	87.3	Confident	81.7	Confident	85 Å²	85	71.6 Å²	71.6	32%	0.322	36%	0.358	S	S	.	.	H	α-helix	trans	-55.2	-43.9	176.4	175.4	62.5	0	0	0	113	S434 K440 E441 L442 L570 H574	S434-W438 PolarHBondContact O-N 2.98Å; W438-K440 PolarHBondContact O-N 3.1Å; W438-E441 PolarHBondContact O-N 3.47Å; W438-L442 VanDerWaalsContact O-CB 3.28Å; W438-L442 WeakPolarHBondContact O-CB 3.38Å; W438-L442 PolarHBondContact O-N 3.45Å; W438-L570 HydrophobicContact CH2-CD1 3.97Å; W438-L570 HydrophobicContact CZ2-CD1 3.72Å; W438-H574 AromaticContact CH2-CE1 3.59Å; W438-H574 AromaticContact CZ3-CE1 3.69Å
439	Y	87.3	Confident	82.8	Confident	56 Å²	56	65.6 Å²	65.6	22%	0.22	33%	0.331	C	S	.	.	H	α-helix	trans	-58.6	-43.5	174.6	167.6	-107.2	0	0	0	112.7	T435 M436 K437 L442 Q443 H574 V581	T435-Y439 WeakPolarHBondContact O-CB 3.27Å; T435-Y439 PolarHBondContact O-N 3.1Å; M436-Y439 HydrophobicContact CE-CD1 4.28Å; K437-Y439 VanDerWaalsContact C-N 3.33Å; K437-Y439 PolarHBondContact O-N 2.96Å; Y439-L442 PolarHBondContact O-N 3Å; Y439-Q443 HydrophobicContact CD2-CG 4.06Å; Y439-Q443 HydrophobicContact CE1-CG 4.25Å; Y439-Q443 HydrophobicContact CE2-CG 3.54Å; Y439-Q443 WeakPolarHBondContact O-CG 3.38Å; Y439-Q443 PolarHBondContact O-N 3.26Å; Y439-H574 HydrophobicContact CD2-CB 3.91Å; Y439-H574 HydrophobicContact CE2-CB 3.75Å; Y439-V581 HydrophobicContact CD2-CG1 4.26Å; Y439-V581 HydrophobicContact CD2-CG2 3.89Å; Y439-V581 HydrophobicContact CE2-CG2 4.34Å; Y439-V581 HydrophobicContact CG-CG1 4.21Å
440	K	88	Confident	84	Confident	123 Å²	123	63.2 Å²	63.2	54%	0.535	32%	0.321	S	S	.	.	H	α-helix	trans	-67.5	-43.8	178.5	-72.7	170.1	-176.8	177.5	0	111.9	M436 K437 W438 L442 Q443 N444	M436-K440 WeakPolarHBondContact O-CD 3.39Å; M436-K440 VanDerWaalsContact O-CG 3.27Å; M436-K440 WeakPolarHBondContact O-CG 3.29Å; M436-K440 PolarHBondContact O-N 3.15Å; K437-K440 WeakPolarHBondContact O-CB 3.5Å; K437-K440 PolarHBondContact O-N 3.4Å; W438-K440 PolarHBondContact O-N 3.1Å; K440-L442 VanDerWaalsContact C-N 3.3Å; K440-L442 PolarHBondContact O-N 2.85Å; K440-Q443 PolarHBondContact O-N 3.14Å; K440-N444 WeakPolarHBondContact O-CB 3.03Å; K440-N444 PolarHBondContact O-N 3.49Å; K440-N444 PolarHBondContact O-ND2 3.26Å; K440-N444 PolarHBondContact O-OD1 3.04Å
441	E	89.9	Confident	85.3	Confident	122 Å²	122	65.4 Å²	65.4	57%	0.57	33%	0.329	S	S	*	.	H	α-helix	trans	-56.9	-45.5	175.8	-71	154.5	-162.8	0	0	111.1	K437 W438 N444 S445	K437-E441 WeakPolarHBondContact O-CG 3.09Å; K437-E441 PolarHBondContact O-N 2.79Å; W438-E441 PolarHBondContact O-N 3.47Å; E441-N444 PolarHBondContact O-N 3.46Å; E441-S445 PolarHBondContact O-N 3.43Å
442	L	90.2	Very high	86.5	Confident	11 Å²	11	67 Å²	67	6%	0.058	34%	0.34	C	S	.	.	H	α-helix	trans	-64.8	-45.1	177.7	-170.3	78	0	0	0	113.1	W438 Y439 K440 N444 S445 A446 D567 L570 A571 H574	W438-L442 VanDerWaalsContact O-CB 3.28Å; W438-L442 WeakPolarHBondContact O-CB 3.38Å; W438-L442 PolarHBondContact O-N 3.45Å; Y439-L442 PolarHBondContact O-N 3Å; K440-L442 VanDerWaalsContact C-N 3.3Å; K440-L442 PolarHBondContact O-N 2.85Å; L442-N444 VanDerWaalsContact C-N 3.33Å; L442-N444 PolarHBondContact O-N 2.8Å; L442-S445 PolarHBondContact O-N 3.26Å; L442-A446 PolarHBondContact O-N 3.17Å; L442-D567 HydrophobicContact CD1-CB 3.94Å; L442-D567 WeakPolarHBondContact CD1-O 3.36Å; L442-L570 HydrophobicContact CD1-CB 4.45Å; L442-L570 HydrophobicContact CD2-CB 3.63Å; L442-A571 HydrophobicContact CD2-CB 4.4Å; L442-A571 HydrophobicContact CG-CB 4.08Å; L442-H574 VanDerWaalsContact CD2-ND1 3.3Å; L442-H574 WeakPolarHBondContact CD2-ND1 3.35Å
443	Q	90.8	Very high	87.1	Confident	31 Å²	31	62 Å²	62	15%	0.145	32%	0.316	C	S	.	.	H	α-helix	trans	-64.1	-38.3	174.8	-69.9	-59.1	-49.2	0	0	111.9	Y439 K440 A446 A447 A571	Y439-Q443 HydrophobicContact CD2-CG 4.06Å; Y439-Q443 HydrophobicContact CE1-CG 4.25Å; Y439-Q443 HydrophobicContact CE2-CG 3.54Å; Y439-Q443 WeakPolarHBondContact O-CG 3.38Å; Y439-Q443 PolarHBondContact O-N 3.26Å; K440-Q443 PolarHBondContact O-N 3.14Å; Q443-A446 PolarHBondContact O-N 3.21Å; Q443-A447 WeakPolarHBondContact O-CB 3.48Å; Q443-A447 PolarHBondContact O-N 3.35Å; Q443-A571 PolarHBondContact NE2-O 2.7Å
444	N	90.7	Very high	87.3	Confident	101 Å²	101	61.2 Å²	61.2	54%	0.54	31%	0.313	S	S	.	.	H	α-helix	trans	-65.3	-43	176.4	-70.3	-15.2	0	0	0	111.5	K440 E441 L442 A447 Q448	K440-N444 WeakPolarHBondContact O-CB 3.03Å; K440-N444 PolarHBondContact O-N 3.49Å; K440-N444 PolarHBondContact O-ND2 3.26Å; K440-N444 PolarHBondContact O-OD1 3.04Å; E441-N444 PolarHBondContact O-N 3.46Å; L442-N444 VanDerWaalsContact C-N 3.33Å; L442-N444 PolarHBondContact O-N 2.8Å; N444-A447 PolarHBondContact O-N 2.99Å; N444-Q448 WeakPolarHBondContact O-CG 3.27Å; N444-Q448 PolarHBondContact O-N 3.27Å
445	S	88	Confident	87	Confident	59 Å²	59	65.5 Å²	65.5	41%	0.413	33%	0.327	S	S	.	.	H	α-helix	trans	-60.8	-44.6	175.5	-177.9	0	0	0	0	111.9	E441 L442 A447 Q448 C449	E441-S445 PolarHBondContact O-N 3.43Å; L442-S445 PolarHBondContact O-N 3.26Å; S445-A447 VanDerWaalsContact C-N 3.34Å; S445-A447 PolarHBondContact O-N 3.4Å; S445-Q448 PolarHBondContact O-N 3.06Å; S445-C449 PolarHBondContact O-N 2.93Å
446	A	88.5	Confident	86.8	Confident	10 Å²	10	65.3 Å²	65.3	8%	0.083	33%	0.326	C	S	.	.	H	α-helix	trans	-66.9	-32.8	175.7	0	0	0	0	0	113.3	L442 Q443 A450 L568 A571	L442-A446 PolarHBondContact O-N 3.17Å; Q443-A446 PolarHBondContact O-N 3.21Å; A446-A450 WeakPolarHBondContact O-CB 3.4Å; A446-A450 PolarHBondContact O-N 3.17Å; A446-L568 HydrophobicContact CB-CD2 3.87Å; A446-A571 HydrophobicContact CB-CB 3.4Å
447	A	90.1	Very high	86.5	Confident	45 Å²	45	67.3 Å²	67.3	37%	0.372	34%	0.338	S	S	.	.	H	α-helix	trans	-68.7	-40.1	173	0	0	0	0	0	112.3	Q443 N444 S445 A450 Q451	Q443-A447 WeakPolarHBondContact O-CB 3.48Å; Q443-A447 PolarHBondContact O-N 3.35Å; N444-A447 PolarHBondContact O-N 2.99Å; S445-A447 VanDerWaalsContact C-N 3.34Å; S445-A447 PolarHBondContact O-N 3.4Å; A447-A450 PolarHBondContact O-N 2.95Å; A447-Q451 WeakPolarHBondContact O-CG 3.39Å; A447-Q451 PolarHBondContact O-N 3.33Å; A447-Q451 VanDerWaalsContact O-N 3.08Å
448	Q	90.1	Very high	86	Confident	127 Å²	127	66.1 Å²	66.1	59%	0.593	34%	0.342	S	S	*	.	H	α-helix	trans	-62.7	-43.1	173	-72.4	168.5	-7.6	0	0	111.2	N444 S445 A450 Q451 S452	N444-Q448 WeakPolarHBondContact O-CG 3.27Å; N444-Q448 PolarHBondContact O-N 3.27Å; S445-Q448 PolarHBondContact O-N 3.06Å; Q448-A450 PolarHBondContact O-N 2.95Å; Q448-Q451 PolarHBondContact O-N 3.23Å; Q448-S452 PolarHBondContact O-N 3.3Å
449	C	87.6	Confident	85.5	Confident	9 Å²	9	63 Å²	63	6%	0.061	33%	0.332	C	S	.	.	H	α-helix	trans	-62.1	-40.6	173	-176.9	0	0	0	0	112.2	S445 Q451 S452 F453 L568	S445-C449 PolarHBondContact O-N 2.93Å; C449-Q451 PolarHBondContact O-N 3.46Å; C449-S452 PolarHBondContact O-N 3.35Å; C449-S452 PolarHBondContact O-OG 3.33Å; C449-F453 WeakPolarHBondContact O-CD1 3.29Å; C449-F453 WeakPolarHBondContact O-CE1 3.49Å; C449-L568 HydrophobicContact CB-CD2 4.1Å
450	A	87.9	Confident	84.8	Confident	28 Å²	28	69.1 Å²	69.1	23%	0.231	36%	0.36	C	S	.	.	H	α-helix	trans	-63.2	-29.7	175.4	0	0	0	0	0	113.4	A446 A447 Q448 F453 Y527	A446-A450 WeakPolarHBondContact O-CB 3.4Å; A446-A450 PolarHBondContact O-N 3.17Å; A447-A450 PolarHBondContact O-N 2.95Å; Q448-A450 PolarHBondContact O-N 2.95Å; A450-F453 HydrophobicContact CB-CZ 4.49Å; A450-Y527 HydrophobicContact CB-CE2 3.85Å
451	Q	88.2	Confident	84.5	Confident	129 Å²	129	68.2 Å²	68.2	60%	0.603	36%	0.361	S	S	*	.	H	α-helix	trans	-80.5	-36.3	175	-69.8	167.5	-2.8	0	0	112.3	A447 Q448 C449 F453 E454	A447-Q451 WeakPolarHBondContact O-CG 3.39Å; A447-Q451 PolarHBondContact O-N 3.33Å; A447-Q451 VanDerWaalsContact O-N 3.08Å; Q448-Q451 PolarHBondContact O-N 3.23Å; C449-Q451 PolarHBondContact O-N 3.46Å; Q451-F453 PolarHBondContact O-N 2.95Å; Q451-E454 WeakPolarHBondContact O-CA 3.32Å; Q451-E454 PolarHBondContact O-N 3.37Å
452	S	86.3	Confident	84.1	Confident	41 Å²	41	66.1 Å²	66.1	29%	0.287	37%	0.365	S	S	.	.	H	α-helix	trans	-64.2	-25.2	-176.1	71.8	0	0	0	0	113.3	Q448 C449 Q520 E523	Q448-S452 PolarHBondContact O-N 3.3Å; C449-S452 PolarHBondContact O-N 3.35Å; C449-S452 PolarHBondContact O-OG 3.33Å; S452-Q520 WeakPolarHBondContact O-CG 3.5Å; S452-Q520 PolarHBondContact O-NE2 3.5Å; S452-E523 VanDerWaalsContact CB-OE2 3.22Å; S452-E523 WeakPolarHBondContact CB-OE2 3.4Å; S452-E523 VanDerWaalsContact OG-CD 3.24Å; S452-E523 PolarHBondContact OG-OE2 3.46Å
453	F	85.7	Confident	83.8	Confident	3 Å²	3	72.2 Å²	72.2	1%	0.013	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	18.9	169.3	65	-104.2	0	0	0	115.6	C449 A450 Q451 Q455 L456 N457 Q520 E523 F524 Y527	C449-F453 WeakPolarHBondContact O-CD1 3.29Å; C449-F453 WeakPolarHBondContact O-CE1 3.49Å; A450-F453 HydrophobicContact CB-CZ 4.49Å; Q451-F453 PolarHBondContact O-N 2.95Å; F453-Q455 VanDerWaalsContact C-N 3.31Å; F453-Q455 PolarHBondContact O-N 2.92Å; F453-Q455 VanDerWaalsContact O-N 3.13Å; F453-L456 PolarHBondContact O-N 3.41Å; F453-L456 VanDerWaalsContact O-N 3.13Å; F453-N457 HydrophobicContact CD2-CB 4.12Å; F453-N457 HydrophobicContact CE2-CB 4.42Å; F453-N457 PolarHBondContact O-N 3.09Å; F453-Q520 HydrophobicContact CB-CB 3.9Å; F453-E523 HydrophobicContact CD1-CB 4.36Å; F453-F524 HydrophobicContact CB-CB 4.12Å; F453-F524 HydrophobicContact CD1-CB 4.25Å; F453-F524 HydrophobicContact CD2-CB 4.39Å; F453-F524 AromaticContact CD2-CD2 3.73Å; F453-F524 HydrophobicContact CD2-CD2 3.73Å; F453-F524 AromaticContact CE2-CD2 3.9Å; F453-F524 HydrophobicContact CE2-CD2 3.9Å; F453-F524 HydrophobicContact CG-CB 4.01Å; F453-F524 HydrophobicContact CG-CD2 4.21Å; F453-F524 HydrophobicContact CZ-CD2 4.5Å; F453-Y527 HydrophobicContact CE1-CD1 4.19Å; F453-Y527 AromaticContact CE1-CD2 3.77Å; F453-Y527 HydrophobicContact CE1-CD2 3.77Å; F453-Y527 HydrophobicContact CE1-CE2 4.5Å; F453-Y527 AromaticContact CE1-CG 3.58Å; F453-Y527 HydrophobicContact CE1-CG 3.58Å; F453-Y527 AromaticContact CZ-CD1 3.66Å; F453-Y527 HydrophobicContact CZ-CD1 3.66Å; F453-Y527 AromaticContact CZ-CD2 3.87Å; F453-Y527 HydrophobicContact CZ-CD2 3.87Å; F453-Y527 HydrophobicContact CZ-CE1 4.08Å; F453-Y527 HydrophobicContact CZ-CE2 4.28Å; F453-Y527 AromaticContact CZ-CG 3.54Å; F453-Y527 HydrophobicContact CZ-CG 3.54Å
454	E	81.4	Confident	83.5	Confident	117 Å²	117	72.2 Å²	72.2	55%	0.547	40%	0.395	S	S	.	.	H	α-helix	trans	-24.2	-62.9	166.6	170.2	-115.6	-112	0	0	114.6	Q451 N457 S458	Q451-E454 WeakPolarHBondContact O-CA 3.32Å; Q451-E454 PolarHBondContact O-N 3.37Å; E454-N457 HydrophobicContact CB-CB 4.25Å; E454-N457 WeakPolarHBondContact O-CB 3.4Å; E454-N457 PolarHBondContact O-N 3.07Å; E454-N457 VanDerWaalsContact O-N 3.1Å; E454-S458 PolarHBondContact O-N 3.38Å; E454-S458 PolarHBondContact O-OG 3.48Å
455	Q	75.8	Confident	83.3	Confident	140 Å²	140	72.6 Å²	72.6	65%	0.654	39%	0.392	S	S	*	.	H	α-helix	trans	-71.3	-37.3	-169.4	-53.4	171.8	1.9	0	0	112.1	F453 N457 S458 P459	F453-Q455 VanDerWaalsContact C-N 3.31Å; F453-Q455 PolarHBondContact O-N 2.92Å; F453-Q455 VanDerWaalsContact O-N 3.13Å; Q455-N457 VanDerWaalsContact C-N 3.3Å; Q455-S458 CarbonylContact O-C 3.6Å; Q455-P459 WeakPolarHBondContact O-CA 3.3Å
456	L	78.9	Confident	83.3	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-72.4	-24.1	171.9	-172.9	59.3	0	0	0	112.1	F453 P459 T464 K468 L471 Q520 F524	F453-L456 PolarHBondContact O-N 3.41Å; F453-L456 VanDerWaalsContact O-N 3.13Å; L456-P459 WeakPolarHBondContact O-CD 3.32Å; L456-T464 HydrophobicContact CD1-CG2 3.86Å; L456-K468 HydrophobicContact CD1-CB 4.06Å; L456-K468 HydrophobicContact CD1-CG 4.5Å; L456-K468 HydrophobicContact CG-CG 4.5Å; L456-K468 WeakPolarHBondContact O-CD 3.32Å; L456-K468 WeakPolarHBondContact O-CE 3.36Å; L456-L471 HydrophobicContact CD2-CD1 4.35Å; L456-Q520 HydrophobicContact CB-CB 4.39Å; L456-F524 HydrophobicContact CD2-CB 3.69Å; L456-F524 HydrophobicContact CD2-CD1 3.89Å; L456-F524 HydrophobicContact CD2-CD2 4.41Å; L456-F524 HydrophobicContact CD2-CG 3.74Å; L456-F524 HydrophobicContact CG-CG 4.41Å
457	N	76.3	Confident	83.2	Confident	74 Å²	74	75.5 Å²	75.5	40%	0.396	40%	0.397	S	S	.	.	H	α-helix	trans	-79.5	-36.6	175.5	-153.8	12.9	0	0	0	112.6	F453 E454 Q455 P459 K468	F453-N457 HydrophobicContact CD2-CB 4.12Å; F453-N457 HydrophobicContact CE2-CB 4.42Å; F453-N457 PolarHBondContact O-N 3.09Å; E454-N457 HydrophobicContact CB-CB 4.25Å; E454-N457 WeakPolarHBondContact O-CB 3.4Å; E454-N457 PolarHBondContact O-N 3.07Å; E454-N457 VanDerWaalsContact O-N 3.1Å; Q455-N457 VanDerWaalsContact C-N 3.3Å; N457-P459 WeakPolarHBondContact O-CD 3.49Å; N457-K468 PolarHBondContact O-NZ 3.06Å; N457-K468 WeakPolarHBondContact OD1-CE 3.27Å; N457-K468 PolarHBondContact OD1-NZ 3.35Å
458	S	77.7	Confident	83.2	Confident	77 Å²	77	75.2 Å²	75.2	54%	0.538	39%	0.387	S	S	.	.	S	Bend	trans	-110.7	49.2	179.6	60.6	0	0	0	0	113.9	E454 Q455 K460	E454-S458 PolarHBondContact O-N 3.38Å; E454-S458 PolarHBondContact O-OG 3.48Å; Q455-S458 CarbonylContact O-C 3.6Å; S458-K460 PolarHBondContact O-N 2.99Å
459	P	75.3	Confident	83.2	Confident	19 Å²	19	73.4 Å²	73.4	12%	0.123	38%	0.381	C	S	.	.			trans	-64.6	132.6	-169.1	28.6	-36.7	0	0	0	111.8	Q455 L456 N457 T464 K465	Q455-P459 WeakPolarHBondContact O-CA 3.3Å; L456-P459 WeakPolarHBondContact O-CD 3.32Å; N457-P459 WeakPolarHBondContact O-CD 3.49Å; P459-T464 HydrophobicContact CB-CG2 3.76Å; P459-K465 HydrophobicContact CB-CG 4Å; P459-K465 HydrophobicContact CG-CB 4.42Å; P459-K465 HydrophobicContact CG-CG 3.5Å; P459-K465 WeakPolarHBondContact O-CE 3.46Å; P459-K465 PolarHBondContact O-NZ 3.26Å
460	K	72.6	Confident	83.3	Confident	186 Å²	186	74.9 Å²	74.9	81%	0.809	39%	0.387	S	S	*	.			trans	-76.5	-46.5	172.6	-62.8	179.9	-177.1	177.5	0	109.6	S458 K465	S458-K460 PolarHBondContact O-N 2.99Å; K460-K465 PolarHBondContact O-NZ 3.38Å
461	D	81.8	Confident	83.5	Confident	103 Å²	103	73.6 Å²	73.6	55%	0.551	38%	0.376	S	S	*	.	S	Bend	trans	-83.9	149.4	-169.5	-44	-75.8	0	0	0	115	Q463 T464 K465	D461-Q463 PolarHBondContact O-N 2.91Å; D461-T464 PolarHBondContact O-N 3.45Å; D461-K465 WeakPolarHBondContact O-CG 3.18Å; D461-K465 PolarHBondContact O-N 2.92Å
462	A	83.1	Confident	83.7	Confident	78 Å²	78	70.8 Å²	70.8	65%	0.645	36%	0.363	S	S	*	.	H	α-helix	trans	-66.9	-35.2	-179.8	0	0	0	0	0	113.5	K466	A462-K466 PolarHBondContact O-N 2.96Å; A462-K466 VanDerWaalsContact O-N 3.08Å
463	Q	83.3	Confident	84	Confident	140 Å²	140	73.6 Å²	73.6	65%	0.654	37%	0.37	S	S	*	.	H	α-helix	trans	-67.5	-43.6	176.7	-62.1	-63.3	-7.6	0	0	111.1	D461 K465 K466 L467	D461-Q463 PolarHBondContact O-N 2.91Å; Q463-K465 VanDerWaalsContact C-N 3.35Å; Q463-K465 PolarHBondContact O-N 2.99Å; Q463-K466 WeakPolarHBondContact O-CB 3.27Å; Q463-K466 PolarHBondContact O-N 2.68Å; Q463-L467 WeakPolarHBondContact O-CB 3.49Å; Q463-L467 PolarHBondContact O-N 2.98Å
464	T	83.8	Confident	84.3	Confident	30 Å²	30	73.7 Å²	73.7	18%	0.184	37%	0.371	C	S	.	.	H	α-helix	trans	-65.1	-37.7	177.6	-42.5	0	0	0	0	111.6	L456 P459 D461 L467 K468	L456-T464 HydrophobicContact CD1-CG2 3.86Å; P459-T464 HydrophobicContact CB-CG2 3.76Å; D461-T464 PolarHBondContact O-N 3.45Å; T464-L467 PolarHBondContact O-N 3.36Å; T464-K468 WeakPolarHBondContact O-CB 3.27Å; T464-K468 PolarHBondContact O-N 2.97Å
465	K	86.9	Confident	84.9	Confident	110 Å²	110	68.2 Å²	68.2	48%	0.478	35%	0.346	S	S	.	.	H	α-helix	trans	-58	-46.3	169.9	-76.6	165.1	178.2	150.9	0	112.6	P459 K460 D461 Q463 L469	P459-K465 HydrophobicContact CB-CG 4Å; P459-K465 HydrophobicContact CG-CB 4.42Å; P459-K465 HydrophobicContact CG-CG 3.5Å; P459-K465 WeakPolarHBondContact O-CE 3.46Å; P459-K465 PolarHBondContact O-NZ 3.26Å; K460-K465 PolarHBondContact O-NZ 3.38Å; D461-K465 WeakPolarHBondContact O-CG 3.18Å; D461-K465 PolarHBondContact O-N 2.92Å; Q463-K465 VanDerWaalsContact C-N 3.35Å; Q463-K465 PolarHBondContact O-N 2.99Å; K465-L469 PolarHBondContact O-N 2.7Å
466	K	87.4	Confident	85.7	Confident	100 Å²	100	63 Å²	63	44%	0.435	32%	0.323	S	S	.	.	H	α-helix	trans	-64.9	-47	177.5	177.3	-173.1	164.6	-161.7	0	111.5	A462 Q463 K468 L469 E470	A462-K466 PolarHBondContact O-N 2.96Å; A462-K466 VanDerWaalsContact O-N 3.08Å; Q463-K466 WeakPolarHBondContact O-CB 3.27Å; Q463-K466 PolarHBondContact O-N 2.68Å; K466-K468 PolarHBondContact O-N 3.43Å; K466-L469 PolarHBondContact O-N 3.47Å; K466-E470 WeakPolarHBondContact CE-OE1 3.34Å; K466-E470 WeakPolarHBondContact CE-OE2 3.5Å; K466-E470 WeakPolarHBondContact O-CG 3.25Å; K466-E470 PolarHBondContact O-N 3.43Å
467	L	86.9	Confident	86.4	Confident	30 Å²	30	66.1 Å²	66.1	16%	0.157	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-43.3	178.7	-179.2	58.5	0	0	0	111.8	Q463 T464 L469 E470 L471 Q517 H518	Q463-L467 WeakPolarHBondContact O-CB 3.49Å; Q463-L467 PolarHBondContact O-N 2.98Å; T464-L467 PolarHBondContact O-N 3.36Å; L467-L469 VanDerWaalsContact C-N 3.3Å; L467-L469 PolarHBondContact O-N 2.89Å; L467-E470 PolarHBondContact O-N 3.32Å; L467-L471 HydrophobicContact CD1-CD1 4.04Å; L467-L471 HydrophobicContact CD1-CG 3.98Å; L467-L471 HydrophobicContact CG-CD1 3.89Å; L467-L471 HydrophobicContact CG-CG 4.31Å; L467-L471 WeakPolarHBondContact O-CB 3.2Å; L467-L471 WeakPolarHBondContact O-CG 3.26Å; L467-L471 PolarHBondContact O-N 3.46Å; L467-Q517 HydrophobicContact CD1-CB 4.11Å; L467-Q517 HydrophobicContact CD2-CB 4.09Å; L467-H518 HydrophobicContact CD2-CB 3.99Å
468	K	89.9	Confident	87.3	Confident	39 Å²	39	62.8 Å²	62.8	17%	0.17	32%	0.322	C	S	.	.	H	α-helix	trans	-52.5	-47.4	172.6	-172.5	-165.2	-169.9	179.3	0	111.6	L456 N457 T464 K466 Q472 F524	L456-K468 HydrophobicContact CD1-CB 4.06Å; L456-K468 HydrophobicContact CD1-CG 4.5Å; L456-K468 HydrophobicContact CG-CG 4.5Å; L456-K468 WeakPolarHBondContact O-CD 3.32Å; L456-K468 WeakPolarHBondContact O-CE 3.36Å; N457-K468 PolarHBondContact O-NZ 3.06Å; N457-K468 WeakPolarHBondContact OD1-CE 3.27Å; N457-K468 PolarHBondContact OD1-NZ 3.35Å; T464-K468 WeakPolarHBondContact O-CB 3.27Å; T464-K468 PolarHBondContact O-N 2.97Å; K466-K468 PolarHBondContact O-N 3.43Å; K468-Q472 VanDerWaalsContact O-CB 3.27Å; K468-Q472 WeakPolarHBondContact O-CB 3.19Å; K468-Q472 PolarHBondContact O-N 3.44Å; K468-F524 HydrophobicContact CD-CZ 4.46Å; K468-F524 HydrophobicContact CG-CE1 4.08Å; K468-F524 HydrophobicContact CG-CE2 4.16Å; K468-F524 HydrophobicContact CG-CZ 3.58Å
469	L	90.1	Very high	88.1	Confident	89 Å²	89	59.1 Å²	59.1	47%	0.466	30%	0.297	S	S	.	.	H	α-helix	trans	-69.2	-39.2	-179.6	-176.8	62.8	0	0	0	112.5	K465 K466 L467 K473	K465-L469 PolarHBondContact O-N 2.7Å; K466-L469 PolarHBondContact O-N 3.47Å; L467-L469 VanDerWaalsContact C-N 3.3Å; L467-L469 PolarHBondContact O-N 2.89Å; L469-K473 HydrophobicContact CG-CD 4.4Å; L469-K473 WeakPolarHBondContact O-CB 3.46Å; L469-K473 VanDerWaalsContact O-CG 3.29Å; L469-K473 WeakPolarHBondContact O-CG 3.17Å; L469-K473 PolarHBondContact O-N 2.94Å
470	E	90.3	Very high	88.9	Confident	40 Å²	40	61.2 Å²	61.2	19%	0.187	31%	0.312	C	S	.	.	H	α-helix	trans	-70.4	-39.2	179	-71.3	177.7	163.7	0	0	111.3	K466 L467 A474 K511 V513	K466-E470 WeakPolarHBondContact CE-OE1 3.34Å; K466-E470 WeakPolarHBondContact CE-OE2 3.5Å; K466-E470 WeakPolarHBondContact O-CG 3.25Å; K466-E470 PolarHBondContact O-N 3.43Å; L467-E470 PolarHBondContact O-N 3.32Å; E470-A474 WeakPolarHBondContact O-CB 3.43Å; E470-A474 PolarHBondContact O-N 3.4Å; E470-K511 WeakPolarHBondContact OE1-CD 3.36Å; E470-K511 IonicContact OE1-NZ 2.79Å; E470-K511 PolarHBondContact OE1-NZ 3.43Å; E470-V513 HydrophobicContact CB-CG2 4.16Å
471	L	91.2	Very high	89.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.7	-48.2	170.1	-73.5	170.8	0	0	0	112.5	L456 L467 K473 A474 A475 V513 A515 F524 V525	L456-L471 HydrophobicContact CD2-CD1 4.35Å; L467-L471 HydrophobicContact CD1-CD1 4.04Å; L467-L471 HydrophobicContact CD1-CG 3.98Å; L467-L471 HydrophobicContact CG-CD1 3.89Å; L467-L471 HydrophobicContact CG-CG 4.31Å; L467-L471 WeakPolarHBondContact O-CB 3.2Å; L467-L471 WeakPolarHBondContact O-CG 3.26Å; L467-L471 PolarHBondContact O-N 3.46Å; L471-K473 VanDerWaalsContact C-N 3.28Å; L471-K473 PolarHBondContact O-N 2.96Å; L471-A474 PolarHBondContact O-N 2.91Å; L471-A474 VanDerWaalsContact O-N 3.15Å; L471-A475 PolarHBondContact O-N 3.16Å; L471-V513 HydrophobicContact CD2-CG1 3.78Å; L471-V513 HydrophobicContact CG-CG1 4.24Å; L471-A515 HydrophobicContact CD2-CB 4.45Å; L471-F524 HydrophobicContact CB-CD1 4.28Å; L471-F524 HydrophobicContact CB-CE1 4.15Å; L471-V525 HydrophobicContact CB-CG2 4.29Å; L471-V525 HydrophobicContact CD2-CG2 4.07Å
472	Q	93.1	Very high	90.4	Very high	71 Å²	71	52.4 Å²	52.4	33%	0.332	27%	0.27	S	S	.	.	H	α-helix	trans	-61.1	-38.8	178.8	-176.2	176.5	-19.5	0	0	111.4	K468 T476 F524 K528	K468-Q472 VanDerWaalsContact O-CB 3.27Å; K468-Q472 WeakPolarHBondContact O-CB 3.19Å; K468-Q472 PolarHBondContact O-N 3.44Å; Q472-T476 HydrophobicContact CG-CG2 4.35Å; Q472-T476 WeakPolarHBondContact O-CB 3.47Å; Q472-T476 WeakPolarHBondContact O-CG2 3.23Å; Q472-T476 PolarHBondContact O-N 3.33Å; Q472-T476 PolarHBondContact O-OG1 3.01Å; Q472-F524 HydrophobicContact CB-CE1 4.1Å; Q472-F524 HydrophobicContact CB-CZ 4.13Å; Q472-K528 HydrophobicContact CG-CD 4.4Å
473	K	92.7	Very high	90.5	Very high	100 Å²	100	50.1 Å²	50.1	44%	0.435	25%	0.25	S	S	.	.	H	α-helix	trans	-64.8	-46.5	172.6	-77.4	176.7	178	-176.1	0	111.9	L469 L471 A475 T476 I477	L469-K473 HydrophobicContact CG-CD 4.4Å; L469-K473 WeakPolarHBondContact O-CB 3.46Å; L469-K473 VanDerWaalsContact O-CG 3.29Å; L469-K473 WeakPolarHBondContact O-CG 3.17Å; L469-K473 PolarHBondContact O-N 2.94Å; L471-K473 VanDerWaalsContact C-N 3.28Å; L471-K473 PolarHBondContact O-N 2.96Å; K473-A475 VanDerWaalsContact C-N 3.28Å; K473-A475 PolarHBondContact O-N 3.44Å; K473-T476 PolarHBondContact O-N 3.13Å; K473-I477 HydrophobicContact CB-CD1 3.82Å; K473-I477 HydrophobicContact CB-CG1 4.48Å; K473-I477 HydrophobicContact CG-CD1 4.16Å; K473-I477 VanDerWaalsContact O-CB 3.3Å; K473-I477 WeakPolarHBondContact O-CB 3.5Å; K473-I477 VanDerWaalsContact O-CG1 3.26Å; K473-I477 WeakPolarHBondContact O-CG1 3.2Å; K473-I477 PolarHBondContact O-N 2.81Å
474	A	91.9	Very high	90.5	Very high	4 Å²	4	46.8 Å²	46.8	3%	0.033	24%	0.239	C	C	.	.	H	α-helix	trans	-59.1	-36.2	177.4	0	0	0	0	0	113	E470 L471 P478 L500 V506 S508 V513	E470-A474 WeakPolarHBondContact O-CB 3.43Å; E470-A474 PolarHBondContact O-N 3.4Å; L471-A474 PolarHBondContact O-N 2.91Å; L471-A474 VanDerWaalsContact O-N 3.15Å; A474-P478 WeakPolarHBondContact O-CD 3.24Å; A474-P478 VanDerWaalsContact O-CG 3.26Å; A474-P478 WeakPolarHBondContact O-CG 3.33Å; A474-L500 HydrophobicContact CB-CD1 4.36Å; A474-L500 HydrophobicContact CB-CD2 3.86Å; A474-V506 HydrophobicContact CB-CG2 4.28Å; A474-S508 PolarHBondContact N-OG 3.46Å; A474-V513 HydrophobicContact CB-CG1 4.47Å
475	A	93	Very high	90.4	Very high	2 Å²	2	51 Å²	51	2%	0.017	26%	0.26	C	S	.	.	H	α-helix	trans	-76.5	-43.3	176.5	0	0	0	0	0	113.4	L471 K473 L500 V525 L529	L471-A475 PolarHBondContact O-N 3.16Å; K473-A475 VanDerWaalsContact C-N 3.28Å; K473-A475 PolarHBondContact O-N 3.44Å; A475-L500 HydrophobicContact CB-CD2 4.24Å; A475-V525 HydrophobicContact CB-CG1 4.13Å; A475-L529 WeakPolarHBondContact O-CD1 3.44Å
476	T	93.6	Very high	90.4	Very high	30 Å²	30	46.5 Å²	46.5	18%	0.184	24%	0.243	C	C	.	.	H	α-helix	trans	-93.7	-23.6	-167.2	59.8	0	0	0	0	115.1	Q472 K473 S480 K532	Q472-T476 HydrophobicContact CG-CG2 4.35Å; Q472-T476 WeakPolarHBondContact O-CB 3.47Å; Q472-T476 WeakPolarHBondContact O-CG2 3.23Å; Q472-T476 PolarHBondContact O-N 3.33Å; Q472-T476 PolarHBondContact O-OG1 3.01Å; K473-T476 PolarHBondContact O-N 3.13Å; T476-S480 PolarHBondContact O-N 3.39Å; T476-S480 PolarHBondContact O-OG 3.17Å; T476-K532 HydrophobicContact CG2-CB 3.92Å; T476-K532 HydrophobicContact CG2-CG 4.17Å
477	I	93.8	Very high	90.5	Very high	66 Å²	66	41.8 Å²	41.8	34%	0.338	22%	0.222	S	C	.	.	H	α-helix	trans	-69.3	-45.2	178	-66.1	172	0	0	0	112	K473 V479 S480 Q481	K473-I477 HydrophobicContact CB-CD1 3.82Å; K473-I477 HydrophobicContact CB-CG1 4.48Å; K473-I477 HydrophobicContact CG-CD1 4.16Å; K473-I477 VanDerWaalsContact O-CB 3.3Å; K473-I477 WeakPolarHBondContact O-CB 3.5Å; K473-I477 VanDerWaalsContact O-CG1 3.26Å; K473-I477 WeakPolarHBondContact O-CG1 3.2Å; K473-I477 PolarHBondContact O-N 2.81Å; I477-V479 VanDerWaalsContact C-N 3.34Å; I477-V479 PolarHBondContact O-N 3.4Å; I477-S480 CarbonylContact O-C 3.36Å; I477-S480 VanDerWaalsContact O-CA 3.3Å; I477-S480 WeakPolarHBondContact O-CA 3.3Å; I477-S480 VanDerWaalsContact O-CB 3.29Å; I477-S480 WeakPolarHBondContact O-CB 3.27Å; I477-S480 PolarHBondContact O-N 3.14Å; I477-Q481 HydrophobicContact CG2-CG 4.33Å; I477-Q481 WeakPolarHBondContact O-CG 3.28Å; I477-Q481 PolarHBondContact O-N 3.05Å; I477-Q481 VanDerWaalsContact O-N 3.15Å
478	P	93.9	Very high	90.6	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.032	24%	0.239	C	C	.	.	H	α-helix	trans	-59.9	-41.5	-179.9	-24.9	35.6	0	0	0	112.8	A474 S480 Q481 I482 I493 I497	A474-P478 WeakPolarHBondContact O-CD 3.24Å; A474-P478 VanDerWaalsContact O-CG 3.26Å; A474-P478 WeakPolarHBondContact O-CG 3.33Å; P478-S480 PolarHBondContact O-N 3.24Å; P478-Q481 PolarHBondContact O-N 3.09Å; P478-I482 PolarHBondContact O-N 3.45Å; P478-I493 HydrophobicContact CB-CG2 4.02Å; P478-I493 WeakPolarHBondContact O-CG2 3.47Å; P478-I497 HydrophobicContact CB-CD1 4.11Å; P478-I497 HydrophobicContact CB-CG1 3.81Å; P478-I497 HydrophobicContact CG-CG1 4.46Å
479	V	95	Very high	90.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66	-18.4	173.9	-179	0	0	0	0	112.6	I477 I482 I497 L529 K532 F533 Q536	I477-V479 VanDerWaalsContact C-N 3.34Å; I477-V479 PolarHBondContact O-N 3.4Å; V479-I482 HydrophobicContact CB-CD1 4.5Å; V479-I482 HydrophobicContact CG1-CD1 4.29Å; V479-I497 HydrophobicContact CG2-CD1 3.76Å; V479-L529 HydrophobicContact CG2-CD1 3.47Å; V479-L529 VanDerWaalsContact CG2-CD1 3.47Å; V479-K532 HydrophobicContact CB-CG 4Å; V479-K532 HydrophobicContact CG1-CG 3.88Å; V479-F533 HydrophobicContact CG1-CD1 3.74Å; V479-F533 HydrophobicContact CG1-CE1 3.93Å; V479-F533 HydrophobicContact CG1-CG 4.28Å; V479-F533 HydrophobicContact CG2-CD1 4.36Å; V479-F533 HydrophobicContact CG2-CE1 3.89Å; V479-F533 HydrophobicContact CG2-CE2 4.22Å; V479-F533 HydrophobicContact CG2-CZ 3.81Å; V479-Q536 HydrophobicContact CG1-CG 3.8Å; V479-Q536 PolarHBondContact O-NE2 2.91Å
480	S	93.2	Very high	90.8	Very high	63 Å²	63	41.5 Å²	41.5	44%	0.441	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-4	171.3	-47.9	0	0	0	0	114	T476 I477 P478 K532	T476-S480 PolarHBondContact O-N 3.39Å; T476-S480 PolarHBondContact O-OG 3.17Å; I477-S480 CarbonylContact O-C 3.36Å; I477-S480 VanDerWaalsContact O-CA 3.3Å; I477-S480 WeakPolarHBondContact O-CA 3.3Å; I477-S480 VanDerWaalsContact O-CB 3.29Å; I477-S480 WeakPolarHBondContact O-CB 3.27Å; I477-S480 PolarHBondContact O-N 3.14Å; P478-S480 PolarHBondContact O-N 3.24Å; S480-K532 WeakPolarHBondContact OG-CE 3.2Å; S480-K532 PolarHBondContact OG-NZ 3.48Å
481	Q	92.6	Very high	90.9	Very high	82 Å²	82	45 Å²	45	38%	0.383	24%	0.238	S	C	.	.	S	Bend	trans	-104.4	-3.3	177.1	-69.2	178.5	-32.8	0	0	112.5	I477 P478 S483 I493	I477-Q481 HydrophobicContact CG2-CG 4.33Å; I477-Q481 WeakPolarHBondContact O-CG 3.28Å; I477-Q481 PolarHBondContact O-N 3.05Å; I477-Q481 VanDerWaalsContact O-N 3.15Å; P478-Q481 PolarHBondContact O-N 3.09Å; Q481-S483 PolarHBondContact O-N 2.92Å; Q481-I493 VanDerWaalsContact C-CD1 3.47Å; Q481-I493 HydrophobicContact CB-CD1 3.88Å; Q481-I493 HydrophobicContact CB-CG1 4.39Å; Q481-I493 VanDerWaalsContact O-CD1 3.24Å; Q481-I493 WeakPolarHBondContact O-CD1 3.29Å
482	I	92.9	Very high	91	Very high	21 Å²	21	49.8 Å²	49.8	11%	0.108	26%	0.26	C	S	.	.			trans	-62.8	123.8	175.7	-64.6	175.2	0	0	0	109.1	P478 V479 L490 I493 F533 P550 I551 V554	P478-I482 PolarHBondContact O-N 3.45Å; V479-I482 HydrophobicContact CB-CD1 4.5Å; V479-I482 HydrophobicContact CG1-CD1 4.29Å; I482-L490 HydrophobicContact CB-CD1 4.41Å; I482-L490 HydrophobicContact CG1-CD1 4.3Å; I482-L490 HydrophobicContact CG2-CD1 3.69Å; I482-I493 HydrophobicContact CG1-CD1 4.44Å; I482-I493 HydrophobicContact CG1-CG2 3.9Å; I482-F533 HydrophobicContact CD1-CE1 4.25Å; I482-P550 HydrophobicContact CG2-CB 3.76Å; I482-P550 HydrophobicContact CG2-CG 4.2Å; I482-I551 HydrophobicContact CB-CG1 4.15Å; I482-I551 HydrophobicContact CD1-CG1 4.42Å; I482-I551 HydrophobicContact CG2-CB 4.39Å; I482-I551 HydrophobicContact CG2-CG1 3.53Å; I482-V554 HydrophobicContact CD1-CB 4.19Å; I482-V554 HydrophobicContact CD1-CG1 4.11Å; I482-V554 HydrophobicContact CD1-CG2 4.36Å
483	S	84.5	Confident	91	Very high	31 Å²	31	46.5 Å²	46.5	22%	0.217	25%	0.245	C	C	.	.			trans	-138.8	168.9	179.3	73.9	0	0	0	0	111.6	Q481 N485	Q481-S483 PolarHBondContact O-N 2.92Å; S483-N485 VanDerWaalsContact C-N 3.3Å
484	T	83.4	Confident	91.1	Very high	69 Å²	69	42.1 Å²	42.1	42%	0.423	23%	0.226	S	C	.	.	S	Bend	trans	-84.3	4.2	178.1	44.6	0	0	0	0	114	P550 F744	T484-P550 HydrophobicContact CG2-CG 3.88Å; T484-F744 WeakPolarHBondContact O-CD2 3.47Å; T484-F744 WeakPolarHBondContact O-CE2 3.34Å
485	N	83.1	Confident	91.1	Very high	118 Å²	118	44.2 Å²	44.2	63%	0.631	24%	0.237	S	C	*	.	S	Bend	trans	-84.6	-36.9	-165	-63.2	-21	0	0	0	115.1	S483	S483-N485 VanDerWaalsContact C-N 3.3Å
486	S	86.1	Confident	91.2	Very high	17 Å²	17	46.9 Å²	46.9	12%	0.119	25%	0.247	C	C	.	.			trans	-153.4	132.9	-170.1	160.6	0	0	0	0	112	S488 Q489 L490 F744 S747	S486-S488 PolarHBondContact OG-N 3.18Å; S486-S488 PolarHBondContact OG-OG 2.73Å; S486-Q489 PolarHBondContact OG-N 2.67Å; S486-L490 WeakPolarHBondContact O-CB 3.38Å; S486-L490 PolarHBondContact O-N 3.45Å; S486-L490 VanDerWaalsContact O-N 3.14Å; S486-F744 VanDerWaalsContact C-CE2 3.45Å; S486-F744 WeakPolarHBondContact O-CZ 3.25Å; S486-S747 WeakPolarHBondContact CB-O 3.38Å; S486-S747 VanDerWaalsContact OG-C 3.31Å; S486-S747 PolarHBondContact OG-O 3.49Å
487	G	89.4	Confident	91.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-73.7	-32.7	173.9	0	0	0	0	0	112.7	L490 R491 F744 S747	G487-L490 PolarHBondContact O-N 2.9Å; G487-R491 WeakPolarHBondContact O-CB 3.49Å; G487-R491 PolarHBondContact O-N 2.87Å; G487-F744 WeakPolarHBondContact CA-O 3.49Å; G487-F744 PolarHBondContact N-O 3.29Å; G487-S747 WeakPolarHBondContact CA-OXT 3.44Å; G487-S747 PolarHBondContact N-OXT 3.39Å
488	S	88.8	Confident	91.3	Very high	71 Å²	71	44.2 Å²	44.2	50%	0.497	23%	0.232	S	C	.	.	H	α-helix	trans	-66.1	-41.9	175.2	69.9	0	0	0	0	111.8	S486 R491 E492 S747	S486-S488 PolarHBondContact OG-N 3.18Å; S486-S488 PolarHBondContact OG-OG 2.73Å; S488-R491 PolarHBondContact O-N 3.11Å; S488-E492 PolarHBondContact O-N 2.74Å; S488-S747 WeakPolarHBondContact CB-OXT 3.32Å; S488-S747 PolarHBondContact N-OXT 2.8Å; S488-S747 PolarHBondContact OG-O 3.35Å
489	Q	90.8	Very high	91.3	Very high	79 Å²	79	48.1 Å²	48.1	37%	0.369	25%	0.248	S	C	.	.	H	α-helix	trans	-64.1	-42.5	170.6	-170.7	-175.1	8.1	0	0	111.7	S486 R491 E492 I493	S486-Q489 PolarHBondContact OG-N 2.67Å; Q489-R491 VanDerWaalsContact C-N 3.26Å; Q489-R491 PolarHBondContact O-N 3.13Å; Q489-E492 PolarHBondContact O-N 2.94Å; Q489-E492 VanDerWaalsContact O-N 3.17Å; Q489-I493 HydrophobicContact CG-CD1 4.3Å; Q489-I493 WeakPolarHBondContact O-CG1 3.46Å; Q489-I493 PolarHBondContact O-N 2.55Å
490	L	93.6	Very high	91.2	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-60.9	-37.6	177.6	-168.4	68.4	0	0	0	111.8	I482 S486 G487 I493 F494 P550 V553 V554 W634 F744 W745	I482-L490 HydrophobicContact CB-CD1 4.41Å; I482-L490 HydrophobicContact CG1-CD1 4.3Å; I482-L490 HydrophobicContact CG2-CD1 3.69Å; S486-L490 WeakPolarHBondContact O-CB 3.38Å; S486-L490 PolarHBondContact O-N 3.45Å; S486-L490 VanDerWaalsContact O-N 3.14Å; G487-L490 PolarHBondContact O-N 2.9Å; L490-I493 PolarHBondContact O-N 3.38Å; L490-F494 PolarHBondContact O-N 3.42Å; L490-P550 HydrophobicContact CD1-CB 4.09Å; L490-P550 HydrophobicContact CD2-CB 4.16Å; L490-V553 HydrophobicContact CD2-CG1 3.75Å; L490-V554 HydrophobicContact CD1-CG2 3.51Å; L490-V554 HydrophobicContact CD2-CG2 4.17Å; L490-V554 HydrophobicContact CG-CG2 3.71Å; L490-W634 HydrophobicContact CD2-CZ3 4.27Å; L490-W634 HydrophobicContact CG-CH2 4.46Å; L490-W634 HydrophobicContact CG-CZ3 4.35Å; L490-F744 HydrophobicContact CB-CZ 4.16Å; L490-F744 HydrophobicContact CD2-CE1 3.87Å; L490-F744 HydrophobicContact CD2-CZ 3.8Å; L490-W745 HydrophobicContact CD2-CH2 3.9Å; L490-W745 HydrophobicContact CD2-CZ3 4.1Å
491	R	92.5	Very high	91.2	Very high	113 Å²	113	46.2 Å²	46.2	43%	0.426	23%	0.233	S	C	.	.	H	α-helix	trans	-67.7	-40.1	173.7	-177.7	177.3	173.9	-176.4	-0.3	112.6	G487 S488 Q489 I493 F494 D495 W634 Y636	G487-R491 WeakPolarHBondContact O-CB 3.49Å; G487-R491 PolarHBondContact O-N 2.87Å; S488-R491 PolarHBondContact O-N 3.11Å; Q489-R491 VanDerWaalsContact C-N 3.26Å; Q489-R491 PolarHBondContact O-N 3.13Å; R491-I493 VanDerWaalsContact C-N 3.29Å; R491-I493 PolarHBondContact O-N 3.32Å; R491-F494 WeakPolarHBondContact O-CB 3.46Å; R491-F494 PolarHBondContact O-N 3.33Å; R491-D495 IonicContact NE-OD2 3.61Å; R491-D495 WeakPolarHBondContact O-CB 3.34Å; R491-D495 PolarHBondContact O-N 3.24Å; R491-W634 HydrophobicContact CB-CH2 4.44Å; R491-W634 HydrophobicContact CB-CZ2 4.34Å; R491-W634 HydrophobicContact CG-CZ2 4.32Å; R491-Y636 HydrophobicContact CB-CE2 4.22Å; R491-Y636 HydrophobicContact CG-CD2 4.31Å; R491-Y636 HydrophobicContact CG-CE2 4.36Å
492	E	92.3	Very high	91.2	Very high	101 Å²	101	44.8 Å²	44.8	47%	0.472	23%	0.232	S	C	.	.	H	α-helix	trans	-62.5	-39	176.3	-155.8	-118.4	128.4	0	0	111.5	S488 Q489 R496	S488-E492 PolarHBondContact O-N 2.74Å; Q489-E492 PolarHBondContact O-N 2.94Å; Q489-E492 VanDerWaalsContact O-N 3.17Å; E492-R496 VanDerWaalsContact CD-NH2 3.28Å; E492-R496 VanDerWaalsContact O-CB 3.28Å; E492-R496 WeakPolarHBondContact O-CB 3.33Å; E492-R496 PolarHBondContact O-N 2.81Å; E492-R496 IonicContact OE1-CZ 3.63Å; E492-R496 IonicContact OE1-NE 3.99Å; E492-R496 PolarHBondContact OE1-NE 2.87Å; E492-R496 IonicContact OE1-NH2 3.69Å; E492-R496 PolarHBondContact OE1-NH2 3.41Å; E492-R496 IonicContact OE2-NH2 2.78Å; E492-R496 PolarHBondContact OE2-NH2 3.21Å
493	I	93.9	Very high	91	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-63.3	-46.7	173.1	-68.8	163.2	0	0	0	111.2	P478 Q481 I482 Q489 L490 R491 R496 I497	P478-I493 HydrophobicContact CB-CG2 4.02Å; P478-I493 WeakPolarHBondContact O-CG2 3.47Å; Q481-I493 VanDerWaalsContact C-CD1 3.47Å; Q481-I493 HydrophobicContact CB-CD1 3.88Å; Q481-I493 HydrophobicContact CB-CG1 4.39Å; Q481-I493 VanDerWaalsContact O-CD1 3.24Å; Q481-I493 WeakPolarHBondContact O-CD1 3.29Å; I482-I493 HydrophobicContact CG1-CD1 4.44Å; I482-I493 HydrophobicContact CG1-CG2 3.9Å; Q489-I493 HydrophobicContact CG-CD1 4.3Å; Q489-I493 WeakPolarHBondContact O-CG1 3.46Å; Q489-I493 PolarHBondContact O-N 2.55Å; L490-I493 PolarHBondContact O-N 3.38Å; R491-I493 VanDerWaalsContact C-N 3.29Å; R491-I493 PolarHBondContact O-N 3.32Å; I493-R496 PolarHBondContact O-N 3.33Å; I493-I497 HydrophobicContact CG2-CD1 3.92Å; I493-I497 WeakPolarHBondContact O-CG1 3.49Å; I493-I497 PolarHBondContact O-N 2.98Å
494	F	94.6	Very high	91.3	Very high	8 Å²	8	50.4 Å²	50.4	4%	0.035	25%	0.25	C	S	.	.	H	α-helix	trans	-57.7	-53.9	176.4	-177.2	-86.5	0	0	0	111.8	L490 R491 R496 I497 D498 V554 I558 L561 W634	L490-F494 PolarHBondContact O-N 3.42Å; R491-F494 WeakPolarHBondContact O-CB 3.46Å; R491-F494 PolarHBondContact O-N 3.33Å; F494-R496 PolarHBondContact O-N 3.17Å; F494-I497 PolarHBondContact O-N 3.43Å; F494-I497 VanDerWaalsContact O-N 3.08Å; F494-D498 PolarHBondContact O-N 3.49Å; F494-V554 HydrophobicContact CD2-CG1 4.2Å; F494-I558 HydrophobicContact CD2-CD1 4.01Å; F494-I558 HydrophobicContact CD2-CG1 4.13Å; F494-I558 HydrophobicContact CE2-CD1 3.71Å; F494-I558 HydrophobicContact CE2-CG1 3.84Å; F494-I558 HydrophobicContact CZ-CD1 4.02Å; F494-L561 HydrophobicContact CE1-CD1 3.77Å; F494-L561 HydrophobicContact CZ-CD1 3.64Å; F494-L561 HydrophobicContact CZ-CG 4.44Å; F494-W634 HydrophobicContact CB-CH2 3.47Å; F494-W634 VanDerWaalsContact CB-CH2 3.47Å; F494-W634 HydrophobicContact CB-CZ2 3.43Å; F494-W634 VanDerWaalsContact CB-CZ2 3.43Å; F494-W634 HydrophobicContact CB-CZ3 4.28Å; F494-W634 AromaticContact CD1-CE2 3.68Å; F494-W634 HydrophobicContact CD1-CH2 4.46Å; F494-W634 AromaticContact CD1-CZ2 3.61Å; F494-W634 HydrophobicContact CD1-CZ2 3.61Å; F494-W634 AromaticContact CD1-NE1 3.68Å; F494-W634 AromaticContact CD2-CD2 3.8Å; F494-W634 HydrophobicContact CD2-CD2 3.8Å; F494-W634 AromaticContact CD2-CE2 3.63Å; F494-W634 AromaticContact CD2-CE3 3.92Å; F494-W634 HydrophobicContact CD2-CE3 3.92Å; F494-W634 AromaticContact CD2-CH2 3.84Å; F494-W634 HydrophobicContact CD2-CH2 3.84Å; F494-W634 AromaticContact CD2-CZ2 3.67Å; F494-W634 HydrophobicContact CD2-CZ2 3.67Å; F494-W634 AromaticContact CD2-CZ3 3.95Å; F494-W634 HydrophobicContact CD2-CZ3 3.95Å; F494-W634 AromaticContact CE1-CE2 3.88Å; F494-W634 HydrophobicContact CE1-CZ2 4.29Å; F494-W634 AromaticContact CE1-NE1 3.47Å; F494-W634 AromaticContact CE2-CD2 3.78Å; F494-W634 HydrophobicContact CE2-CD2 3.78Å; F494-W634 AromaticContact CE2-CE2 3.83Å; F494-W634 HydrophobicContact CE2-CE3 4.2Å; F494-W634 HydrophobicContact CE2-CG 4.04Å; F494-W634 HydrophobicContact CE2-CZ2 4.33Å; F494-W634 AromaticContact CE2-NE1 3.99Å; F494-W634 HydrophobicContact CG-CD2 4.23Å; F494-W634 AromaticContact CG-CE2 3.56Å; F494-W634 AromaticContact CG-CH2 3.68Å; F494-W634 HydrophobicContact CG-CH2 3.68Å; F494-W634 AromaticContact CG-CZ2 3.26Å; F494-W634 HydrophobicContact CG-CZ2 3.26Å; F494-W634 HydrophobicContact CG-CZ3 4.27Å; F494-W634 AromaticContact CZ-CD1 3.79Å; F494-W634 HydrophobicContact CZ-CD2 4.19Å; F494-W634 AromaticContact CZ-CE2 3.95Å; F494-W634 HydrophobicContact CZ-CG 4.13Å; F494-W634 AromaticContact CZ-NE1 3.64Å
495	D	93.3	Very high	91.6	Very high	49 Å²	49	50 Å²	50	26%	0.262	25%	0.253	S	S	.	.	H	α-helix	trans	-60.8	-30.5	179.9	-72.1	3.1	0	0	0	111.5	R491 K499	R491-D495 IonicContact NE-OD2 3.61Å; R491-D495 WeakPolarHBondContact O-CB 3.34Å; R491-D495 PolarHBondContact O-N 3.24Å; D495-K499 WeakPolarHBondContact O-CB 3.47Å; D495-K499 WeakPolarHBondContact O-CD 3.48Å; D495-K499 WeakPolarHBondContact O-CE 3.48Å; D495-K499 WeakPolarHBondContact O-CG 3.43Å; D495-K499 PolarHBondContact O-N 3.5Å; D495-K499 VanDerWaalsContact O-N 3.11Å
496	R	93.4	Very high	92	Very high	58 Å²	58	44.9 Å²	44.9	22%	0.219	23%	0.226	C	C	.	.	H	α-helix	trans	-73	-38.5	175.8	-162.2	-171.3	-61.9	163.6	-0.9	112.1	E492 I493 F494 L500 V506	E492-R496 VanDerWaalsContact CD-NH2 3.28Å; E492-R496 VanDerWaalsContact O-CB 3.28Å; E492-R496 WeakPolarHBondContact O-CB 3.33Å; E492-R496 PolarHBondContact O-N 2.81Å; E492-R496 IonicContact OE1-CZ 3.63Å; E492-R496 IonicContact OE1-NE 3.99Å; E492-R496 PolarHBondContact OE1-NE 2.87Å; E492-R496 IonicContact OE1-NH2 3.69Å; E492-R496 PolarHBondContact OE1-NH2 3.41Å; E492-R496 IonicContact OE2-NH2 2.78Å; E492-R496 PolarHBondContact OE2-NH2 3.21Å; I493-R496 PolarHBondContact O-N 3.33Å; F494-R496 PolarHBondContact O-N 3.17Å; R496-L500 PolarHBondContact O-N 3.41Å; R496-V506 HydrophobicContact CG-CB 4.31Å; R496-V506 HydrophobicContact CG-CG1 4.37Å
497	I	95	Very high	92	Very high	5 Å²	5	48.8 Å²	48.8	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-68.6	-47.1	175.2	-65.7	164.9	0	0	0	110.3	P478 V479 I493 F494 K499 L500 L501 L529 F533 V554 I558	P478-I497 HydrophobicContact CB-CD1 4.11Å; P478-I497 HydrophobicContact CB-CG1 3.81Å; P478-I497 HydrophobicContact CG-CG1 4.46Å; V479-I497 HydrophobicContact CG2-CD1 3.76Å; I493-I497 HydrophobicContact CG2-CD1 3.92Å; I493-I497 WeakPolarHBondContact O-CG1 3.49Å; I493-I497 PolarHBondContact O-N 2.98Å; F494-I497 PolarHBondContact O-N 3.43Å; F494-I497 VanDerWaalsContact O-N 3.08Å; I497-K499 PolarHBondContact O-N 2.96Å; I497-L500 PolarHBondContact O-N 2.91Å; I497-L501 HydrophobicContact CG2-CD1 3.95Å; I497-L501 HydrophobicContact CG2-CG 4.46Å; I497-L501 PolarHBondContact O-N 2.79Å; I497-L529 HydrophobicContact CD1-CD1 4.43Å; I497-L529 HydrophobicContact CG1-CD1 4.44Å; I497-L529 HydrophobicContact CG2-CD1 3.89Å; I497-L529 HydrophobicContact CG2-CD2 3.53Å; I497-L529 HydrophobicContact CG2-CG 4.37Å; I497-F533 HydrophobicContact CD1-CZ 4.47Å; I497-V554 HydrophobicContact CD1-CG1 4.19Å; I497-I558 HydrophobicContact CB-CD1 4.1Å; I497-I558 HydrophobicContact CG2-CD1 3.68Å; I497-I558 HydrophobicContact CG2-CG1 4.03Å
498	D	94.6	Very high	91.6	Very high	35 Å²	35	49.7 Å²	49.7	19%	0.187	26%	0.256	C	S	.	.	H	α-helix	trans	-59.9	-42.9	178.1	174.7	63.6	0	0	0	112.6	F494 L500 L501 S502 I558 L561 H562	F494-D498 PolarHBondContact O-N 3.49Å; D498-L500 VanDerWaalsContact C-N 3.34Å; D498-L500 PolarHBondContact O-N 3.4Å; D498-L501 PolarHBondContact O-N 3Å; D498-S502 WeakPolarHBondContact O-CB 3.42Å; D498-S502 PolarHBondContact O-N 3.31Å; D498-S502 PolarHBondContact O-OG 3.09Å; D498-I558 HydrophobicContact CB-CD1 4.4Å; D498-L561 HydrophobicContact CB-CD1 4.42Å; D498-L561 WeakPolarHBondContact OD1-CD1 3.35Å; D498-H562 IonicContact OD1-CD2 2.7Å; D498-H562 IonicContact OD1-CE1 3.4Å; D498-H562 IonicContact OD1-NE2 3.57Å; D498-H562 PolarHBondContact OD1-NE2 3.19Å
499	K	93.8	Very high	90.7	Very high	87 Å²	87	50.2 Å²	50.2	38%	0.378	27%	0.272	S	S	.	.	H	α-helix	trans	-58.7	-44.3	175	-75.8	161.3	-160.4	161	0	111.8	D495 I497 S502 G503 R504 V506	D495-K499 WeakPolarHBondContact O-CB 3.47Å; D495-K499 WeakPolarHBondContact O-CD 3.48Å; D495-K499 WeakPolarHBondContact O-CE 3.48Å; D495-K499 WeakPolarHBondContact O-CG 3.43Å; D495-K499 PolarHBondContact O-N 3.5Å; D495-K499 VanDerWaalsContact O-N 3.11Å; I497-K499 PolarHBondContact O-N 2.96Å; K499-S502 CarbonylContact O-C 3.53Å; K499-S502 PolarHBondContact O-N 3.45Å; K499-G503 PolarHBondContact O-N 3.14Å; K499-R504 HydrophobicContact CB-CB 4.26Å; K499-R504 WeakPolarHBondContact O-CA 2.95Å; K499-R504 VanDerWaalsContact O-CB 3.27Å; K499-R504 WeakPolarHBondContact O-CB 3.45Å; K499-R504 PolarHBondContact O-N 2.64Å; K499-V506 HydrophobicContact CB-CG1 3.72Å
500	L	93.7	Very high	89.9	Confident	4 Å²	4	50 Å²	50	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-67	-43.4	179.8	179.8	66.1	0	0	0	112.1	A474 A475 R496 I497 D498 S502 G503 V506 A515 V525	A474-L500 HydrophobicContact CB-CD1 4.36Å; A474-L500 HydrophobicContact CB-CD2 3.86Å; A475-L500 HydrophobicContact CB-CD2 4.24Å; R496-L500 PolarHBondContact O-N 3.41Å; I497-L500 PolarHBondContact O-N 2.91Å; D498-L500 VanDerWaalsContact C-N 3.34Å; D498-L500 PolarHBondContact O-N 3.4Å; L500-S502 VanDerWaalsContact C-N 3.31Å; L500-G503 PolarHBondContact O-N 3.26Å; L500-G503 VanDerWaalsContact O-N 3.12Å; L500-V506 HydrophobicContact CB-CG1 4.13Å; L500-V506 HydrophobicContact CB-CG2 4.11Å; L500-V506 HydrophobicContact CD1-CG2 3.88Å; L500-V506 HydrophobicContact CG-CG2 4.39Å; L500-A515 HydrophobicContact CD1-CB 4.2Å; L500-A515 WeakPolarHBondContact O-CB 2.98Å; L500-V525 HydrophobicContact CD2-CG1 3.81Å; L500-V525 HydrophobicContact CD2-CG2 4.37Å; L500-V525 HydrophobicContact CG-CG1 3.95Å
501	L	93.5	Very high	89.3	Confident	18 Å²	18	54.8 Å²	54.8	9%	0.094	31%	0.312	C	S	.	.	H	α-helix	trans	-64.7	-35.5	174.5	-71.3	170.8	0	0	0	112.1	I497 D498 G503 L522 V525 A526 L529 I558 H562 V565	I497-L501 HydrophobicContact CG2-CD1 3.95Å; I497-L501 HydrophobicContact CG2-CG 4.46Å; I497-L501 PolarHBondContact O-N 2.79Å; D498-L501 PolarHBondContact O-N 3Å; L501-G503 PolarHBondContact O-N 3.45Å; L501-G503 VanDerWaalsContact O-N 3.09Å; L501-L522 VanDerWaalsContact O-CD2 3.23Å; L501-L522 WeakPolarHBondContact O-CD2 3.27Å; L501-V525 HydrophobicContact CD2-CG1 3.98Å; L501-A526 HydrophobicContact CD2-CB 4.34Å; L501-L529 HydrophobicContact CD1-CD2 3.72Å; L501-L529 HydrophobicContact CD2-CD2 4.01Å; L501-L529 HydrophobicContact CG-CD2 4.11Å; L501-I558 HydrophobicContact CD1-CD1 4.49Å; L501-I558 HydrophobicContact CD1-CG2 3.69Å; L501-H562 HydrophobicContact CD1-CB 4.24Å; L501-V565 HydrophobicContact CD1-CG2 4.03Å; L501-V565 HydrophobicContact CD2-CG2 3.87Å
502	S	92.5	Very high	89	Confident	52 Å²	52	53.2 Å²	53.2	36%	0.364	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	13.4	172.2	-60.6	0	0	0	0	113.7	D498 K499 L500 R504	D498-S502 WeakPolarHBondContact O-CB 3.42Å; D498-S502 PolarHBondContact O-N 3.31Å; D498-S502 PolarHBondContact O-OG 3.09Å; K499-S502 CarbonylContact O-C 3.53Å; K499-S502 PolarHBondContact O-N 3.45Å; L500-S502 VanDerWaalsContact C-N 3.31Å; S502-R504 PolarHBondContact O-N 3.46Å; S502-R504 VanDerWaalsContact O-N 3.08Å
503	G	88.8	Confident	88.9	Confident	10 Å²	10	48.5 Å²	48.5	10%	0.103	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	69	0.5	-179.9	0	0	0	0	0	115.5	K499 L500 L501 S514 S516	K499-G503 PolarHBondContact O-N 3.14Å; L500-G503 PolarHBondContact O-N 3.26Å; L500-G503 VanDerWaalsContact O-N 3.12Å; L501-G503 PolarHBondContact O-N 3.45Å; L501-G503 VanDerWaalsContact O-N 3.09Å; G503-S514 PolarHBondContact O-OG 3.33Å; G503-S516 WeakPolarHBondContact CA-OG 2.81Å; G503-S516 PolarHBondContact O-OG 3.38Å
504	R	91.3	Very high	88.8	Confident	161 Å²	161	49.2 Å²	49.2	61%	0.608	30%	0.301	S	S	*	.			trans	-74.7	155.8	-178.2	-51.6	-177	-176.2	179	2.7	110.2	K499 S502	K499-R504 HydrophobicContact CB-CB 4.26Å; K499-R504 WeakPolarHBondContact O-CA 2.95Å; K499-R504 VanDerWaalsContact O-CB 3.27Å; K499-R504 WeakPolarHBondContact O-CB 3.45Å; K499-R504 PolarHBondContact O-N 2.64Å; S502-R504 PolarHBondContact O-N 3.46Å; S502-R504 VanDerWaalsContact O-N 3.08Å
505	A	89.3	Confident	88.5	Confident	59 Å²	59	48.8 Å²	48.8	49%	0.488	30%	0.299	S	S	.	.			trans	-75.3	137.6	178.8	0	0	0	0	0	111.5	S512 V513	A505-S512 WeakPolarHBondContact CB-OG 3.31Å; A505-V513 CarbonylContact C-O 3.58Å; A505-V513 WeakPolarHBondContact CA-O 3.39Å
506	V	90.7	Very high	88.4	Confident	11 Å²	11	50.1 Å²	50.1	7%	0.067	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	149.4	178.1	-60.5	0	0	0	0	110.6	A474 R496 K499 L500 V513	A474-V506 HydrophobicContact CB-CG2 4.28Å; R496-V506 HydrophobicContact CG-CB 4.31Å; R496-V506 HydrophobicContact CG-CG1 4.37Å; K499-V506 HydrophobicContact CB-CG1 3.72Å; L500-V506 HydrophobicContact CB-CG1 4.13Å; L500-V506 HydrophobicContact CB-CG2 4.11Å; L500-V506 HydrophobicContact CD1-CG2 3.88Å; L500-V506 HydrophobicContact CG-CG2 4.39Å; V506-V513 PolarHBondContact N-O 2.93Å; V506-V513 PolarHBondContact O-N 3.34Å
507	V	86.9	Confident	88	Confident	99 Å²	99	52.3 Å²	52.3	60%	0.6	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	121.9	178.2	-176.5	0	0	0	0	110.1	K511	V507-K511 CarbonylContact C-O 3Å; V507-K511 WeakPolarHBondContact CA-O 3.14Å
508	S	80.8	Confident	87.5	Confident	20 Å²	20	53.8 Å²	53.8	14%	0.14	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	118.7	177.2	-173.8	0	0	0	0	109.1	A474 G510 K511	A474-S508 PolarHBondContact N-OG 3.46Å; S508-G510 VanDerWaalsContact C-N 3.26Å; S508-G510 PolarHBondContact O-N 2.86Å; S508-K511 PolarHBondContact N-O 2.72Å; S508-K511 PolarHBondContact O-N 2.91Å
509	G	68.8	Low	87.1	Confident	81 Å²	81	58.1 Å²	58.1	84%	0.835	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	35.9	179.7	0	0	0	0	0	114.6
510	G	75	Confident	86.9	Confident	74 Å²	74	55.2 Å²	55.2	76%	0.763	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	5.2	-178	0	0	0	0	0	115.7	S508	S508-G510 VanDerWaalsContact C-N 3.26Å; S508-G510 PolarHBondContact O-N 2.86Å
511	K	80.2	Confident	86.7	Confident	104 Å²	104	55 Å²	55	45%	0.452	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	149.6	178	-55.8	-177	-164.3	176.4	0	111.7	E470 V507 S508	E470-K511 WeakPolarHBondContact OE1-CD 3.36Å; E470-K511 IonicContact OE1-NZ 2.79Å; E470-K511 PolarHBondContact OE1-NZ 3.43Å; V507-K511 CarbonylContact C-O 3Å; V507-K511 WeakPolarHBondContact CA-O 3.14Å; S508-K511 PolarHBondContact N-O 2.72Å; S508-K511 PolarHBondContact O-N 2.91Å
512	S	87.5	Confident	86.5	Confident	80 Å²	80	57.7 Å²	57.7	56%	0.559	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	122.4	173	-163.8	0	0	0	0	110.5	A505	A505-S512 WeakPolarHBondContact CB-OG 3.31Å
513	V	89.7	Confident	86.5	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.012	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.4	-175.7	-175.1	0	0	0	0	109.1	E470 L471 A474 A505 V506	E470-V513 HydrophobicContact CB-CG2 4.16Å; L471-V513 HydrophobicContact CD2-CG1 3.78Å; L471-V513 HydrophobicContact CG-CG1 4.24Å; A474-V513 HydrophobicContact CB-CG1 4.47Å; A505-V513 CarbonylContact C-O 3.58Å; A505-V513 WeakPolarHBondContact CA-O 3.39Å; V506-V513 PolarHBondContact N-O 2.93Å; V506-V513 PolarHBondContact O-N 3.34Å
514	S	91	Very high	86.7	Confident	16 Å²	16	57.8 Å²	57.8	11%	0.112	36%	0.355	C	S	.	.			trans	-132.5	136.9	177.6	155.1	0	0	0	0	110.1	G503 S516 Q517	G503-S514 PolarHBondContact O-OG 3.33Å; S514-S516 PolarHBondContact O-N 3.2Å; S514-S516 PolarHBondContact OG-N 2.91Å; S514-S516 VanDerWaalsContact OG-N 3.14Å; S514-Q517 VanDerWaalsContact O-CB 3.29Å; S514-Q517 WeakPolarHBondContact O-CB 3.37Å; S514-Q517 VanDerWaalsContact O-CG 3.31Å; S514-Q517 WeakPolarHBondContact O-CG 3.16Å; S514-Q517 PolarHBondContact O-N 3.1Å; S514-Q517 VanDerWaalsContact O-N 3.12Å; S514-Q517 PolarHBondContact O-OE1 3.27Å
515	A	89.4	Confident	86.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-62.1	-25.2	176.2	0	0	0	0	0	113	L471 L500 Q517 G521 L522 V525	L471-A515 HydrophobicContact CD2-CB 4.45Å; L500-A515 HydrophobicContact CD1-CB 4.2Å; L500-A515 WeakPolarHBondContact O-CB 2.98Å; A515-Q517 PolarHBondContact O-N 3.04Å; A515-G521 WeakPolarHBondContact O-CA 3.39Å; A515-L522 HydrophobicContact CB-CD2 3.61Å; A515-L522 HydrophobicContact CB-CG 4.07Å; A515-V525 HydrophobicContact CB-CG2 4.22Å
516	S	89.7	Confident	87.1	Confident	77 Å²	77	47.6 Å²	47.6	54%	0.538	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-74.1	-3	176.5	-50.2	0	0	0	0	114.2	G503 S514 H518	G503-S516 WeakPolarHBondContact CA-OG 2.81Å; G503-S516 PolarHBondContact O-OG 3.38Å; S514-S516 PolarHBondContact O-N 3.2Å; S514-S516 PolarHBondContact OG-N 2.91Å; S514-S516 VanDerWaalsContact OG-N 3.14Å; S516-H518 PolarHBondContact O-N 3.17Å
517	Q	85.8	Confident	87.3	Confident	103 Å²	103	49 Å²	49	48%	0.481	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-69.9	-9.8	174.9	-69.2	171	-29.7	0	0	113.3	L467 S514 A515	L467-Q517 HydrophobicContact CD1-CB 4.11Å; L467-Q517 HydrophobicContact CD2-CB 4.09Å; S514-Q517 VanDerWaalsContact O-CB 3.29Å; S514-Q517 WeakPolarHBondContact O-CB 3.37Å; S514-Q517 VanDerWaalsContact O-CG 3.31Å; S514-Q517 WeakPolarHBondContact O-CG 3.16Å; S514-Q517 PolarHBondContact O-N 3.1Å; S514-Q517 VanDerWaalsContact O-N 3.12Å; S514-Q517 PolarHBondContact O-OE1 3.27Å; A515-Q517 PolarHBondContact O-N 3.04Å
518	H	85.6	Confident	87.7	Confident	36 Å²	36	45.9 Å²	45.9	17%	0.167	29%	0.287	C	S	.	.	S	Bend	trans	-145	140.1	174.1	-168.9	-101.6	0	0	0	109.8	L467 S516 Q520 G521	L467-H518 HydrophobicContact CD2-CB 3.99Å; S516-H518 PolarHBondContact O-N 3.17Å; H518-Q520 VanDerWaalsContact C-N 3.27Å; H518-Q520 PolarHBondContact ND1-N 2.93Å; H518-Q520 PolarHBondContact O-N 2.93Å; H518-G521 WeakPolarHBondContact O-CA 3.5Å; H518-G521 PolarHBondContact O-N 2.89Å
519	P	85.5	Confident	88.4	Confident	127 Å²	127	45 Å²	45	83%	0.825	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-39.7	-178.9	-27.8	35.9	0	0	0	113.8	G521	P519-G521 VanDerWaalsContact C-N 3.3Å; P519-G521 PolarHBondContact O-N 3.27Å
520	Q	89.6	Confident	89.8	Confident	26 Å²	26	41.1 Å²	41.1	12%	0.121	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	3.2	177.2	-56.9	172.5	-26.8	0	0	113.7	S452 F453 L456 H518 F524	S452-Q520 WeakPolarHBondContact O-CG 3.5Å; S452-Q520 PolarHBondContact O-NE2 3.5Å; F453-Q520 HydrophobicContact CB-CB 3.9Å; L456-Q520 HydrophobicContact CB-CB 4.39Å; H518-Q520 VanDerWaalsContact C-N 3.27Å; H518-Q520 PolarHBondContact ND1-N 2.93Å; H518-Q520 PolarHBondContact O-N 2.93Å; Q520-F524 WeakPolarHBondContact O-CB 3.26Å; Q520-F524 PolarHBondContact O-N 2.65Å; Q520-F524 VanDerWaalsContact O-N 3.15Å
521	G	88.6	Confident	90.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-69.1	-35.8	-170.2	0	0	0	0	0	113.7	A515 H518 P519 V525	A515-G521 WeakPolarHBondContact O-CA 3.39Å; H518-G521 WeakPolarHBondContact O-CA 3.5Å; H518-G521 PolarHBondContact O-N 2.89Å; P519-G521 VanDerWaalsContact C-N 3.3Å; P519-G521 PolarHBondContact O-N 3.27Å; G521-V525 WeakPolarHBondContact O-CB 3.43Å; G521-V525 VanDerWaalsContact O-CG2 3.27Å; G521-V525 WeakPolarHBondContact O-CG2 3.44Å; G521-V525 PolarHBondContact O-N 2.66Å
522	L	91.1	Very high	91.6	Very high	73 Å²	73	36.9 Å²	36.9	38%	0.382	20%	0.203	S	C	.	.	H	α-helix	trans	-64.7	-49.9	177.6	-71.9	164.5	0	0	0	111.9	L501 A515 V525 A526	L501-L522 VanDerWaalsContact O-CD2 3.23Å; L501-L522 WeakPolarHBondContact O-CD2 3.27Å; A515-L522 HydrophobicContact CB-CD2 3.61Å; A515-L522 HydrophobicContact CB-CG 4.07Å; L522-V525 PolarHBondContact O-N 3.1Å; L522-A526 WeakPolarHBondContact O-CB 3.31Å; L522-A526 PolarHBondContact O-N 3.44Å
523	E	91.8	Very high	92	Very high	65 Å²	65	33.1 Å²	33.1	30%	0.304	18%	0.176	S	C	.	.	H	α-helix	trans	-65.7	-42	-179.9	-59.5	-177.2	136.2	0	0	111.7	S452 F453 V525 A526 Y527	S452-E523 VanDerWaalsContact CB-OE2 3.22Å; S452-E523 WeakPolarHBondContact CB-OE2 3.4Å; S452-E523 VanDerWaalsContact OG-CD 3.24Å; S452-E523 PolarHBondContact OG-OE2 3.46Å; F453-E523 HydrophobicContact CD1-CB 4.36Å; E523-V525 VanDerWaalsContact C-N 3.35Å; E523-V525 PolarHBondContact O-N 2.8Å; E523-A526 PolarHBondContact O-N 2.97Å; E523-Y527 WeakPolarHBondContact O-CB 3.34Å; E523-Y527 PolarHBondContact O-N 3.35Å
524	F	93.1	Very high	92.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.3	-42	173.6	174.9	-102.2	0	0	0	112.4	F453 L456 K468 L471 Q472 Q520 K528	F453-F524 HydrophobicContact CB-CB 4.12Å; F453-F524 HydrophobicContact CD1-CB 4.25Å; F453-F524 HydrophobicContact CD2-CB 4.39Å; F453-F524 AromaticContact CD2-CD2 3.73Å; F453-F524 HydrophobicContact CD2-CD2 3.73Å; F453-F524 AromaticContact CE2-CD2 3.9Å; F453-F524 HydrophobicContact CE2-CD2 3.9Å; F453-F524 HydrophobicContact CG-CB 4.01Å; F453-F524 HydrophobicContact CG-CD2 4.21Å; F453-F524 HydrophobicContact CZ-CD2 4.5Å; L456-F524 HydrophobicContact CD2-CB 3.69Å; L456-F524 HydrophobicContact CD2-CD1 3.89Å; L456-F524 HydrophobicContact CD2-CD2 4.41Å; L456-F524 HydrophobicContact CD2-CG 3.74Å; L456-F524 HydrophobicContact CG-CG 4.41Å; K468-F524 HydrophobicContact CD-CZ 4.46Å; K468-F524 HydrophobicContact CG-CE1 4.08Å; K468-F524 HydrophobicContact CG-CE2 4.16Å; K468-F524 HydrophobicContact CG-CZ 3.58Å; L471-F524 HydrophobicContact CB-CD1 4.28Å; L471-F524 HydrophobicContact CB-CE1 4.15Å; Q472-F524 HydrophobicContact CB-CE1 4.1Å; Q472-F524 HydrophobicContact CB-CZ 4.13Å; Q520-F524 WeakPolarHBondContact O-CB 3.26Å; Q520-F524 PolarHBondContact O-N 2.65Å; Q520-F524 VanDerWaalsContact O-N 3.15Å; F524-K528 HydrophobicContact CD2-CG 4.16Å; F524-K528 HydrophobicContact CE1-CG 4.23Å; F524-K528 HydrophobicContact CE2-CD 4.31Å; F524-K528 HydrophobicContact CE2-CG 3.8Å; F524-K528 HydrophobicContact CZ-CD 4.42Å; F524-K528 HydrophobicContact CZ-CG 3.84Å; F524-K528 WeakPolarHBondContact O-CB 3.49Å; F524-K528 VanDerWaalsContact O-CG 3.26Å; F524-K528 WeakPolarHBondContact O-CG 3.42Å; F524-K528 PolarHBondContact O-N 3Å
525	V	94.4	Very high	92.6	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	19%	0.188	C	C	.	.	H	α-helix	trans	-64.3	-48.1	174.5	162.3	0	0	0	0	110.8	L471 A475 L500 L501 A515 G521 L522 E523 Y527 K528 L529	L471-V525 HydrophobicContact CB-CG2 4.29Å; L471-V525 HydrophobicContact CD2-CG2 4.07Å; A475-V525 HydrophobicContact CB-CG1 4.13Å; L500-V525 HydrophobicContact CD2-CG1 3.81Å; L500-V525 HydrophobicContact CD2-CG2 4.37Å; L500-V525 HydrophobicContact CG-CG1 3.95Å; L501-V525 HydrophobicContact CD2-CG1 3.98Å; A515-V525 HydrophobicContact CB-CG2 4.22Å; G521-V525 WeakPolarHBondContact O-CB 3.43Å; G521-V525 VanDerWaalsContact O-CG2 3.27Å; G521-V525 WeakPolarHBondContact O-CG2 3.44Å; G521-V525 PolarHBondContact O-N 2.66Å; L522-V525 PolarHBondContact O-N 3.1Å; E523-V525 VanDerWaalsContact C-N 3.35Å; E523-V525 PolarHBondContact O-N 2.8Å; V525-Y527 VanDerWaalsContact C-N 3.35Å; V525-Y527 PolarHBondContact O-N 3.48Å; V525-K528 PolarHBondContact O-N 3.37Å; V525-L529 WeakPolarHBondContact O-CB 3.24Å; V525-L529 PolarHBondContact O-N 2.71Å
526	A	94.6	Very high	92.9	Very high	4 Å²	4	37 Å²	37	3%	0.033	19%	0.192	C	C	.	.	H	α-helix	trans	-57.6	-46.6	179.1	0	0	0	0	0	111.8	L501 L522 E523 L529 A530 V565 L568	L501-A526 HydrophobicContact CD2-CB 4.34Å; L522-A526 WeakPolarHBondContact O-CB 3.31Å; L522-A526 PolarHBondContact O-N 3.44Å; E523-A526 PolarHBondContact O-N 2.97Å; A526-L529 PolarHBondContact O-N 3Å; A526-A530 WeakPolarHBondContact O-CB 3.13Å; A526-A530 PolarHBondContact O-N 2.89Å; A526-V565 HydrophobicContact CB-CG2 3.96Å; A526-L568 HydrophobicContact CB-CD1 4.1Å
527	Y	94.9	Very high	93.2	Very high	42 Å²	42	33.4 Å²	33.4	17%	0.165	17%	0.166	C	C	.	.	H	α-helix	trans	-63	-49	176.5	-170.9	-78.9	0	0	0	112.2	A450 F453 E523 V525 L529 A530 E531 L568 H572	A450-Y527 HydrophobicContact CB-CE2 3.85Å; F453-Y527 HydrophobicContact CE1-CD1 4.19Å; F453-Y527 AromaticContact CE1-CD2 3.77Å; F453-Y527 HydrophobicContact CE1-CD2 3.77Å; F453-Y527 HydrophobicContact CE1-CE2 4.5Å; F453-Y527 AromaticContact CE1-CG 3.58Å; F453-Y527 HydrophobicContact CE1-CG 3.58Å; F453-Y527 AromaticContact CZ-CD1 3.66Å; F453-Y527 HydrophobicContact CZ-CD1 3.66Å; F453-Y527 AromaticContact CZ-CD2 3.87Å; F453-Y527 HydrophobicContact CZ-CD2 3.87Å; F453-Y527 HydrophobicContact CZ-CE1 4.08Å; F453-Y527 HydrophobicContact CZ-CE2 4.28Å; F453-Y527 AromaticContact CZ-CG 3.54Å; F453-Y527 HydrophobicContact CZ-CG 3.54Å; E523-Y527 WeakPolarHBondContact O-CB 3.34Å; E523-Y527 PolarHBondContact O-N 3.35Å; V525-Y527 VanDerWaalsContact C-N 3.35Å; V525-Y527 PolarHBondContact O-N 3.48Å; Y527-L529 VanDerWaalsContact C-N 3.31Å; Y527-L529 PolarHBondContact O-N 3.2Å; Y527-A530 PolarHBondContact O-N 3.33Å; Y527-E531 WeakPolarHBondContact O-CB 3.5Å; Y527-E531 PolarHBondContact O-N 3.27Å; Y527-L568 HydrophobicContact CD2-CD2 4.11Å; Y527-H572 AromaticContact CD1-NE2 3.82Å; Y527-H572 AromaticContact CD2-NE2 3.98Å; Y527-H572 AromaticContact CE1-CE1 3.56Å; Y527-H572 AromaticContact CE1-NE2 3.61Å; Y527-H572 AromaticContact CE2-CE1 3.98Å; Y527-H572 AromaticContact CE2-NE2 3.78Å; Y527-H572 AromaticContact CZ-CE1 3.42Å; Y527-H572 VanDerWaalsContact CZ-CE1 3.42Å; Y527-H572 AromaticContact CZ-NE2 3.59Å
528	K	94.8	Very high	93.6	Very high	32 Å²	32	29 Å²	29	14%	0.139	15%	0.145	C	C	.	.	H	α-helix	trans	-68.7	-29.2	-179.5	-70.6	-72	148.4	-163.2	0	113.2	Q472 F524 V525 E531 K532	Q472-K528 HydrophobicContact CG-CD 4.4Å; F524-K528 HydrophobicContact CD2-CG 4.16Å; F524-K528 HydrophobicContact CE1-CG 4.23Å; F524-K528 HydrophobicContact CE2-CD 4.31Å; F524-K528 HydrophobicContact CE2-CG 3.8Å; F524-K528 HydrophobicContact CZ-CD 4.42Å; F524-K528 HydrophobicContact CZ-CG 3.84Å; F524-K528 WeakPolarHBondContact O-CB 3.49Å; F524-K528 VanDerWaalsContact O-CG 3.26Å; F524-K528 WeakPolarHBondContact O-CG 3.42Å; F524-K528 PolarHBondContact O-N 3Å; V525-K528 PolarHBondContact O-N 3.37Å; K528-E531 WeakPolarHBondContact CD-OE2 3.33Å; K528-E531 WeakPolarHBondContact CE-OE2 3.21Å; K528-E531 IonicContact NZ-OE1 3.73Å; K528-E531 IonicContact NZ-OE2 3.85Å; K528-E531 PolarHBondContact NZ-OE2 3.1Å; K528-K532 WeakPolarHBondContact O-CB 3.18Å; K528-K532 PolarHBondContact O-N 3.21Å; K528-K532 VanDerWaalsContact O-N 3.17Å
529	L	96.4	Very high	94	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-69.1	-49	172.7	-177.9	71.6	0	0	0	110.8	A475 V479 I497 L501 V525 A526 Y527 K532 F533 I558 V565	A475-L529 WeakPolarHBondContact O-CD1 3.44Å; V479-L529 HydrophobicContact CG2-CD1 3.47Å; V479-L529 VanDerWaalsContact CG2-CD1 3.47Å; I497-L529 HydrophobicContact CD1-CD1 4.43Å; I497-L529 HydrophobicContact CG1-CD1 4.44Å; I497-L529 HydrophobicContact CG2-CD1 3.89Å; I497-L529 HydrophobicContact CG2-CD2 3.53Å; I497-L529 HydrophobicContact CG2-CG 4.37Å; L501-L529 HydrophobicContact CD1-CD2 3.72Å; L501-L529 HydrophobicContact CD2-CD2 4.01Å; L501-L529 HydrophobicContact CG-CD2 4.11Å; V525-L529 WeakPolarHBondContact O-CB 3.24Å; V525-L529 PolarHBondContact O-N 2.71Å; A526-L529 PolarHBondContact O-N 3Å; Y527-L529 VanDerWaalsContact C-N 3.31Å; Y527-L529 PolarHBondContact O-N 3.2Å; L529-K532 PolarHBondContact O-N 2.73Å; L529-K532 VanDerWaalsContact O-N 3.16Å; L529-F533 HydrophobicContact CD1-CD2 4.45Å; L529-F533 HydrophobicContact CD1-CE2 3.88Å; L529-F533 HydrophobicContact CD1-CZ 4.42Å; L529-F533 HydrophobicContact CD2-CE2 4.14Å; L529-F533 HydrophobicContact CG-CD2 4.07Å; L529-F533 HydrophobicContact CG-CE2 3.67Å; L529-F533 WeakPolarHBondContact O-CD2 3.37Å; L529-F533 PolarHBondContact O-N 3.26Å; L529-I558 HydrophobicContact CD2-CG2 4.31Å; L529-V565 HydrophobicContact CD2-CG1 3.93Å; L529-V565 HydrophobicContact CG-CG1 4.46Å
530	A	96.7	Very high	94.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.2	-47.5	176.9	0	0	0	0	0	112.5	A526 Y527 K532 F533 V534 L568 I569	A526-A530 WeakPolarHBondContact O-CB 3.13Å; A526-A530 PolarHBondContact O-N 2.89Å; Y527-A530 PolarHBondContact O-N 3.33Å; A530-K532 PolarHBondContact O-N 2.96Å; A530-F533 PolarHBondContact O-N 3.02Å; A530-V534 PolarHBondContact O-N 3.39Å; A530-L568 HydrophobicContact CB-CB 3.55Å; A530-I569 HydrophobicContact CB-CG1 3.74Å
531	E	95.6	Very high	94.7	Very high	59 Å²	59	27.1 Å²	27.1	28%	0.276	13%	0.126	S	C	.	.	H	α-helix	trans	-55	-40.6	173.3	-176.4	-179.2	-155.5	0	0	111.8	Y527 K528 K535 H572	Y527-E531 WeakPolarHBondContact O-CB 3.5Å; Y527-E531 PolarHBondContact O-N 3.27Å; K528-E531 WeakPolarHBondContact CD-OE2 3.33Å; K528-E531 WeakPolarHBondContact CE-OE2 3.21Å; K528-E531 IonicContact NZ-OE1 3.73Å; K528-E531 IonicContact NZ-OE2 3.85Å; K528-E531 PolarHBondContact NZ-OE2 3.1Å; E531-K535 VanDerWaalsContact O-CB 3.27Å; E531-K535 WeakPolarHBondContact O-CB 3.31Å; E531-K535 PolarHBondContact O-N 3.37Å; E531-H572 PolarHBondContact N-CD2 2.86Å
532	K	96.9	Very high	95	Very high	31 Å²	31	27.8 Å²	27.8	14%	0.135	13%	0.132	C	C	.	.	H	α-helix	trans	-75.6	-33.9	-179.6	-179.1	54.2	178	164.9	0	113.2	T476 V479 S480 K528 L529 A530 K535 Q536	T476-K532 HydrophobicContact CG2-CB 3.92Å; T476-K532 HydrophobicContact CG2-CG 4.17Å; V479-K532 HydrophobicContact CB-CG 4Å; V479-K532 HydrophobicContact CG1-CG 3.88Å; S480-K532 WeakPolarHBondContact OG-CE 3.2Å; S480-K532 PolarHBondContact OG-NZ 3.48Å; K528-K532 WeakPolarHBondContact O-CB 3.18Å; K528-K532 PolarHBondContact O-N 3.21Å; K528-K532 VanDerWaalsContact O-N 3.17Å; L529-K532 PolarHBondContact O-N 2.73Å; L529-K532 VanDerWaalsContact O-N 3.16Å; A530-K532 PolarHBondContact O-N 2.96Å; K532-K535 HydrophobicContact CD-CB 4.35Å; K532-K535 PolarHBondContact O-N 2.9Å; K532-Q536 HydrophobicContact CD-CG 4.43Å; K532-Q536 WeakPolarHBondContact O-CG 3.25Å; K532-Q536 PolarHBondContact O-N 2.99Å
533	F	97.3	Very high	95.1	Very high	1 Å²	1	28.3 Å²	28.3	0%	0.004	14%	0.141	C	C	.	.	H	α-helix	trans	-59	-49.9	170.6	-81.1	-63	0	0	0	111.1	V479 I482 I497 L529 A530 K535 Q536 G537 I551 V554 A555 I569 L625	V479-F533 HydrophobicContact CG1-CD1 3.74Å; V479-F533 HydrophobicContact CG1-CE1 3.93Å; V479-F533 HydrophobicContact CG1-CG 4.28Å; V479-F533 HydrophobicContact CG2-CD1 4.36Å; V479-F533 HydrophobicContact CG2-CE1 3.89Å; V479-F533 HydrophobicContact CG2-CE2 4.22Å; V479-F533 HydrophobicContact CG2-CZ 3.81Å; I482-F533 HydrophobicContact CD1-CE1 4.25Å; I497-F533 HydrophobicContact CD1-CZ 4.47Å; L529-F533 HydrophobicContact CD1-CD2 4.45Å; L529-F533 HydrophobicContact CD1-CE2 3.88Å; L529-F533 HydrophobicContact CD1-CZ 4.42Å; L529-F533 HydrophobicContact CD2-CE2 4.14Å; L529-F533 HydrophobicContact CG-CD2 4.07Å; L529-F533 HydrophobicContact CG-CE2 3.67Å; L529-F533 WeakPolarHBondContact O-CD2 3.37Å; L529-F533 PolarHBondContact O-N 3.26Å; A530-F533 PolarHBondContact O-N 3.02Å; F533-K535 VanDerWaalsContact C-N 3.31Å; F533-K535 PolarHBondContact O-N 3.27Å; F533-Q536 PolarHBondContact O-N 2.86Å; F533-Q536 VanDerWaalsContact O-N 3.13Å; F533-G537 PolarHBondContact O-N 3.23Å; F533-I551 HydrophobicContact CD1-CG2 4.06Å; F533-V554 HydrophobicContact CE1-CG1 4.02Å; F533-V554 HydrophobicContact CZ-CG1 3.93Å; F533-A555 HydrophobicContact CD1-CB 3.95Å; F533-A555 HydrophobicContact CE1-CB 4.01Å; F533-A555 HydrophobicContact CG-CB 4.3Å; F533-A555 HydrophobicContact CZ-CB 4.38Å; F533-I569 HydrophobicContact CB-CD1 4.29Å; F533-I569 HydrophobicContact CB-CG1 4.25Å; F533-I569 HydrophobicContact CD2-CD1 3.7Å; F533-I569 HydrophobicContact CD2-CG1 4.23Å; F533-I569 HydrophobicContact CE2-CD1 4.33Å; F533-I569 HydrophobicContact CG-CD1 4.22Å; F533-L625 VanDerWaalsContact O-CD2 3.26Å; F533-L625 WeakPolarHBondContact O-CD2 3.44Å
534	V	96.9	Very high	95.1	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.018	15%	0.152	C	C	.	.	H	α-helix	trans	-62.9	-39.4	176.7	-178.8	0	0	0	0	111.1	A530 Q536 G537 E538 I569 H572 L573 K576 M622	A530-V534 PolarHBondContact O-N 3.39Å; V534-Q536 VanDerWaalsContact C-N 3.3Å; V534-Q536 PolarHBondContact O-N 3.2Å; V534-G537 WeakPolarHBondContact O-CA 3.41Å; V534-G537 PolarHBondContact O-N 2.89Å; V534-G537 VanDerWaalsContact O-N 3.09Å; V534-E538 WeakPolarHBondContact O-CB 3.4Å; V534-E538 PolarHBondContact O-N 3.38Å; V534-I569 HydrophobicContact CG2-CG2 4.21Å; V534-I569 WeakPolarHBondContact CG2-O 3.49Å; V534-H572 HydrophobicContact CB-CB 4.23Å; V534-H572 HydrophobicContact CG2-CB 3.77Å; V534-L573 HydrophobicContact CG1-CB 4.39Å; V534-L573 HydrophobicContact CG1-CD1 4.32Å; V534-L573 HydrophobicContact CG2-CB 4.04Å; V534-K576 HydrophobicContact CG1-CD 3.94Å; V534-M622 HydrophobicContact CG1-SD 3.97Å
535	K	95.9	Very high	95.2	Very high	81 Å²	81	34.5 Å²	34.5	35%	0.352	17%	0.17	S	C	.	.	H	α-helix	trans	-63.1	-30.5	175.1	-173.6	168.1	178.6	164.5	0	113.4	E531 K532 F533 E538 E539	E531-K535 VanDerWaalsContact O-CB 3.27Å; E531-K535 WeakPolarHBondContact O-CB 3.31Å; E531-K535 PolarHBondContact O-N 3.37Å; K532-K535 HydrophobicContact CD-CB 4.35Å; K532-K535 PolarHBondContact O-N 2.9Å; F533-K535 VanDerWaalsContact C-N 3.31Å; F533-K535 PolarHBondContact O-N 3.27Å; K535-E538 WeakPolarHBondContact O-CB 3.48Å; K535-E538 PolarHBondContact O-N 3.28Å; K535-E539 WeakPolarHBondContact CE-OE1 3.35Å; K535-E539 WeakPolarHBondContact CE-OE2 3.19Å; K535-E539 IonicContact NZ-OE1 3.15Å; K535-E539 PolarHBondContact NZ-OE1 3.41Å; K535-E539 IonicContact NZ-OE2 3.6Å; K535-E539 PolarHBondContact O-N 3.41Å; K535-E539 VanDerWaalsContact O-N 3.07Å
536	Q	95.6	Very high	95.1	Very high	16 Å²	16	39 Å²	39	8%	0.075	19%	0.191	C	C	.	.	H	α-helix	trans	-70.3	-37.4	170.5	-66.9	-63.4	60.9	0	0	112.4	V479 K532 F533 V534 E538 E539 E540 V541 I551	V479-Q536 HydrophobicContact CG1-CG 3.8Å; V479-Q536 PolarHBondContact O-NE2 2.91Å; K532-Q536 HydrophobicContact CD-CG 4.43Å; K532-Q536 WeakPolarHBondContact O-CG 3.25Å; K532-Q536 PolarHBondContact O-N 2.99Å; F533-Q536 PolarHBondContact O-N 2.86Å; F533-Q536 VanDerWaalsContact O-N 3.13Å; V534-Q536 VanDerWaalsContact C-N 3.3Å; V534-Q536 PolarHBondContact O-N 3.2Å; Q536-E538 PolarHBondContact O-N 2.91Å; Q536-E539 PolarHBondContact O-N 3.34Å; Q536-E540 WeakPolarHBondContact O-CB 3.43Å; Q536-E540 PolarHBondContact O-N 3.4Å; Q536-V541 PolarHBondContact O-N 2.75Å; Q536-I551 HydrophobicContact CB-CD1 3.94Å; Q536-I551 HydrophobicContact CB-CG2 4.3Å; Q536-I551 HydrophobicContact CG-CD1 4.46Å
537	G	95.6	Very high	95.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.7	-40.4	169.1	0	0	0	0	0	111.7	F533 V534 A542 G621 M622	F533-G537 PolarHBondContact O-N 3.23Å; V534-G537 WeakPolarHBondContact O-CA 3.41Å; V534-G537 PolarHBondContact O-N 2.89Å; V534-G537 VanDerWaalsContact O-N 3.09Å; G537-A542 PolarHBondContact O-N 3.2Å; G537-G621 CarbonylContact O-C 3.56Å; G537-G621 WeakPolarHBondContact O-CA 3.42Å; G537-M622 PolarHBondContact O-N 3.28Å
538	E	94.9	Very high	95.2	Very high	10 Å²	10	37.3 Å²	37.3	5%	0.047	19%	0.185	C	C	.	.	H	α-helix	trans	-69.9	-32.4	-177.8	-161.1	-179.2	-179	0	0	114.5	V534 K535 Q536 A542 K576 R603 R618 M622	V534-E538 WeakPolarHBondContact O-CB 3.4Å; V534-E538 PolarHBondContact O-N 3.38Å; K535-E538 WeakPolarHBondContact O-CB 3.48Å; K535-E538 PolarHBondContact O-N 3.28Å; Q536-E538 PolarHBondContact O-N 2.91Å; E538-A542 WeakPolarHBondContact O-CB 3.47Å; E538-K576 WeakPolarHBondContact OE2-CE 3.39Å; E538-K576 IonicContact OE2-NZ 3.9Å; E538-K576 PolarHBondContact OE2-NZ 2.94Å; E538-R603 IonicContact OE1-CZ 2.66Å; E538-R603 IonicContact OE1-NE 2.68Å; E538-R603 PolarHBondContact OE1-NE 3.35Å; E538-R603 VanDerWaalsContact OE1-NE 3.1Å; E538-R603 IonicContact OE1-NH2 3.89Å; E538-R603 PolarHBondContact OE1-NH2 3.42Å; E538-R603 IonicContact OE2-NH2 2.7Å; E538-R603 PolarHBondContact OE2-NH2 2.93Å; E538-R618 HydrophobicContact CB-CG 4.41Å; E538-R618 HydrophobicContact CG-CG 3.28Å; E538-R618 WeakPolarHBondContact OE1-CD 3.49Å; E538-R618 IonicContact OE1-CZ 3.22Å; E538-R618 IonicContact OE1-NE 2.65Å; E538-R618 IonicContact OE1-NH1 3.15Å; E538-R618 PolarHBondContact OE1-NH1 2.9Å; E538-M622 HydrophobicContact CB-CG 4.15Å; E538-M622 HydrophobicContact CB-SD 4.22Å; E538-M622 HydrophobicContact CG-CE 4.31Å; E538-M622 HydrophobicContact CG-SD 4.23Å
539	E	93.8	Very high	95.2	Very high	72 Å²	72	35.9 Å²	35.9	34%	0.336	18%	0.179	S	C	.	.	H	α-helix	trans	-119	-54.4	-170.2	-66.5	174.3	171.1	0	0	112.7	K535 Q536 S543 R603	K535-E539 WeakPolarHBondContact CE-OE1 3.35Å; K535-E539 WeakPolarHBondContact CE-OE2 3.19Å; K535-E539 IonicContact NZ-OE1 3.15Å; K535-E539 PolarHBondContact NZ-OE1 3.41Å; K535-E539 IonicContact NZ-OE2 3.6Å; K535-E539 PolarHBondContact O-N 3.41Å; K535-E539 VanDerWaalsContact O-N 3.07Å; Q536-E539 PolarHBondContact O-N 3.34Å; E539-S543 PolarHBondContact O-OG 3.19Å; E539-R603 IonicContact OE1-NH2 3.45Å; E539-R603 PolarHBondContact OE1-NH2 3.21Å
540	E	94.3	Very high	95.2	Very high	78 Å²	78	35.9 Å²	35.9	36%	0.364	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-53.4	-177.5	-175.7	64.3	-155	0	0	111	Q536 A542 S543 H544 A547 I551	Q536-E540 WeakPolarHBondContact O-CB 3.43Å; Q536-E540 PolarHBondContact O-N 3.4Å; E540-A542 VanDerWaalsContact C-N 3.25Å; E540-A542 PolarHBondContact O-N 3.15Å; E540-S543 PolarHBondContact O-N 3.44Å; E540-H544 PolarHBondContact O-N 3.06Å; E540-H544 IonicContact OE1-CD2 3.43Å; E540-H544 PolarHBondContact OE1-CD2 2.73Å; E540-A547 HydrophobicContact CG-CB 3.92Å; E540-I551 HydrophobicContact CG-CD1 4.43Å
541	V	96	Very high	95.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-26.1	-177	-174.6	0	0	0	0	112.1	Q536 S543 H544 H545 A547 A548 I551 G621 R624	Q536-V541 PolarHBondContact O-N 2.75Å; V541-S543 PolarHBondContact O-N 2.77Å; V541-H544 CarbonylContact O-C 3.58Å; V541-H545 PolarHBondContact O-CD2 3.29Å; V541-H545 PolarHBondContact O-N 2.53Å; V541-A547 HydrophobicContact CG2-CB 4.3Å; V541-A548 HydrophobicContact CG1-CB 3.7Å; V541-A548 HydrophobicContact CG2-CB 4.48Å; V541-I551 HydrophobicContact CG2-CD1 3.99Å; V541-G621 WeakPolarHBondContact CG1-O 3.35Å; V541-R624 HydrophobicContact CG1-CB 3.91Å
542	A	94.2	Very high	95.1	Very high	15 Å²	15	33.1 Å²	33.1	12%	0.124	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-20.5	171.9	0	0	0	0	0	113.4	G537 E538 E540 K617	G537-A542 PolarHBondContact O-N 3.2Å; E538-A542 WeakPolarHBondContact O-CB 3.47Å; E540-A542 VanDerWaalsContact C-N 3.25Å; E540-A542 PolarHBondContact O-N 3.15Å; A542-K617 VanDerWaalsContact CB-O 3.25Å; A542-K617 WeakPolarHBondContact CB-O 3.42Å
543	S	92.5	Very high	95	Very high	83 Å²	83	31.7 Å²	31.7	58%	0.58	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104	-37	178.6	-53	0	0	0	0	112	E539 E540 V541	E539-S543 PolarHBondContact O-OG 3.19Å; E540-S543 PolarHBondContact O-N 3.44Å; V541-S543 PolarHBondContact O-N 2.77Å
544	H	92.9	Very high	94.9	Very high	117 Å²	117	31.7 Å²	31.7	54%	0.542	16%	0.16	S	C	.	.			trans	-132.1	85.6	-175	-63.5	-44.1	0	0	0	109.7	E540 V541 E546 A547	E540-H544 PolarHBondContact O-N 3.06Å; E540-H544 IonicContact OE1-CD2 3.43Å; E540-H544 PolarHBondContact OE1-CD2 2.73Å; V541-H544 CarbonylContact O-C 3.58Å; H544-E546 PolarHBondContact O-N 2.93Å; H544-A547 VanDerWaalsContact O-CB 3.29Å; H544-A547 WeakPolarHBondContact O-CB 3.16Å; H544-A547 PolarHBondContact O-N 3.44Å
545	H	94.6	Very high	94.8	Very high	78 Å²	78	31.7 Å²	31.7	36%	0.361	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-53.1	-30.3	-173.8	-58.6	176.1	0	0	0	113.8	V541 A547 A548 R624	V541-H545 PolarHBondContact O-CD2 3.29Å; V541-H545 PolarHBondContact O-N 2.53Å; H545-A547 VanDerWaalsContact C-N 3.27Å; H545-A547 PolarHBondContact O-N 3.04Å; H545-A548 VanDerWaalsContact O-CB 3.24Å; H545-A548 WeakPolarHBondContact O-CB 3.46Å; H545-A548 PolarHBondContact O-N 3.08Å; H545-R624 PolarHBondContact ND1-NH1 3.22Å; H545-R624 PolarHBondContact ND1-NH2 3.38Å
546	E	92.9	Very high	94.7	Very high	95 Å²	95	28 Å²	28	44%	0.444	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-69.2	-21.7	-179.8	-58.1	-170.3	170.8	0	0	113.2	H544 A548 F549 P550 K737	H544-E546 PolarHBondContact O-N 2.93Å; E546-A548 PolarHBondContact O-N 3.1Å; E546-F549 PolarHBondContact O-N 3.45Å; E546-P550 WeakPolarHBondContact O-CD 3.43Å; E546-K737 HydrophobicContact CG-CB 4.36Å; E546-K737 WeakPolarHBondContact OE1-CB 3.46Å
547	A	94.7	Very high	94.6	Very high	11 Å²	11	27.2 Å²	27.2	9%	0.091	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-65.8	-16.7	174.1	0	0	0	0	0	113	E540 V541 H544 H545 F549 P550 I551	E540-A547 HydrophobicContact CG-CB 3.92Å; V541-A547 HydrophobicContact CG2-CB 4.3Å; H544-A547 VanDerWaalsContact O-CB 3.29Å; H544-A547 WeakPolarHBondContact O-CB 3.16Å; H544-A547 PolarHBondContact O-N 3.44Å; H545-A547 VanDerWaalsContact C-N 3.27Å; H545-A547 PolarHBondContact O-N 3.04Å; A547-F549 PolarHBondContact O-N 3.32Å; A547-P550 VanDerWaalsContact O-CD 3.31Å; A547-P550 WeakPolarHBondContact O-CD 3.44Å; A547-I551 HydrophobicContact CB-CD1 4.04Å; A547-I551 WeakPolarHBondContact O-CB 3.35Å; A547-I551 VanDerWaalsContact O-CD1 3.32Å; A547-I551 WeakPolarHBondContact O-CD1 3.43Å; A547-I551 WeakPolarHBondContact O-CG1 3.28Å; A547-I551 PolarHBondContact O-N 2.84Å
548	A	96.4	Very high	94.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-53.7	-35.4	175.2	0	0	0	0	0	113	V541 H545 E546 G552 A628	V541-A548 HydrophobicContact CG1-CB 3.7Å; V541-A548 HydrophobicContact CG2-CB 4.48Å; H545-A548 VanDerWaalsContact O-CB 3.24Å; H545-A548 WeakPolarHBondContact O-CB 3.46Å; H545-A548 PolarHBondContact O-N 3.08Å; E546-A548 PolarHBondContact O-N 3.1Å; A548-G552 WeakPolarHBondContact O-CA 3.48Å; A548-G552 PolarHBondContact O-N 3.48Å; A548-A628 HydrophobicContact CB-CB 4.06Å; A548-A628 VanDerWaalsContact O-CB 3.29Å; A548-A628 WeakPolarHBondContact O-CB 3.49Å
549	F	95.4	Very high	94.4	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.009	14%	0.142	C	C	.	.	H	α-helix	trans	-75.9	-53.3	-173.4	-60.2	-84.4	0	0	0	114.2	E546 A547 I551 G552 V553 L632 V677 P736 K737 G738 L740	E546-F549 PolarHBondContact O-N 3.45Å; A547-F549 PolarHBondContact O-N 3.32Å; F549-I551 VanDerWaalsContact C-N 3.3Å; F549-I551 PolarHBondContact O-N 3.32Å; F549-G552 PolarHBondContact O-N 2.79Å; F549-V553 PolarHBondContact O-N 3.04Å; F549-L632 HydrophobicContact CB-CD1 4.26Å; F549-L632 HydrophobicContact CD1-CD1 3.94Å; F549-L632 HydrophobicContact CD1-CD2 4.38Å; F549-L632 WeakPolarHBondContact O-CD1 3.32Å; F549-V677 HydrophobicContact CE1-CG1 4.25Å; F549-V677 HydrophobicContact CZ-CG1 3.92Å; F549-V677 HydrophobicContact CZ-CG2 4.48Å; F549-P736 HydrophobicContact CE1-CB 4.2Å; F549-P736 HydrophobicContact CE1-CG 3.6Å; F549-P736 HydrophobicContact CE2-CB 4.17Å; F549-P736 HydrophobicContact CE2-CG 4.4Å; F549-P736 HydrophobicContact CZ-CB 3.47Å; F549-P736 VanDerWaalsContact CZ-CB 3.47Å; F549-P736 HydrophobicContact CZ-CG 3.41Å; F549-P736 VanDerWaalsContact CZ-CG 3.41Å; F549-K737 WeakPolarHBondContact CE2-O 3.41Å; F549-G738 WeakPolarHBondContact CB-O 3.38Å; F549-G738 WeakPolarHBondContact CD2-O 3.39Å; F549-G738 WeakPolarHBondContact CG-O 3.41Å; F549-L740 HydrophobicContact CB-CD2 4.3Å; F549-L740 HydrophobicContact CB-CG 4Å
550	P	95.5	Very high	94.3	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-65.4	-32.1	176.1	27.6	-36.1	0	0	0	112.6	I482 T484 L490 E546 A547 V554 L740	I482-P550 HydrophobicContact CG2-CB 3.76Å; I482-P550 HydrophobicContact CG2-CG 4.2Å; T484-P550 HydrophobicContact CG2-CG 3.88Å; L490-P550 HydrophobicContact CD1-CB 4.09Å; L490-P550 HydrophobicContact CD2-CB 4.16Å; E546-P550 WeakPolarHBondContact O-CD 3.43Å; A547-P550 VanDerWaalsContact O-CD 3.31Å; A547-P550 WeakPolarHBondContact O-CD 3.44Å; P550-V554 WeakPolarHBondContact O-CG2 3.49Å; P550-V554 PolarHBondContact O-N 3.44Å; P550-L740 HydrophobicContact CB-CD2 4.37Å
551	I	96.3	Very high	94.1	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-73.6	-44.9	176.6	-57.7	169.3	0	0	0	110.4	I482 F533 Q536 E540 V541 A547 F549 V554 A555 L625	I482-I551 HydrophobicContact CB-CG1 4.15Å; I482-I551 HydrophobicContact CD1-CG1 4.42Å; I482-I551 HydrophobicContact CG2-CB 4.39Å; I482-I551 HydrophobicContact CG2-CG1 3.53Å; F533-I551 HydrophobicContact CD1-CG2 4.06Å; Q536-I551 HydrophobicContact CB-CD1 3.94Å; Q536-I551 HydrophobicContact CB-CG2 4.3Å; Q536-I551 HydrophobicContact CG-CD1 4.46Å; E540-I551 HydrophobicContact CG-CD1 4.43Å; V541-I551 HydrophobicContact CG2-CD1 3.99Å; A547-I551 HydrophobicContact CB-CD1 4.04Å; A547-I551 WeakPolarHBondContact O-CB 3.35Å; A547-I551 VanDerWaalsContact O-CD1 3.32Å; A547-I551 WeakPolarHBondContact O-CD1 3.43Å; A547-I551 WeakPolarHBondContact O-CG1 3.28Å; A547-I551 PolarHBondContact O-N 2.84Å; F549-I551 VanDerWaalsContact C-N 3.3Å; F549-I551 PolarHBondContact O-N 3.32Å; I551-V554 PolarHBondContact O-N 2.86Å; I551-A555 WeakPolarHBondContact O-CB 3.2Å; I551-A555 PolarHBondContact O-N 3.47Å; I551-L625 HydrophobicContact CB-CD1 4.03Å; I551-L625 HydrophobicContact CG2-CD1 3.74Å; I551-L625 HydrophobicContact CG2-CD2 4.37Å
552	G	95.2	Very high	93.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-65.6	-37.2	-179.5	0	0	0	0	0	113.9	A548 F549 A555 S556	A548-G552 WeakPolarHBondContact O-CA 3.48Å; A548-G552 PolarHBondContact O-N 3.48Å; F549-G552 PolarHBondContact O-N 2.79Å; G552-A555 PolarHBondContact O-N 2.96Å; G552-S556 VanDerWaalsContact O-CB 3.28Å; G552-S556 WeakPolarHBondContact O-CB 3.38Å; G552-S556 PolarHBondContact O-N 2.98Å
553	V	93.8	Very high	93.8	Very high	2 Å²	2	29 Å²	29	1%	0.012	16%	0.155	C	C	.	.	H	α-helix	trans	-71	-35	177.6	77.3	0	0	0	0	112.4	L490 F549 G557 L632 R633 W634 L740 W745	L490-V553 HydrophobicContact CD2-CG1 3.75Å; F549-V553 PolarHBondContact O-N 3.04Å; V553-G557 PolarHBondContact O-N 2.89Å; V553-L632 HydrophobicContact CB-CB 4.13Å; V553-L632 HydrophobicContact CB-CD1 4.11Å; V553-L632 HydrophobicContact CG2-CB 4.16Å; V553-R633 VanDerWaalsContact CG2-O 3.32Å; V553-R633 WeakPolarHBondContact CG2-O 3.42Å; V553-W634 HydrophobicContact CG1-CE3 4.36Å; V553-W634 HydrophobicContact CG1-CZ3 4.25Å; V553-W634 HydrophobicContact CG2-CE3 4.16Å; V553-L740 HydrophobicContact CB-CD1 4.29Å; V553-L740 HydrophobicContact CG1-CD1 3.66Å; V553-W745 HydrophobicContact CG1-CH2 3.85Å; V553-W745 HydrophobicContact CG1-CZ2 4.17Å; V553-W745 HydrophobicContact CG2-CH2 4.16Å; V553-W745 HydrophobicContact CG2-CZ2 4.12Å
554	V	95	Very high	93.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-68.2	-46.8	173.1	170.6	0	0	0	0	110.3	I482 L490 F494 I497 F533 P550 I551 S556 G557 I558 W634	I482-V554 HydrophobicContact CD1-CB 4.19Å; I482-V554 HydrophobicContact CD1-CG1 4.11Å; I482-V554 HydrophobicContact CD1-CG2 4.36Å; L490-V554 HydrophobicContact CD1-CG2 3.51Å; L490-V554 HydrophobicContact CD2-CG2 4.17Å; L490-V554 HydrophobicContact CG-CG2 3.71Å; F494-V554 HydrophobicContact CD2-CG1 4.2Å; I497-V554 HydrophobicContact CD1-CG1 4.19Å; F533-V554 HydrophobicContact CE1-CG1 4.02Å; F533-V554 HydrophobicContact CZ-CG1 3.93Å; P550-V554 WeakPolarHBondContact O-CG2 3.49Å; P550-V554 PolarHBondContact O-N 3.44Å; I551-V554 PolarHBondContact O-N 2.86Å; V554-S556 PolarHBondContact O-N 3.19Å; V554-G557 PolarHBondContact O-N 3.49Å; V554-I558 HydrophobicContact CG1-CG1 4.31Å; V554-I558 WeakPolarHBondContact O-CG1 3.5Å; V554-I558 PolarHBondContact O-N 2.97Å; V554-W634 HydrophobicContact CG2-CH2 4.46Å; V554-W634 HydrophobicContact CG2-CZ3 3.86Å
555	A	95.6	Very high	93.8	Very high	3 Å²	3	24.3 Å²	24.3	3%	0.025	13%	0.125	C	C	.	.	H	α-helix	trans	-58.8	-44.6	176.3	0	0	0	0	0	112.3	F533 I551 G552 I558 W559 I569 V629	F533-A555 HydrophobicContact CD1-CB 3.95Å; F533-A555 HydrophobicContact CE1-CB 4.01Å; F533-A555 HydrophobicContact CG-CB 4.3Å; F533-A555 HydrophobicContact CZ-CB 4.38Å; I551-A555 WeakPolarHBondContact O-CB 3.2Å; I551-A555 PolarHBondContact O-N 3.47Å; G552-A555 PolarHBondContact O-N 2.96Å; A555-I558 PolarHBondContact O-N 3.27Å; A555-W559 WeakPolarHBondContact O-CB 3.4Å; A555-W559 PolarHBondContact O-N 3.37Å; A555-I569 HydrophobicContact CB-CD1 4.38Å; A555-V629 HydrophobicContact CB-CG2 4.04Å
556	S	93.8	Very high	93.8	Very high	3 Å²	3	20.6 Å²	20.6	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-58.8	-46.7	174.7	176.8	0	0	0	0	112.5	G552 V554 W559 E560 L632	G552-S556 VanDerWaalsContact O-CB 3.28Å; G552-S556 WeakPolarHBondContact O-CB 3.38Å; G552-S556 PolarHBondContact O-N 2.98Å; V554-S556 PolarHBondContact O-N 3.19Å; S556-W559 WeakPolarHBondContact O-CB 3.46Å; S556-W559 PolarHBondContact O-N 3.47Å; S556-E560 PolarHBondContact O-N 3.45Å; S556-L632 WeakPolarHBondContact CB-O 3.34Å; S556-L632 PolarHBondContact OG-O 2.9Å
557	G	92.4	Very high	93.8	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-67.3	-37.8	177.7	0	0	0	0	0	114.1	V553 V554 W559 E560 L561	V553-G557 PolarHBondContact O-N 2.89Å; V554-G557 PolarHBondContact O-N 3.49Å; G557-W559 VanDerWaalsContact C-N 3.29Å; G557-W559 PolarHBondContact O-N 3.48Å; G557-E560 PolarHBondContact O-N 2.87Å; G557-L561 PolarHBondContact O-N 3.14Å
558	I	94	Very high	93.8	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-66.9	-34.1	175.9	-68.4	-60.6	0	0	0	110.5	F494 I497 D498 L501 L529 V554 A555 L561 H562 V565	F494-I558 HydrophobicContact CD2-CD1 4.01Å; F494-I558 HydrophobicContact CD2-CG1 4.13Å; F494-I558 HydrophobicContact CE2-CD1 3.71Å; F494-I558 HydrophobicContact CE2-CG1 3.84Å; F494-I558 HydrophobicContact CZ-CD1 4.02Å; I497-I558 HydrophobicContact CB-CD1 4.1Å; I497-I558 HydrophobicContact CG2-CD1 3.68Å; I497-I558 HydrophobicContact CG2-CG1 4.03Å; D498-I558 HydrophobicContact CB-CD1 4.4Å; L501-I558 HydrophobicContact CD1-CD1 4.49Å; L501-I558 HydrophobicContact CD1-CG2 3.69Å; L529-I558 HydrophobicContact CD2-CG2 4.31Å; V554-I558 HydrophobicContact CG1-CG1 4.31Å; V554-I558 WeakPolarHBondContact O-CG1 3.5Å; V554-I558 PolarHBondContact O-N 2.97Å; A555-I558 PolarHBondContact O-N 3.27Å; I558-L561 PolarHBondContact O-N 3.05Å; I558-H562 WeakPolarHBondContact O-CA 3.36Å; I558-H562 WeakPolarHBondContact O-CB 3.39Å; I558-H562 PolarHBondContact O-N 3.42Å; I558-V565 HydrophobicContact CG2-CB 4.26Å; I558-V565 HydrophobicContact CG2-CG1 3.95Å
559	W	93.9	Very high	93.8	Very high	12 Å²	12	19.8 Å²	19.8	5%	0.045	10%	0.104	C	C	.	.	H	α-helix	trans	-64.6	-40.7	171.7	-159.3	-24.5	0	0	0	112.4	A555 S556 G557 L561 G566 L570 V629 P644 H645	A555-W559 WeakPolarHBondContact O-CB 3.4Å; A555-W559 PolarHBondContact O-N 3.37Å; S556-W559 WeakPolarHBondContact O-CB 3.46Å; S556-W559 PolarHBondContact O-N 3.47Å; G557-W559 VanDerWaalsContact C-N 3.29Å; G557-W559 PolarHBondContact O-N 3.48Å; W559-L561 PolarHBondContact O-N 3.06Å; W559-G566 VanDerWaalsContact CD2-CA 3.44Å; W559-G566 VanDerWaalsContact CE2-CA 3.46Å; W559-L570 HydrophobicContact CH2-CD1 3.59Å; W559-L570 HydrophobicContact CH2-CD2 3.72Å; W559-L570 HydrophobicContact CH2-CG 3.41Å; W559-L570 VanDerWaalsContact CH2-CG 3.41Å; W559-L570 HydrophobicContact CZ2-CD1 3.72Å; W559-L570 HydrophobicContact CZ2-CG 3.92Å; W559-L570 HydrophobicContact CZ3-CD2 4.41Å; W559-L570 HydrophobicContact CZ3-CG 4.36Å; W559-V629 HydrophobicContact CE3-CG1 3.97Å; W559-V629 HydrophobicContact CZ3-CG1 3.82Å; W559-P644 VanDerWaalsContact CD1-CB 3.45Å; W559-P644 HydrophobicContact CD2-CB 4.36Å; W559-P644 HydrophobicContact CG-CB 3.99Å; W559-P644 HydrophobicContact CG-CG 4.2Å; W559-H645 HydrophobicContact CD2-CB 4.39Å; W559-H645 HydrophobicContact CE3-CB 4.25Å; W559-H645 HydrophobicContact CH2-CB 3.22Å; W559-H645 AromaticContact CH2-CD2 3.66Å; W559-H645 AromaticContact CH2-CG 3.31Å; W559-H645 AromaticContact CH2-ND1 3.92Å; W559-H645 HydrophobicContact CZ2-CB 3.43Å; W559-H645 VanDerWaalsContact CZ2-CB 3.43Å; W559-H645 AromaticContact CZ2-CG 3.86Å; W559-H645 HydrophobicContact CZ3-CB 3.69Å; W559-H645 AromaticContact CZ3-CD2 3.99Å; W559-H645 AromaticContact CZ3-CG 3.96Å
560	E	91.1	Very high	93.7	Very high	17 Å²	17	19.8 Å²	19.8	8%	0.079	10%	0.104	C	C	.	.	H	α-helix	trans	-67.1	-22.2	178.3	-172.7	172.8	171.2	0	0	113.4	S556 G557 R633 K639 P644	S556-E560 PolarHBondContact O-N 3.45Å; G557-E560 PolarHBondContact O-N 2.87Å; E560-R633 VanDerWaalsContact CD-NH2 3.32Å; E560-R633 IonicContact OE1-CZ 2.77Å; E560-R633 IonicContact OE1-NE 2.82Å; E560-R633 IonicContact OE1-NH2 3.51Å; E560-R633 PolarHBondContact OE1-NH2 3.23Å; E560-R633 IonicContact OE2-CZ 3.22Å; E560-R633 IonicContact OE2-NE 2.93Å; E560-R633 PolarHBondContact OE2-NE 3.47Å; E560-R633 IonicContact OE2-NH2 3.67Å; E560-R633 PolarHBondContact OE2-NH2 3.4Å; E560-K639 HydrophobicContact CG-CD 4.47Å; E560-K639 PolarHBondContact O-NZ 3.44Å; E560-K639 WeakPolarHBondContact OE1-CB 3.45Å; E560-P644 HydrophobicContact CB-CG 4.42Å
561	L	90.4	Very high	93.6	Very high	70 Å²	70	19.9 Å²	19.9	37%	0.366	11%	0.105	S	C	.	.	H	α-helix	trans	-94.6	-42.8	173.5	-63.2	-176.9	0	0	0	113	F494 D498 G557 I558 W559	F494-L561 HydrophobicContact CE1-CD1 3.77Å; F494-L561 HydrophobicContact CZ-CD1 3.64Å; F494-L561 HydrophobicContact CZ-CG 4.44Å; D498-L561 HydrophobicContact CB-CD1 4.42Å; D498-L561 WeakPolarHBondContact OD1-CD1 3.35Å; G557-L561 PolarHBondContact O-N 3.14Å; I558-L561 PolarHBondContact O-N 3.05Å; W559-L561 PolarHBondContact O-N 3.06Å
562	H	91.9	Very high	93.6	Very high	39 Å²	39	20.7 Å²	20.7	18%	0.181	11%	0.109	C	C	.	.			trans	-129.4	78.3	-170.7	-56.1	-83.2	0	0	0	111.2	D498 L501 I558 Q564 V565	D498-H562 IonicContact OD1-CD2 2.7Å; D498-H562 IonicContact OD1-CE1 3.4Å; D498-H562 IonicContact OD1-NE2 3.57Å; D498-H562 PolarHBondContact OD1-NE2 3.19Å; L501-H562 HydrophobicContact CD1-CB 4.24Å; I558-H562 WeakPolarHBondContact O-CA 3.36Å; I558-H562 WeakPolarHBondContact O-CB 3.39Å; I558-H562 PolarHBondContact O-N 3.42Å; H562-Q564 VanDerWaalsContact C-N 3.29Å; H562-Q564 PolarHBondContact O-N 3.5Å; H562-Q564 VanDerWaalsContact O-N 3.13Å; H562-V565 HydrophobicContact CB-CB 4.43Å; H562-V565 HydrophobicContact CB-CG2 3.83Å; H562-V565 WeakPolarHBondContact O-CB 3.33Å; H562-V565 PolarHBondContact O-N 3.12Å
563	P	91.5	Very high	93.5	Very high	73 Å²	73	21 Å²	21	47%	0.474	11%	0.111	S	C	.	.	H	α-helix	trans	-55.3	-36.5	-170.7	-29.7	36.8	0	0	0	115.5	V565 G566 D567	P563-V565 PolarHBondContact O-N 3.41Å; P563-G566 WeakPolarHBondContact O-CA 3.45Å; P563-G566 PolarHBondContact O-N 2.95Å; P563-D567 PolarHBondContact O-N 2.96Å; P563-D567 VanDerWaalsContact O-N 3.08Å
564	Q	91.3	Very high	93.4	Very high	100 Å²	100	21 Å²	21	47%	0.467	11%	0.11	S	C	.	.	H	α-helix	trans	-54.6	-35.1	175.6	-173.2	-175.6	14	0	0	112.9	H562 G566 L568	H562-Q564 VanDerWaalsContact C-N 3.29Å; H562-Q564 PolarHBondContact O-N 3.5Å; H562-Q564 VanDerWaalsContact O-N 3.13Å; Q564-G566 VanDerWaalsContact C-N 3.32Å; Q564-L568 HydrophobicContact CG-CD1 4.36Å; Q564-L568 WeakPolarHBondContact O-CB 3.34Å; Q564-L568 VanDerWaalsContact O-CG 3.25Å; Q564-L568 WeakPolarHBondContact O-CG 3.28Å; Q564-L568 PolarHBondContact O-N 3.36Å; Q564-L568 VanDerWaalsContact O-N 3.1Å
565	V	94.3	Very high	93.2	Very high	3 Å²	3	27.7 Å²	27.7	2%	0.018	14%	0.139	C	C	.	.	H	α-helix	trans	-67.1	-37.3	176.2	-178.2	0	0	0	0	110.5	L501 A526 L529 I558 H562 P563 L568 I569	L501-V565 HydrophobicContact CD1-CG2 4.03Å; L501-V565 HydrophobicContact CD2-CG2 3.87Å; A526-V565 HydrophobicContact CB-CG2 3.96Å; L529-V565 HydrophobicContact CD2-CG1 3.93Å; L529-V565 HydrophobicContact CG-CG1 4.46Å; I558-V565 HydrophobicContact CG2-CB 4.26Å; I558-V565 HydrophobicContact CG2-CG1 3.95Å; H562-V565 HydrophobicContact CB-CB 4.43Å; H562-V565 HydrophobicContact CB-CG2 3.83Å; H562-V565 WeakPolarHBondContact O-CB 3.33Å; H562-V565 PolarHBondContact O-N 3.12Å; P563-V565 PolarHBondContact O-N 3.41Å; V565-L568 PolarHBondContact O-N 3.08Å; V565-I569 HydrophobicContact CG1-CD1 4.13Å; V565-I569 VanDerWaalsContact O-CG1 3.26Å; V565-I569 WeakPolarHBondContact O-CG1 3.15Å; V565-I569 PolarHBondContact O-N 3.08Å
566	G	93.4	Very high	92.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-67.4	-43.4	177.3	0	0	0	0	0	113.5	W559 P563 Q564 L568 I569 L570	W559-G566 VanDerWaalsContact CD2-CA 3.44Å; W559-G566 VanDerWaalsContact CE2-CA 3.46Å; P563-G566 WeakPolarHBondContact O-CA 3.45Å; P563-G566 PolarHBondContact O-N 2.95Å; Q564-G566 VanDerWaalsContact C-N 3.32Å; G566-L568 VanDerWaalsContact C-N 3.3Å; G566-L568 PolarHBondContact O-N 2.56Å; G566-I569 WeakPolarHBondContact O-CB 3.5Å; G566-I569 PolarHBondContact O-N 3.23Å; G566-I569 VanDerWaalsContact O-N 3.11Å; G566-L570 PolarHBondContact O-N 2.92Å
567	D	93.8	Very high	92.8	Very high	69 Å²	69	29.8 Å²	29.8	37%	0.369	15%	0.147	S	C	.	.	H	α-helix	trans	-61.7	-40.1	174	-63.8	-32	0	0	0	111.1	L442 P563 L570 A571	L442-D567 HydrophobicContact CD1-CB 3.94Å; L442-D567 WeakPolarHBondContact CD1-O 3.36Å; P563-D567 PolarHBondContact O-N 2.96Å; P563-D567 VanDerWaalsContact O-N 3.08Å; D567-L570 PolarHBondContact O-N 3.15Å; D567-A571 WeakPolarHBondContact O-CB 3.45Å; D567-A571 PolarHBondContact O-N 3.47Å
568	L	95.1	Very high	92.6	Very high	6 Å²	6	30.2 Å²	30.2	3%	0.031	15%	0.15	C	C	.	.	H	α-helix	trans	-66.5	-36	172.7	-68.6	170.1	0	0	0	112.6	A446 C449 A526 Y527 A530 Q564 V565 G566 A571 H572	A446-L568 HydrophobicContact CB-CD2 3.87Å; C449-L568 HydrophobicContact CB-CD2 4.1Å; A526-L568 HydrophobicContact CB-CD1 4.1Å; Y527-L568 HydrophobicContact CD2-CD2 4.11Å; A530-L568 HydrophobicContact CB-CB 3.55Å; Q564-L568 HydrophobicContact CG-CD1 4.36Å; Q564-L568 WeakPolarHBondContact O-CB 3.34Å; Q564-L568 VanDerWaalsContact O-CG 3.25Å; Q564-L568 WeakPolarHBondContact O-CG 3.28Å; Q564-L568 PolarHBondContact O-N 3.36Å; Q564-L568 VanDerWaalsContact O-N 3.1Å; V565-L568 PolarHBondContact O-N 3.08Å; G566-L568 VanDerWaalsContact C-N 3.3Å; G566-L568 PolarHBondContact O-N 2.56Å; L568-A571 PolarHBondContact O-N 2.96Å; L568-H572 WeakPolarHBondContact O-CB 3.33Å; L568-H572 PolarHBondContact O-CD2 2.79Å; L568-H572 PolarHBondContact O-N 2.9Å
569	I	95.8	Very high	92.4	Very high	13 Å²	13	30.3 Å²	30.3	7%	0.067	15%	0.151	C	C	.	.	H	α-helix	trans	-61.4	-48.2	173.5	-74.7	164.1	0	0	0	109.7	A530 F533 V534 A555 V565 G566 H572 L573	A530-I569 HydrophobicContact CB-CG1 3.74Å; F533-I569 HydrophobicContact CB-CD1 4.29Å; F533-I569 HydrophobicContact CB-CG1 4.25Å; F533-I569 HydrophobicContact CD2-CD1 3.7Å; F533-I569 HydrophobicContact CD2-CG1 4.23Å; F533-I569 HydrophobicContact CE2-CD1 4.33Å; F533-I569 HydrophobicContact CG-CD1 4.22Å; V534-I569 HydrophobicContact CG2-CG2 4.21Å; V534-I569 WeakPolarHBondContact CG2-O 3.49Å; A555-I569 HydrophobicContact CB-CD1 4.38Å; V565-I569 HydrophobicContact CG1-CD1 4.13Å; V565-I569 VanDerWaalsContact O-CG1 3.26Å; V565-I569 WeakPolarHBondContact O-CG1 3.15Å; V565-I569 PolarHBondContact O-N 3.08Å; G566-I569 WeakPolarHBondContact O-CB 3.5Å; G566-I569 PolarHBondContact O-N 3.23Å; G566-I569 VanDerWaalsContact O-N 3.11Å; I569-H572 PolarHBondContact O-N 3.49Å; I569-L573 VanDerWaalsContact O-CB 3.24Å; I569-L573 WeakPolarHBondContact O-CB 3.39Å; I569-L573 PolarHBondContact O-N 3.12Å
570	L	94.1	Very high	92.1	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-62	-43.2	175.1	-69.8	-176.9	0	0	0	111.6	W438 L442 W559 G566 D567 H572 L573 H574 Y626	W438-L570 HydrophobicContact CH2-CD1 3.97Å; W438-L570 HydrophobicContact CZ2-CD1 3.72Å; L442-L570 HydrophobicContact CD1-CB 4.45Å; L442-L570 HydrophobicContact CD2-CB 3.63Å; W559-L570 HydrophobicContact CH2-CD1 3.59Å; W559-L570 HydrophobicContact CH2-CD2 3.72Å; W559-L570 HydrophobicContact CH2-CG 3.41Å; W559-L570 VanDerWaalsContact CH2-CG 3.41Å; W559-L570 HydrophobicContact CZ2-CD1 3.72Å; W559-L570 HydrophobicContact CZ2-CG 3.92Å; W559-L570 HydrophobicContact CZ3-CD2 4.41Å; W559-L570 HydrophobicContact CZ3-CG 4.36Å; G566-L570 PolarHBondContact O-N 2.92Å; D567-L570 PolarHBondContact O-N 3.15Å; L570-H572 PolarHBondContact O-N 2.92Å; L570-L573 PolarHBondContact O-N 3.36Å; L570-H574 VanDerWaalsContact O-CB 3.22Å; L570-H574 WeakPolarHBondContact O-CB 3.49Å; L570-H574 PolarHBondContact O-CD2 2.98Å; L570-H574 VanDerWaalsContact O-CD2 3.28Å; L570-H574 PolarHBondContact O-N 3.21Å; L570-Y626 HydrophobicContact CD2-CD2 4.4Å; L570-Y626 HydrophobicContact CD2-CE2 3.92Å
571	A	93.9	Very high	91.7	Very high	2 Å²	2	29.4 Å²	29.4	2%	0.017	15%	0.148	C	C	.	.	H	α-helix	trans	-60.3	-44.7	179.5	0	0	0	0	0	112	L442 Q443 A446 D567 L568 K575	L442-A571 HydrophobicContact CD2-CB 4.4Å; L442-A571 HydrophobicContact CG-CB 4.08Å; Q443-A571 PolarHBondContact NE2-O 2.7Å; A446-A571 HydrophobicContact CB-CB 3.4Å; D567-A571 WeakPolarHBondContact O-CB 3.45Å; D567-A571 PolarHBondContact O-N 3.47Å; L568-A571 PolarHBondContact O-N 2.96Å; A571-K575 VanDerWaalsContact O-CB 3.23Å; A571-K575 WeakPolarHBondContact O-CB 3.42Å; A571-K575 PolarHBondContact O-N 3.44Å; A571-K575 VanDerWaalsContact O-N 3.12Å
572	H	94.6	Very high	90.7	Very high	18 Å²	18	26.2 Å²	26.2	8%	0.083	13%	0.131	C	C	.	.	H	α-helix	trans	-66.6	-40.9	175	-79.3	-62.4	0	0	0	112.7	Y527 E531 V534 L568 I569 L570 K576	Y527-H572 AromaticContact CD1-NE2 3.82Å; Y527-H572 AromaticContact CD2-NE2 3.98Å; Y527-H572 AromaticContact CE1-CE1 3.56Å; Y527-H572 AromaticContact CE1-NE2 3.61Å; Y527-H572 AromaticContact CE2-CE1 3.98Å; Y527-H572 AromaticContact CE2-NE2 3.78Å; Y527-H572 AromaticContact CZ-CE1 3.42Å; Y527-H572 VanDerWaalsContact CZ-CE1 3.42Å; Y527-H572 AromaticContact CZ-NE2 3.59Å; E531-H572 PolarHBondContact N-CD2 2.86Å; V534-H572 HydrophobicContact CB-CB 4.23Å; V534-H572 HydrophobicContact CG2-CB 3.77Å; L568-H572 WeakPolarHBondContact O-CB 3.33Å; L568-H572 PolarHBondContact O-CD2 2.79Å; L568-H572 PolarHBondContact O-N 2.9Å; I569-H572 PolarHBondContact O-N 3.49Å; L570-H572 PolarHBondContact O-N 2.92Å; H572-K576 WeakPolarHBondContact O-CB 3.36Å; H572-K576 PolarHBondContact O-N 3.41Å
573	L	94.6	Very high	89.7	Confident	8 Å²	8	25.4 Å²	25.4	4%	0.042	13%	0.128	C	C	.	.	H	α-helix	trans	-64.2	-52.7	178.4	178.5	69.2	0	0	0	111	V534 I569 L570 K575 K576 C577 M622 Y626	V534-L573 HydrophobicContact CG1-CB 4.39Å; V534-L573 HydrophobicContact CG1-CD1 4.32Å; V534-L573 HydrophobicContact CG2-CB 4.04Å; I569-L573 VanDerWaalsContact O-CB 3.24Å; I569-L573 WeakPolarHBondContact O-CB 3.39Å; I569-L573 PolarHBondContact O-N 3.12Å; L570-L573 PolarHBondContact O-N 3.36Å; L573-K575 VanDerWaalsContact C-N 3.25Å; L573-K575 PolarHBondContact O-N 3.34Å; L573-K576 PolarHBondContact O-N 2.91Å; L573-C577 HydrophobicContact CD1-CB 4.49Å; L573-C577 WeakPolarHBondContact O-CA 3.13Å; L573-C577 WeakPolarHBondContact O-CB 3.26Å; L573-C577 PolarHBondContact O-N 2.84Å; L573-M622 HydrophobicContact CD1-CB 3.85Å; L573-M622 HydrophobicContact CD1-CG 4.39Å; L573-Y626 HydrophobicContact CD2-CD2 3.32Å; L573-Y626 HydrophobicContact CD2-CE2 4.08Å; L573-Y626 HydrophobicContact CD2-CG 3.87Å
574	H	91.4	Very high	88.8	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-61.5	-34	-179.1	-63.8	178.9	0	0	0	112	W438 Y439 L442 L570 C577 S580 V581	W438-H574 AromaticContact CH2-CE1 3.59Å; W438-H574 AromaticContact CZ3-CE1 3.69Å; Y439-H574 HydrophobicContact CD2-CB 3.91Å; Y439-H574 HydrophobicContact CE2-CB 3.75Å; L442-H574 VanDerWaalsContact CD2-ND1 3.3Å; L442-H574 WeakPolarHBondContact CD2-ND1 3.35Å; L570-H574 VanDerWaalsContact O-CB 3.22Å; L570-H574 WeakPolarHBondContact O-CB 3.49Å; L570-H574 PolarHBondContact O-CD2 2.98Å; L570-H574 VanDerWaalsContact O-CD2 3.28Å; L570-H574 PolarHBondContact O-N 3.21Å; H574-C577 CarbonylContact O-C 3.53Å; H574-S580 WeakPolarHBondContact CA-OG 3.22Å; H574-S580 PolarHBondContact CD2-OG 2.99Å; H574-S580 VanDerWaalsContact CD2-OG 3.26Å; H574-V581 HydrophobicContact CB-CG2 3.48Å; H574-V581 VanDerWaalsContact CB-CG2 3.48Å
575	K	89.5	Confident	87.6	Confident	140 Å²	140	19 Å²	19	61%	0.609	9%	0.092	S	C	*	.	H	α-helix	trans	-75.5	-34.5	176.6	-175.2	169.2	-178.6	169.7	0	113.6	A571 L573	A571-K575 VanDerWaalsContact O-CB 3.23Å; A571-K575 WeakPolarHBondContact O-CB 3.42Å; A571-K575 PolarHBondContact O-N 3.44Å; A571-K575 VanDerWaalsContact O-N 3.12Å; L573-K575 VanDerWaalsContact C-N 3.25Å; L573-K575 PolarHBondContact O-N 3.34Å
576	K	91	Very high	86.4	Confident	50 Å²	50	22.9 Å²	22.9	22%	0.217	12%	0.118	C	C	.	.	H	α-helix	trans	-85.7	-23.7	177.1	-76.4	-174.2	170.7	-174.5	0	113.7	V534 E538 H572 L573 M619 M622	V534-K576 HydrophobicContact CG1-CD 3.94Å; E538-K576 WeakPolarHBondContact OE2-CE 3.39Å; E538-K576 IonicContact OE2-NZ 3.9Å; E538-K576 PolarHBondContact OE2-NZ 2.94Å; H572-K576 WeakPolarHBondContact O-CB 3.36Å; H572-K576 PolarHBondContact O-N 3.41Å; L573-K576 PolarHBondContact O-N 2.91Å; K576-M619 WeakPolarHBondContact O-CE 3.33Å; K576-M622 HydrophobicContact CB-CE 4.29Å; K576-M622 HydrophobicContact CB-SD 3.79Å; K576-M622 HydrophobicContact CD-SD 4.45Å
577	C	91.3	Very high	85.5	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.14	C	C	.	.			trans	-140.7	84	-175.6	-173.9	0	0	0	0	109	L573 H574 Y579 S580 M619 M622	L573-C577 HydrophobicContact CD1-CB 4.49Å; L573-C577 WeakPolarHBondContact O-CA 3.13Å; L573-C577 WeakPolarHBondContact O-CB 3.26Å; L573-C577 PolarHBondContact O-N 2.84Å; H574-C577 CarbonylContact O-C 3.53Å; C577-Y579 PolarHBondContact O-N 2.97Å; C577-S580 WeakPolarHBondContact O-CB 3.34Å; C577-S580 PolarHBondContact O-N 3.03Å; C577-S580 PolarHBondContact O-OG 3.32Å; C577-M619 HydrophobicContact CB-SD 3.75Å; C577-M622 HydrophobicContact CB-CB 4.42Å; C577-M622 HydrophobicContact CB-CE 3.86Å; C577-M622 HydrophobicContact CB-SD 4.13Å
578	P	87.9	Confident	84.6	Confident	11 Å²	11	31.5 Å²	31.5	7%	0.071	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-55.6	-27.7	179	-26.1	35.1	0	0	0	113.3	S580 V581 I599	P578-S580 PolarHBondContact O-N 2.73Å; P578-S580 VanDerWaalsContact O-N 3.17Å; P578-V581 WeakPolarHBondContact O-CB 3.49Å; P578-V581 PolarHBondContact O-N 3.36Å; P578-I599 WeakPolarHBondContact CG-O 3.42Å
579	Y	89.4	Confident	83.4	Confident	1 Å²	1	39.4 Å²	39.4	0%	0.004	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-65.1	-10.2	175.8	-41.4	-68.2	0	0	0	114.6	C577 V581 P582 Y584 L600 F615 M619 W653 L663 I666 L670	C577-Y579 PolarHBondContact O-N 2.97Å; Y579-V581 VanDerWaalsContact C-N 3.34Å; Y579-P582 WeakPolarHBondContact O-CD 3.34Å; Y579-Y584 AromaticContact CD1-CD1 3.92Å; Y579-Y584 HydrophobicContact CD1-CD1 3.92Å; Y579-Y584 AromaticContact CD1-CE1 3.81Å; Y579-Y584 HydrophobicContact CD1-CE1 3.81Å; Y579-Y584 AromaticContact CE1-CD1 3.88Å; Y579-Y584 HydrophobicContact CE1-CD1 3.88Å; Y579-Y584 HydrophobicContact CE1-CE1 4.09Å; Y579-L600 PolarHBondContact OH-O 3.17Å; Y579-F615 HydrophobicContact CE2-CE1 4.47Å; Y579-F615 AromaticContact CE2-CZ 3.72Å; Y579-F615 HydrophobicContact CE2-CZ 3.72Å; Y579-M619 HydrophobicContact CD2-CG 4.22Å; Y579-M619 HydrophobicContact CD2-SD 4.01Å; Y579-M619 HydrophobicContact CE2-CE 4.17Å; Y579-M619 HydrophobicContact CE2-CG 4.31Å; Y579-M619 HydrophobicContact CE2-SD 4.19Å; Y579-W653 PolarHBondContact O-NE1 3.32Å; Y579-L663 HydrophobicContact CE1-CD1 4.18Å; Y579-I666 HydrophobicContact CD1-CG2 4.06Å; Y579-I666 HydrophobicContact CE1-CD1 4.49Å; Y579-I666 HydrophobicContact CE1-CG2 4.07Å; Y579-I666 HydrophobicContact CG-CG2 4.28Å; Y579-L670 VanDerWaalsContact CB-CD1 3.44Å; Y579-L670 HydrophobicContact CD2-CD1 4.22Å; Y579-L670 HydrophobicContact CG-CD1 3.87Å
580	S	88.6	Confident	82.4	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.021	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-80	-15.4	168.8	61.8	0	0	0	0	113.3	H574 C577 P578 P582	H574-S580 WeakPolarHBondContact CA-OG 3.22Å; H574-S580 PolarHBondContact CD2-OG 2.99Å; H574-S580 VanDerWaalsContact CD2-OG 3.26Å; C577-S580 WeakPolarHBondContact O-CB 3.34Å; C577-S580 PolarHBondContact O-N 3.03Å; C577-S580 PolarHBondContact O-OG 3.32Å; P578-S580 PolarHBondContact O-N 2.73Å; P578-S580 VanDerWaalsContact O-N 3.17Å; S580-P582 WeakPolarHBondContact O-CD 3.49Å
581	V	83.1	Confident	81.6	Confident	7 Å²	7	43.9 Å²	43.9	4%	0.042	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	4	176	-169.9	0	0	0	0	112.2	T435 Y439 H574 P578 Y579 H583 Q656	T435-V581 HydrophobicContact CG2-CG1 3.73Å; Y439-V581 HydrophobicContact CD2-CG1 4.26Å; Y439-V581 HydrophobicContact CD2-CG2 3.89Å; Y439-V581 HydrophobicContact CE2-CG2 4.34Å; Y439-V581 HydrophobicContact CG-CG1 4.21Å; H574-V581 HydrophobicContact CB-CG2 3.48Å; H574-V581 VanDerWaalsContact CB-CG2 3.48Å; P578-V581 WeakPolarHBondContact O-CB 3.49Å; P578-V581 PolarHBondContact O-N 3.36Å; Y579-V581 VanDerWaalsContact C-N 3.34Å; V581-H583 VanDerWaalsContact C-N 3.34Å; V581-H583 PolarHBondContact O-N 2.85Å; V581-Q656 PolarHBondContact O-NE2 3.31Å
582	P	68.2	Low	81	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.019	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	25.7	65.9	-149.9	-7.1	-17.6	0	0	0	115.1	A431 Y579 S580 W653 Q656 M657 M660	A431-P582 WeakPolarHBondContact CB-O 3.44Å; Y579-P582 WeakPolarHBondContact O-CD 3.34Å; S580-P582 WeakPolarHBondContact O-CD 3.49Å; P582-W653 HydrophobicContact CG-CG 4.2Å; P582-Q656 HydrophobicContact CB-CB 4Å; P582-Q656 HydrophobicContact CB-CG 3.97Å; P582-Q656 HydrophobicContact CG-CB 3.86Å; P582-Q656 HydrophobicContact CG-CG 4.22Å; P582-Q656 PolarHBondContact O-NE2 2.94Å; P582-M657 HydrophobicContact CB-CG 3.94Å; P582-M657 HydrophobicContact CB-SD 3.81Å; P582-M657 HydrophobicContact CG-CG 3.99Å; P582-M657 HydrophobicContact CG-SD 4.32Å; P582-M660 HydrophobicContact CB-CE 3.48Å; P582-M660 VanDerWaalsContact CB-CE 3.48Å; P582-M660 VanDerWaalsContact O-CE 3.27Å; P582-M660 WeakPolarHBondContact O-CE 3.46Å
583	H	72.1	Confident	80.4	Confident	23 Å²	23	50.8 Å²	50.8	11%	0.106	29%	0.286	C	S	.	.			trans	-128.5	132.2	169	176.4	40.3	0	0	0	110.1	N430 A431 M436 V581 P585	N430-H583 PolarHBondContact OD1-CE1 3Å; N430-H583 VanDerWaalsContact OD1-CE1 3.27Å; A431-H583 HydrophobicContact CB-CB 4.04Å; M436-H583 VanDerWaalsContact CE-CD2 3.45Å; M436-H583 WeakPolarHBondContact CE-CD2 3.31Å; M436-H583 WeakPolarHBondContact CE-NE2 3.47Å; M436-H583 HydrophobicContact SD-CB 4.08Å; V581-H583 VanDerWaalsContact C-N 3.34Å; V581-H583 PolarHBondContact O-N 2.85Å; H583-P585 WeakPolarHBondContact O-CD 3.14Å
584	Y	71.1	Confident	79.7	Confident	18 Å²	18	55.6 Å²	55.6	7%	0.071	31%	0.308	C	S	.	.			trans	-103.4	104.2	166.9	-48.8	-52.7	0	0	0	108.1	Y579 P586 M660 E661 L663 T667	Y579-Y584 AromaticContact CD1-CD1 3.92Å; Y579-Y584 HydrophobicContact CD1-CD1 3.92Å; Y579-Y584 AromaticContact CD1-CE1 3.81Å; Y579-Y584 HydrophobicContact CD1-CE1 3.81Å; Y579-Y584 AromaticContact CE1-CD1 3.88Å; Y579-Y584 HydrophobicContact CE1-CD1 3.88Å; Y579-Y584 HydrophobicContact CE1-CE1 4.09Å; Y584-P586 WeakPolarHBondContact O-CD 3.3Å; Y584-M660 HydrophobicContact CD2-CE 4.07Å; Y584-M660 HydrophobicContact CD2-SD 4.03Å; Y584-M660 HydrophobicContact CE1-CE 4.4Å; Y584-M660 HydrophobicContact CE2-CB 3.9Å; Y584-M660 HydrophobicContact CE2-CE 3.51Å; Y584-M660 HydrophobicContact CE2-SD 3.95Å; Y584-E661 VanDerWaalsContact CE2-O 3.28Å; Y584-E661 WeakPolarHBondContact CE2-O 3.37Å; Y584-L663 HydrophobicContact CD1-CD1 3.4Å; Y584-L663 HydrophobicContact CD1-CG 3.96Å; Y584-L663 HydrophobicContact CD2-CG 4.34Å; Y584-L663 HydrophobicContact CE1-CD1 3.54Å; Y584-L663 HydrophobicContact CE1-CG 3.78Å; Y584-L663 HydrophobicContact CE2-CG 4.2Å; Y584-L663 HydrophobicContact CG-CD1 3.93Å; Y584-L663 HydrophobicContact CG-CG 4.21Å; Y584-T667 PolarHBondContact OH-OG1 3.13Å
585	P	67.5	Low	79.3	Confident	20 Å²	20	60.3 Å²	60.3	13%	0.13	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-65.1	123.2	175.3	-18.9	31.7	0	0	0	109.3	H583 Y596 I599	H583-P585 WeakPolarHBondContact O-CD 3.14Å; P585-Y596 WeakPolarHBondContact O-CE2 3.48Å; P585-Y596 PolarHBondContact O-OH 3.08Å; P585-I599 HydrophobicContact CB-CG2 3.64Å; P585-I599 HydrophobicContact CG-CG2 3.88Å
586	P	68.5	Low	79	Confident	85 Å²	85	56.2 Å²	56.2	55%	0.552	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-71.6	149.5	174.1	29.7	-34.3	0	0	0	110.6	Y584 K588	Y584-P586 WeakPolarHBondContact O-CD 3.3Å; P586-K588 PolarHBondContact O-N 3.27Å
587	M	74.4	Confident	78.7	Confident	97 Å²	97	56.1 Å²	56.1	48%	0.478	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-61.1	134.1	169.7	-168	172.8	-179.8	0	0	109.3	T591 V593 Y596	M587-T591 WeakPolarHBondContact CE-O 3.5Å; M587-V593 HydrophobicContact CE-CG2 4.48Å; M587-Y596 VanDerWaalsContact CA-CE2 3.44Å; M587-Y596 HydrophobicContact CB-CD1 4.1Å; M587-Y596 HydrophobicContact CB-CD2 3.9Å; M587-Y596 HydrophobicContact CB-CE1 3.92Å; M587-Y596 HydrophobicContact CB-CE2 3.72Å; M587-Y596 HydrophobicContact CB-CG 4.09Å; M587-Y596 HydrophobicContact CG-CD1 4.02Å; M587-Y596 HydrophobicContact CG-CD2 4.08Å; M587-Y596 HydrophobicContact CG-CE1 4.33Å; M587-Y596 HydrophobicContact CG-CE2 4.4Å; M587-Y596 HydrophobicContact CG-CG 3.88Å; M587-Y596 VanDerWaalsContact N-CE2 3.27Å; M587-Y596 HydrophobicContact SD-CD1 4.01Å; M587-Y596 HydrophobicContact SD-CE1 4.39Å; M587-Y596 HydrophobicContact SD-CG 4.37Å
588	K	75.5	Confident	78.4	Confident	152 Å²	152	61 Å²	61	66%	0.661	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-95.4	145.6	173.9	-62.7	178.1	-176.6	174	0	109.7	P586 G590 T591	P586-K588 PolarHBondContact O-N 3.27Å; K588-G590 PolarHBondContact O-N 2.84Å; K588-T591 PolarHBondContact O-N 3.01Å; K588-T591 VanDerWaalsContact O-N 3.1Å
589	D	70	Confident	78.2	Confident	173 Å²	173	64 Å²	64	93%	0.925	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	125.8	174.9	-56	-59.4	0	0	0	110.5
590	G	73.6	Confident	78	Confident	83 Å²	83	65 Å²	65	86%	0.856	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.5	-5.9	-178.8	0	0	0	0	0	116.5	K588	K588-G590 PolarHBondContact O-N 2.84Å
591	T	77.1	Confident	77.9	Confident	26 Å²	26	65.3 Å²	65.3	16%	0.16	36%	0.356	C	S	.	.			trans	-72.9	127.4	171.4	-63.4	0	0	0	0	110.2	M587 K588 E595	M587-T591 WeakPolarHBondContact CE-O 3.5Å; K588-T591 PolarHBondContact O-N 3.01Å; K588-T591 VanDerWaalsContact O-N 3.1Å; T591-E595 HydrophobicContact CG2-CB 3.9Å; T591-E595 HydrophobicContact CG2-CG 4.04Å
592	P	81.6	Confident	78.1	Confident	76 Å²	76	66.9 Å²	66.9	49%	0.494	36%	0.362	S	S	.	.			trans	-67.3	149.5	177.4	27.2	-33.5	0	0	0	111.7	E594 E595 Y596	P592-E594 VanDerWaalsContact C-N 3.28Å; P592-E594 PolarHBondContact O-N 2.94Å; P592-E595 WeakPolarHBondContact CD-OE2 3.27Å; P592-E595 HydrophobicContact CG-CB 3.84Å; P592-E595 PolarHBondContact O-N 2.8Å; P592-Y596 PolarHBondContact O-N 3.46Å
593	V	81.6	Confident	79	Confident	89 Å²	89	71.6 Å²	71.6	54%	0.539	38%	0.379	S	S	.	.	H	α-helix	trans	-55.9	-40.3	-171.9	-179.2	0	0	0	0	112.5	M587 E595 Y596 Q597	M587-V593 HydrophobicContact CE-CG2 4.48Å; V593-E595 PolarHBondContact O-N 3.35Å; V593-Y596 PolarHBondContact O-N 2.85Å; V593-Q597 HydrophobicContact CG1-CG 4.46Å; V593-Q597 WeakPolarHBondContact O-CB 3.26Å; V593-Q597 VanDerWaalsContact O-CG 3.31Å; V593-Q597 WeakPolarHBondContact O-CG 3.49Å; V593-Q597 PolarHBondContact O-N 2.7Å; V593-Q597 PolarHBondContact O-OE1 3.19Å
594	E	80.9	Confident	79.6	Confident	109 Å²	109	72 Å²	72	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-63.6	-38	176.5	-64.4	175.6	-150.8	0	0	113.7	P592 Q597 K598 V604	P592-E594 VanDerWaalsContact C-N 3.28Å; P592-E594 PolarHBondContact O-N 2.94Å; E594-Q597 PolarHBondContact O-N 2.86Å; E594-K598 WeakPolarHBondContact O-CB 3.37Å; E594-K598 WeakPolarHBondContact O-CD 3.37Å; E594-K598 WeakPolarHBondContact O-CG 3.46Å; E594-K598 PolarHBondContact O-N 3.09Å; E594-K598 IonicContact OE2-NZ 3.73Å; E594-K598 PolarHBondContact OE2-NZ 3.38Å; E594-V604 HydrophobicContact CG-CG1 4.48Å
595	E	82.8	Confident	79.9	Confident	100 Å²	100	75.9 Å²	75.9	47%	0.467	41%	0.405	S	S	.	.	H	α-helix	trans	-71.5	-39	177.8	-174.6	178.4	-174.3	0	0	110.1	T591 P592 V593 Q597 K598 I599	T591-E595 HydrophobicContact CG2-CB 3.9Å; T591-E595 HydrophobicContact CG2-CG 4.04Å; P592-E595 WeakPolarHBondContact CD-OE2 3.27Å; P592-E595 HydrophobicContact CG-CB 3.84Å; P592-E595 PolarHBondContact O-N 2.8Å; V593-E595 PolarHBondContact O-N 3.35Å; E595-Q597 PolarHBondContact O-N 3.23Å; E595-K598 PolarHBondContact O-N 3.14Å; E595-I599 HydrophobicContact CG-CD1 4.24Å; E595-I599 VanDerWaalsContact O-CG1 3.28Å; E595-I599 WeakPolarHBondContact O-CG1 3.16Å; E595-I599 PolarHBondContact O-N 3.49Å
596	Y	83.4	Confident	80.1	Confident	55 Å²	55	83.5 Å²	83.5	22%	0.216	45%	0.445	C	S	.	.	H	α-helix	trans	-62.5	-41	172	-179.5	-123.2	0	0	0	112.3	P585 M587 P592 V593 I599 L600	P585-Y596 WeakPolarHBondContact O-CE2 3.48Å; P585-Y596 PolarHBondContact O-OH 3.08Å; M587-Y596 VanDerWaalsContact CA-CE2 3.44Å; M587-Y596 HydrophobicContact CB-CD1 4.1Å; M587-Y596 HydrophobicContact CB-CD2 3.9Å; M587-Y596 HydrophobicContact CB-CE1 3.92Å; M587-Y596 HydrophobicContact CB-CE2 3.72Å; M587-Y596 HydrophobicContact CB-CG 4.09Å; M587-Y596 HydrophobicContact CG-CD1 4.02Å; M587-Y596 HydrophobicContact CG-CD2 4.08Å; M587-Y596 HydrophobicContact CG-CE1 4.33Å; M587-Y596 HydrophobicContact CG-CE2 4.4Å; M587-Y596 HydrophobicContact CG-CG 3.88Å; M587-Y596 VanDerWaalsContact N-CE2 3.27Å; M587-Y596 HydrophobicContact SD-CD1 4.01Å; M587-Y596 HydrophobicContact SD-CE1 4.39Å; M587-Y596 HydrophobicContact SD-CG 4.37Å; P592-Y596 PolarHBondContact O-N 3.46Å; V593-Y596 PolarHBondContact O-N 2.85Å; Y596-I599 WeakPolarHBondContact O-CB 3.17Å; Y596-I599 PolarHBondContact O-N 2.84Å; Y596-I599 VanDerWaalsContact O-N 3.17Å; Y596-L600 HydrophobicContact CD1-CD1 4.22Å; Y596-L600 HydrophobicContact CE1-CD1 3.74Å; Y596-L600 HydrophobicContact CE1-CG 4.41Å; Y596-L600 HydrophobicContact CE2-CD1 4.36Å; Y596-L600 HydrophobicContact CE2-CD2 4.32Å; Y596-L600 HydrophobicContact CE2-CG 4.17Å; Y596-L600 WeakPolarHBondContact O-CG 3.38Å; Y596-L600 PolarHBondContact O-N 3.35Å
597	Q	83.4	Confident	80	Confident	47 Å²	47	85.6 Å²	85.6	22%	0.22	46%	0.46	C	S	.	.	H	α-helix	trans	-63.1	-42.5	172.9	-75.3	165.3	-30	0	0	111.9	V593 E594 E595 I599 L600 G601 Y602 V604 V609	V593-Q597 HydrophobicContact CG1-CG 4.46Å; V593-Q597 WeakPolarHBondContact O-CB 3.26Å; V593-Q597 VanDerWaalsContact O-CG 3.31Å; V593-Q597 WeakPolarHBondContact O-CG 3.49Å; V593-Q597 PolarHBondContact O-N 2.7Å; V593-Q597 PolarHBondContact O-OE1 3.19Å; E594-Q597 PolarHBondContact O-N 2.86Å; E595-Q597 PolarHBondContact O-N 3.23Å; Q597-I599 VanDerWaalsContact C-N 3.28Å; Q597-I599 PolarHBondContact O-N 3.05Å; Q597-L600 CarbonylContact O-C 3.59Å; Q597-L600 PolarHBondContact O-N 3.34Å; Q597-G601 PolarHBondContact O-N 3.4Å; Q597-G601 VanDerWaalsContact O-N 3.14Å; Q597-Y602 HydrophobicContact CB-CD2 4.32Å; Q597-Y602 HydrophobicContact CB-CG 4.4Å; Q597-Y602 WeakPolarHBondContact O-CB 3.49Å; Q597-Y602 WeakPolarHBondContact O-CD2 3.3Å; Q597-Y602 PolarHBondContact O-N 3.41Å; Q597-V604 HydrophobicContact CB-CG2 4.38Å; Q597-V609 VanDerWaalsContact OE1-CG2 3.3Å
598	K	84.8	Confident	80.2	Confident	103 Å²	103	82.5 Å²	82.5	45%	0.448	45%	0.453	S	S	.	.	H	α-helix	trans	-59.9	-36.6	172	-70.5	158.7	-169	161.9	0	111.8	E594 E595 G601 V604	E594-K598 WeakPolarHBondContact O-CB 3.37Å; E594-K598 WeakPolarHBondContact O-CD 3.37Å; E594-K598 WeakPolarHBondContact O-CG 3.46Å; E594-K598 PolarHBondContact O-N 3.09Å; E594-K598 IonicContact OE2-NZ 3.73Å; E594-K598 PolarHBondContact OE2-NZ 3.38Å; E595-K598 PolarHBondContact O-N 3.14Å; K598-G601 WeakPolarHBondContact O-CA 3.46Å; K598-G601 PolarHBondContact O-N 3.01Å; K598-G601 VanDerWaalsContact O-N 3.09Å; K598-V604 VanDerWaalsContact CE-CB 3.46Å; K598-V604 HydrophobicContact CG-CB 4.28Å; K598-V604 HydrophobicContact CG-CG2 3.95Å
599	I	84.3	Confident	80.6	Confident	74 Å²	74	78.2 Å²	78.2	38%	0.379	44%	0.439	S	S	.	.	H	α-helix	trans	-69.2	-36.7	175	-71.2	163.3	0	0	0	112.4	P578 P585 E595 Y596 Q597 G601	P578-I599 WeakPolarHBondContact CG-O 3.42Å; P585-I599 HydrophobicContact CB-CG2 3.64Å; P585-I599 HydrophobicContact CG-CG2 3.88Å; E595-I599 HydrophobicContact CG-CD1 4.24Å; E595-I599 VanDerWaalsContact O-CG1 3.28Å; E595-I599 WeakPolarHBondContact O-CG1 3.16Å; E595-I599 PolarHBondContact O-N 3.49Å; Y596-I599 WeakPolarHBondContact O-CB 3.17Å; Y596-I599 PolarHBondContact O-N 2.84Å; Y596-I599 VanDerWaalsContact O-N 3.17Å; Q597-I599 VanDerWaalsContact C-N 3.28Å; Q597-I599 PolarHBondContact O-N 3.05Å; I599-G601 PolarHBondContact O-N 3.11Å
600	L	84.9	Confident	81.6	Confident	23 Å²	23	71.6 Å²	71.6	12%	0.12	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-5.4	169.3	-67.2	175	0	0	0	112.9	Y579 Y596 Q597 Y602	Y579-L600 PolarHBondContact OH-O 3.17Å; Y596-L600 HydrophobicContact CD1-CD1 4.22Å; Y596-L600 HydrophobicContact CE1-CD1 3.74Å; Y596-L600 HydrophobicContact CE1-CG 4.41Å; Y596-L600 HydrophobicContact CE2-CD1 4.36Å; Y596-L600 HydrophobicContact CE2-CD2 4.32Å; Y596-L600 HydrophobicContact CE2-CG 4.17Å; Y596-L600 WeakPolarHBondContact O-CG 3.38Å; Y596-L600 PolarHBondContact O-N 3.35Å; Q597-L600 CarbonylContact O-C 3.59Å; Q597-L600 PolarHBondContact O-N 3.34Å; L600-Y602 HydrophobicContact CB-CD2 3.81Å; L600-Y602 HydrophobicContact CB-CE2 3.9Å; L600-Y602 HydrophobicContact CD1-CE2 4.22Å
601	G	86.7	Confident	82.2	Confident	9 Å²	9	69.9 Å²	69.9	9%	0.093	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.7	9.9	176.8	0	0	0	0	0	114.8	Q597 K598 I599 R618 M619	Q597-G601 PolarHBondContact O-N 3.4Å; Q597-G601 VanDerWaalsContact O-N 3.14Å; K598-G601 WeakPolarHBondContact O-CA 3.46Å; K598-G601 PolarHBondContact O-N 3.01Å; K598-G601 VanDerWaalsContact O-N 3.09Å; I599-G601 PolarHBondContact O-N 3.11Å; G601-R618 PolarHBondContact O-NH2 3.05Å; G601-M619 WeakPolarHBondContact O-CE 3.5Å
602	Y	88.8	Confident	82.7	Confident	39 Å²	39	71.7 Å²	71.7	15%	0.153	39%	0.392	C	S	.	.			trans	-66.4	141.5	173.3	-70.9	-104.3	0	0	0	110.8	Q597 L600 V609 E610 Q612 F615	Q597-Y602 HydrophobicContact CB-CD2 4.32Å; Q597-Y602 HydrophobicContact CB-CG 4.4Å; Q597-Y602 WeakPolarHBondContact O-CB 3.49Å; Q597-Y602 WeakPolarHBondContact O-CD2 3.3Å; Q597-Y602 PolarHBondContact O-N 3.41Å; L600-Y602 HydrophobicContact CB-CD2 3.81Å; L600-Y602 HydrophobicContact CB-CE2 3.9Å; L600-Y602 HydrophobicContact CD1-CE2 4.22Å; Y602-V609 HydrophobicContact CD1-CG1 4.11Å; Y602-V609 HydrophobicContact CG-CG1 4.49Å; Y602-E610 WeakPolarHBondContact CA-OE1 3.18Å; Y602-E610 HydrophobicContact CD1-CG 4.17Å; Y602-Q612 PolarHBondContact OH-OE1 3.4Å; Y602-F615 HydrophobicContact CD1-CB 4.06Å; Y602-F615 AromaticContact CD1-CD2 3.44Å; Y602-F615 HydrophobicContact CD1-CD2 3.44Å; Y602-F615 VanDerWaalsContact CD1-CD2 3.44Å; Y602-F615 AromaticContact CD1-CE2 3.94Å; Y602-F615 HydrophobicContact CD1-CE2 3.94Å; Y602-F615 AromaticContact CD1-CG 3.82Å; Y602-F615 HydrophobicContact CD1-CG 3.82Å; Y602-F615 AromaticContact CD2-CD2 3.8Å; Y602-F615 HydrophobicContact CD2-CD2 3.8Å; Y602-F615 AromaticContact CD2-CE2 3.38Å; Y602-F615 HydrophobicContact CD2-CE2 3.38Å; Y602-F615 AromaticContact CD2-CZ 3.98Å; Y602-F615 HydrophobicContact CD2-CZ 3.98Å; Y602-F615 HydrophobicContact CE1-CB 3.91Å; Y602-F615 AromaticContact CE1-CD1 3.93Å; Y602-F615 HydrophobicContact CE1-CD1 3.93Å; Y602-F615 AromaticContact CE1-CD2 3.57Å; Y602-F615 HydrophobicContact CE1-CD2 3.57Å; Y602-F615 HydrophobicContact CE1-CE1 4.32Å; Y602-F615 AromaticContact CE1-CE2 3.96Å; Y602-F615 HydrophobicContact CE1-CE2 3.96Å; Y602-F615 AromaticContact CE1-CG 3.54Å; Y602-F615 HydrophobicContact CE1-CG 3.54Å; Y602-F615 HydrophobicContact CE1-CZ 4.32Å; Y602-F615 AromaticContact CE2-CD2 3.92Å; Y602-F615 HydrophobicContact CE2-CD2 3.92Å; Y602-F615 HydrophobicContact CE2-CE1 4.1Å; Y602-F615 AromaticContact CE2-CE2 3.41Å; Y602-F615 HydrophobicContact CE2-CE2 3.41Å; Y602-F615 VanDerWaalsContact CE2-CE2 3.41Å; Y602-F615 HydrophobicContact CE2-CG 4.44Å; Y602-F615 AromaticContact CE2-CZ 3.51Å; Y602-F615 HydrophobicContact CE2-CZ 3.51Å; Y602-F615 AromaticContact CG-CD2 3.55Å; Y602-F615 HydrophobicContact CG-CD2 3.55Å; Y602-F615 AromaticContact CG-CE2 3.65Å; Y602-F615 HydrophobicContact CG-CE2 3.65Å; Y602-F615 HydrophobicContact CG-CG 4.37Å; Y602-F615 AromaticContact CZ-CD1 3.87Å; Y602-F615 AromaticContact CZ-CD2 3.81Å; Y602-F615 AromaticContact CZ-CE1 3.8Å; Y602-F615 AromaticContact CZ-CE2 3.7Å; Y602-F615 AromaticContact CZ-CG 3.88Å; Y602-F615 AromaticContact CZ-CZ 3.7Å
603	R	86.2	Confident	83.1	Confident	102 Å²	102	73.3 Å²	73.3	39%	0.385	40%	0.396	S	S	.	.			trans	-73.2	130	162.1	-66.5	178.8	172.3	-160.7	2.2	108.6	E538 E539 E610	E538-R603 IonicContact OE1-CZ 2.66Å; E538-R603 IonicContact OE1-NE 2.68Å; E538-R603 PolarHBondContact OE1-NE 3.35Å; E538-R603 VanDerWaalsContact OE1-NE 3.1Å; E538-R603 IonicContact OE1-NH2 3.89Å; E538-R603 PolarHBondContact OE1-NH2 3.42Å; E538-R603 IonicContact OE2-NH2 2.7Å; E538-R603 PolarHBondContact OE2-NH2 2.93Å; E539-R603 IonicContact OE1-NH2 3.45Å; E539-R603 PolarHBondContact OE1-NH2 3.21Å; R603-E610 HydrophobicContact CB-CB 4.25Å; R603-E610 HydrophobicContact CB-CG 4.33Å; R603-E610 PolarHBondContact N-OE1 3.37Å; R603-E610 PolarHBondContact O-N 3.09Å
604	V	84.7	Confident	83.5	Confident	33 Å²	33	72.3 Å²	72.3	20%	0.2	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.1	171.5	-176.2	0	0	0	0	106.1	E594 Q597 K598 G608 V609	E594-V604 HydrophobicContact CG-CG1 4.48Å; Q597-V604 HydrophobicContact CB-CG2 4.38Å; K598-V604 VanDerWaalsContact CE-CB 3.46Å; K598-V604 HydrophobicContact CG-CB 4.28Å; K598-V604 HydrophobicContact CG-CG2 3.95Å; V604-G608 CarbonylContact C-O 3.57Å; V604-G608 VanDerWaalsContact CA-O 3.3Å; V604-G608 WeakPolarHBondContact CA-O 3.4Å; V604-V609 HydrophobicContact CG1-CG2 4.29Å; V604-V609 HydrophobicContact CG2-CG1 4.28Å; V604-V609 HydrophobicContact CG2-CG2 4.14Å
605	D	77.4	Confident	84	Confident	99 Å²	99	67.1 Å²	67.1	53%	0.529	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	-177	-179.1	62.1	42.2	0	0	0	110.7	C607 G608	D605-C607 PolarHBondContact O-N 2.98Å; D605-C607 VanDerWaalsContact O-N 3.08Å; D605-C607 WeakPolarHBondContact OD1-CA 3.2Å; D605-C607 VanDerWaalsContact OD1-CB 3.3Å; D605-C607 WeakPolarHBondContact OD1-CB 3.44Å; D605-C607 PolarHBondContact OD1-N 3.23Å; D605-G608 PolarHBondContact N-O 2.99Å; D605-G608 PolarHBondContact O-N 3.42Å; D605-G608 PolarHBondContact OD1-N 2.96Å
606	D	71.2	Confident	84.5	Confident	179 Å²	179	62.9 Å²	62.9	96%	0.957	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-11.7	-176.5	-52	-47	0	0	0	113.4
607	C	66.7	Low	85	Confident	130 Å²	130	65.9 Å²	65.9	88%	0.878	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-6.9	174.1	-64.7	0	0	0	0	113	D605	D605-C607 PolarHBondContact O-N 2.98Å; D605-C607 VanDerWaalsContact O-N 3.08Å; D605-C607 WeakPolarHBondContact OD1-CA 3.2Å; D605-C607 VanDerWaalsContact OD1-CB 3.3Å; D605-C607 WeakPolarHBondContact OD1-CB 3.44Å; D605-C607 PolarHBondContact OD1-N 3.23Å
608	G	78.3	Confident	85.6	Confident	31 Å²	31	64.4 Å²	64.4	32%	0.32	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	127.6	-151.7	173.8	0	0	0	0	0	114.4	V604 D605	V604-G608 CarbonylContact C-O 3.57Å; V604-G608 VanDerWaalsContact CA-O 3.3Å; V604-G608 WeakPolarHBondContact CA-O 3.4Å; D605-G608 PolarHBondContact N-O 2.99Å; D605-G608 PolarHBondContact O-N 3.42Å; D605-G608 PolarHBondContact OD1-N 2.96Å
609	V	85.3	Confident	86.1	Confident	62 Å²	62	59.5 Å²	59.5	38%	0.376	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	137.8	-180	-173.4	0	0	0	0	109.4	Q597 Y602 V604	Q597-V609 VanDerWaalsContact OE1-CG2 3.3Å; Y602-V609 HydrophobicContact CD1-CG1 4.11Å; Y602-V609 HydrophobicContact CG-CG1 4.49Å; V604-V609 HydrophobicContact CG1-CG2 4.29Å; V604-V609 HydrophobicContact CG2-CG1 4.28Å; V604-V609 HydrophobicContact CG2-CG2 4.14Å
610	E	89.9	Confident	86.6	Confident	34 Å²	34	56.3 Å²	56.3	16%	0.159	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-62.6	143.9	177.7	83	-171.3	141	0	0	112.2	Y602 R603 F615 R618	Y602-E610 WeakPolarHBondContact CA-OE1 3.18Å; Y602-E610 HydrophobicContact CD1-CG 4.17Å; R603-E610 HydrophobicContact CB-CB 4.25Å; R603-E610 HydrophobicContact CB-CG 4.33Å; R603-E610 PolarHBondContact N-OE1 3.37Å; R603-E610 PolarHBondContact O-N 3.09Å; E610-F615 HydrophobicContact CG-CB 4Å; E610-R618 IonicContact OE1-CZ 2.68Å; E610-R618 IonicContact OE1-NE 3.86Å; E610-R618 PolarHBondContact OE1-NE 3.43Å; E610-R618 IonicContact OE1-NH2 2.68Å; E610-R618 PolarHBondContact OE1-NH2 3.33Å; E610-R618 IonicContact OE2-CZ 3.39Å; E610-R618 IonicContact OE2-NE 2.82Å; E610-R618 PolarHBondContact OE2-NE 3.42Å; E610-R618 IonicContact OE2-NH2 2.67Å
611	G	87.2	Confident	87.2	Confident	47 Å²	47	55.2 Å²	55.2	49%	0.485	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-67.8	148.1	178.7	0	0	0	0	0	113.5	D613 S614 F615	G611-D613 VanDerWaalsContact C-N 3.34Å; G611-D613 PolarHBondContact O-N 3.02Å; G611-S614 WeakPolarHBondContact O-CA 3.34Å; G611-S614 WeakPolarHBondContact O-CB 3.46Å; G611-S614 PolarHBondContact O-N 3.41Å; G611-F615 PolarHBondContact O-N 3.44Å
612	Q	87.3	Confident	87.6	Confident	64 Å²	64	54.9 Å²	54.9	30%	0.299	31%	0.309	S	S	.	.	H	α-helix	trans	-51	-45.3	-175.1	-173.5	65.9	-3.6	0	0	113.8	Y602 S614 F615 L616	Y602-Q612 PolarHBondContact OH-OE1 3.4Å; Q612-S614 VanDerWaalsContact C-N 3.29Å; Q612-S614 PolarHBondContact O-N 3.37Å; Q612-F615 PolarHBondContact O-N 2.94Å; Q612-L616 HydrophobicContact CG-CD1 3.87Å; Q612-L616 HydrophobicContact CG-CG 4.38Å; Q612-L616 WeakPolarHBondContact O-CB 3.21Å; Q612-L616 WeakPolarHBondContact O-CG 3.47Å; Q612-L616 PolarHBondContact O-N 2.89Å
613	D	88.6	Confident	88	Confident	111 Å²	111	53 Å²	53	59%	0.594	30%	0.302	S	S	*	.	H	α-helix	trans	-56.5	-40.3	175.6	-80.3	20.9	0	0	0	113.3	G611 K617	G611-D613 VanDerWaalsContact C-N 3.34Å; G611-D613 PolarHBondContact O-N 3.02Å; D613-K617 WeakPolarHBondContact O-CB 3.42Å; D613-K617 WeakPolarHBondContact O-CD 3.31Å; D613-K617 WeakPolarHBondContact O-CG 3.31Å; D613-K617 PolarHBondContact O-N 3.32Å; D613-K617 VanDerWaalsContact O-N 3.1Å
614	S	90.7	Very high	88.5	Confident	67 Å²	67	48.4 Å²	48.4	47%	0.469	29%	0.285	S	S	.	.	H	α-helix	trans	-72.9	-46	-179.7	-62.9	0	0	0	0	110.3	G611 Q612 L616 K617 R618	G611-S614 WeakPolarHBondContact O-CA 3.34Å; G611-S614 WeakPolarHBondContact O-CB 3.46Å; G611-S614 PolarHBondContact O-N 3.41Å; Q612-S614 VanDerWaalsContact C-N 3.29Å; Q612-S614 PolarHBondContact O-N 3.37Å; S614-L616 PolarHBondContact O-N 2.85Å; S614-K617 PolarHBondContact O-N 3.09Å; S614-R618 WeakPolarHBondContact O-CB 3.45Å; S614-R618 PolarHBondContact O-N 3.26Å
615	F	92.8	Very high	89.1	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-54.1	-49.6	172.1	170.3	-94.6	0	0	0	111.7	Y579 Y602 E610 G611 Q612 R618 M619 I666	Y579-F615 HydrophobicContact CE2-CE1 4.47Å; Y579-F615 AromaticContact CE2-CZ 3.72Å; Y579-F615 HydrophobicContact CE2-CZ 3.72Å; Y602-F615 HydrophobicContact CD1-CB 4.06Å; Y602-F615 AromaticContact CD1-CD2 3.44Å; Y602-F615 HydrophobicContact CD1-CD2 3.44Å; Y602-F615 VanDerWaalsContact CD1-CD2 3.44Å; Y602-F615 AromaticContact CD1-CE2 3.94Å; Y602-F615 HydrophobicContact CD1-CE2 3.94Å; Y602-F615 AromaticContact CD1-CG 3.82Å; Y602-F615 HydrophobicContact CD1-CG 3.82Å; Y602-F615 AromaticContact CD2-CD2 3.8Å; Y602-F615 HydrophobicContact CD2-CD2 3.8Å; Y602-F615 AromaticContact CD2-CE2 3.38Å; Y602-F615 HydrophobicContact CD2-CE2 3.38Å; Y602-F615 AromaticContact CD2-CZ 3.98Å; Y602-F615 HydrophobicContact CD2-CZ 3.98Å; Y602-F615 HydrophobicContact CE1-CB 3.91Å; Y602-F615 AromaticContact CE1-CD1 3.93Å; Y602-F615 HydrophobicContact CE1-CD1 3.93Å; Y602-F615 AromaticContact CE1-CD2 3.57Å; Y602-F615 HydrophobicContact CE1-CD2 3.57Å; Y602-F615 HydrophobicContact CE1-CE1 4.32Å; Y602-F615 AromaticContact CE1-CE2 3.96Å; Y602-F615 HydrophobicContact CE1-CE2 3.96Å; Y602-F615 AromaticContact CE1-CG 3.54Å; Y602-F615 HydrophobicContact CE1-CG 3.54Å; Y602-F615 HydrophobicContact CE1-CZ 4.32Å; Y602-F615 AromaticContact CE2-CD2 3.92Å; Y602-F615 HydrophobicContact CE2-CD2 3.92Å; Y602-F615 HydrophobicContact CE2-CE1 4.1Å; Y602-F615 AromaticContact CE2-CE2 3.41Å; Y602-F615 HydrophobicContact CE2-CE2 3.41Å; Y602-F615 VanDerWaalsContact CE2-CE2 3.41Å; Y602-F615 HydrophobicContact CE2-CG 4.44Å; Y602-F615 AromaticContact CE2-CZ 3.51Å; Y602-F615 HydrophobicContact CE2-CZ 3.51Å; Y602-F615 AromaticContact CG-CD2 3.55Å; Y602-F615 HydrophobicContact CG-CD2 3.55Å; Y602-F615 AromaticContact CG-CE2 3.65Å; Y602-F615 HydrophobicContact CG-CE2 3.65Å; Y602-F615 HydrophobicContact CG-CG 4.37Å; Y602-F615 AromaticContact CZ-CD1 3.87Å; Y602-F615 AromaticContact CZ-CD2 3.81Å; Y602-F615 AromaticContact CZ-CE1 3.8Å; Y602-F615 AromaticContact CZ-CE2 3.7Å; Y602-F615 AromaticContact CZ-CG 3.88Å; Y602-F615 AromaticContact CZ-CZ 3.7Å; E610-F615 HydrophobicContact CG-CB 4Å; G611-F615 PolarHBondContact O-N 3.44Å; Q612-F615 PolarHBondContact O-N 2.94Å; F615-R618 WeakPolarHBondContact O-CB 3.49Å; F615-R618 PolarHBondContact O-N 3.46Å; F615-M619 HydrophobicContact CD1-CG 4.45Å; F615-M619 HydrophobicContact CD2-CE 3.77Å; F615-M619 HydrophobicContact CD2-CG 4.46Å; F615-M619 HydrophobicContact CE1-CG 4.18Å; F615-M619 HydrophobicContact CE2-CE 3.24Å; F615-M619 HydrophobicContact CE2-CG 4.22Å; F615-M619 HydrophobicContact CZ-CE 3.8Å; F615-M619 HydrophobicContact CZ-CG 4.07Å; F615-M619 WeakPolarHBondContact O-CG 3.34Å; F615-M619 PolarHBondContact O-N 3.35Å; F615-I666 HydrophobicContact CE1-CD1 3.93Å; F615-I666 HydrophobicContact CE1-CG1 4.16Å; F615-I666 HydrophobicContact CZ-CD1 4.45Å
616	L	92.6	Very high	90	Very high	12 Å²	12	43.4 Å²	43.4	6%	0.063	26%	0.256	C	S	.	.	H	α-helix	trans	-65.5	-43.5	-178.4	-74.1	170.8	0	0	0	112.9	Q612 S614 R618 M619 S620 D665 I666	Q612-L616 HydrophobicContact CG-CD1 3.87Å; Q612-L616 HydrophobicContact CG-CG 4.38Å; Q612-L616 WeakPolarHBondContact O-CB 3.21Å; Q612-L616 WeakPolarHBondContact O-CG 3.47Å; Q612-L616 PolarHBondContact O-N 2.89Å; S614-L616 PolarHBondContact O-N 2.85Å; L616-R618 VanDerWaalsContact C-N 3.28Å; L616-R618 PolarHBondContact O-N 2.93Å; L616-M619 PolarHBondContact O-N 2.97Å; L616-S620 WeakPolarHBondContact O-CB 3.49Å; L616-S620 PolarHBondContact O-N 3.45Å; L616-D665 HydrophobicContact CD1-CB 4.27Å; L616-D665 WeakPolarHBondContact CD1-OD2 3.45Å; L616-I666 HydrophobicContact CD2-CB 4.34Å; L616-I666 HydrophobicContact CD2-CG1 3.85Å
617	K	94.1	Very high	91.2	Very high	117 Å²	117	34.9 Å²	34.9	51%	0.509	21%	0.21	S	C	.	.	H	α-helix	trans	-59	-42	172.8	-72.8	163.8	-170.6	161.9	0	111.4	A542 D613 S614 S620 G621	A542-K617 VanDerWaalsContact CB-O 3.25Å; A542-K617 WeakPolarHBondContact CB-O 3.42Å; D613-K617 WeakPolarHBondContact O-CB 3.42Å; D613-K617 WeakPolarHBondContact O-CD 3.31Å; D613-K617 WeakPolarHBondContact O-CG 3.31Å; D613-K617 PolarHBondContact O-N 3.32Å; D613-K617 VanDerWaalsContact O-N 3.1Å; S614-K617 PolarHBondContact O-N 3.09Å; K617-S620 WeakPolarHBondContact O-CB 3.5Å; K617-S620 PolarHBondContact O-N 2.99Å; K617-G621 PolarHBondContact O-N 3.48Å
618	R	95.3	Very high	92.5	Very high	16 Å²	16	28.7 Å²	28.7	6%	0.06	17%	0.168	C	C	.	.	H	α-helix	trans	-66.9	-41.1	-178.9	-163.5	168.1	67.1	60.9	20.2	112.1	E538 G601 E610 S614 F615 L616 M622	E538-R618 HydrophobicContact CB-CG 4.41Å; E538-R618 HydrophobicContact CG-CG 3.28Å; E538-R618 WeakPolarHBondContact OE1-CD 3.49Å; E538-R618 IonicContact OE1-CZ 3.22Å; E538-R618 IonicContact OE1-NE 2.65Å; E538-R618 IonicContact OE1-NH1 3.15Å; E538-R618 PolarHBondContact OE1-NH1 2.9Å; G601-R618 PolarHBondContact O-NH2 3.05Å; E610-R618 IonicContact OE1-CZ 2.68Å; E610-R618 IonicContact OE1-NE 3.86Å; E610-R618 PolarHBondContact OE1-NE 3.43Å; E610-R618 IonicContact OE1-NH2 2.68Å; E610-R618 PolarHBondContact OE1-NH2 3.33Å; E610-R618 IonicContact OE2-CZ 3.39Å; E610-R618 IonicContact OE2-NE 2.82Å; E610-R618 PolarHBondContact OE2-NE 3.42Å; E610-R618 IonicContact OE2-NH2 2.67Å; S614-R618 WeakPolarHBondContact O-CB 3.45Å; S614-R618 PolarHBondContact O-N 3.26Å; F615-R618 WeakPolarHBondContact O-CB 3.49Å; F615-R618 PolarHBondContact O-N 3.46Å; L616-R618 VanDerWaalsContact C-N 3.28Å; L616-R618 PolarHBondContact O-N 2.93Å; R618-M622 HydrophobicContact CG-CE 4.39Å; R618-M622 WeakPolarHBondContact O-CE 3.23Å; R618-M622 WeakPolarHBondContact O-CG 3.5Å; R618-M622 PolarHBondContact O-N 2.87Å
619	M	95.1	Very high	93.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-69.3	-40.5	171.5	-63.3	-56.5	171.2	0	0	112.2	K576 C577 Y579 G601 F615 L616 M622 I623 L670	K576-M619 WeakPolarHBondContact O-CE 3.33Å; C577-M619 HydrophobicContact CB-SD 3.75Å; Y579-M619 HydrophobicContact CD2-CG 4.22Å; Y579-M619 HydrophobicContact CD2-SD 4.01Å; Y579-M619 HydrophobicContact CE2-CE 4.17Å; Y579-M619 HydrophobicContact CE2-CG 4.31Å; Y579-M619 HydrophobicContact CE2-SD 4.19Å; G601-M619 WeakPolarHBondContact O-CE 3.5Å; F615-M619 HydrophobicContact CD1-CG 4.45Å; F615-M619 HydrophobicContact CD2-CE 3.77Å; F615-M619 HydrophobicContact CD2-CG 4.46Å; F615-M619 HydrophobicContact CE1-CG 4.18Å; F615-M619 HydrophobicContact CE2-CE 3.24Å; F615-M619 HydrophobicContact CE2-CG 4.22Å; F615-M619 HydrophobicContact CZ-CE 3.8Å; F615-M619 HydrophobicContact CZ-CG 4.07Å; F615-M619 WeakPolarHBondContact O-CG 3.34Å; F615-M619 PolarHBondContact O-N 3.35Å; L616-M619 PolarHBondContact O-N 2.97Å; M619-M622 HydrophobicContact CE-CE 4.38Å; M619-M622 PolarHBondContact O-N 3.28Å; M619-M622 HydrophobicContact SD-CE 3.53Å; M619-M622 VanDerWaalsContact SD-CE 3.53Å; M619-I623 WeakPolarHBondContact O-CG1 3.45Å; M619-I623 PolarHBondContact O-N 3.04Å; M619-L670 HydrophobicContact CB-CD2 4Å
620	S	95.3	Very high	93.7	Very high	8 Å²	8	24.8 Å²	24.8	6%	0.056	14%	0.138	C	C	.	.	H	α-helix	trans	-55.8	-52.3	175.1	-176.2	0	0	0	0	111.3	L616 K617 M622 I623 R624 D673	L616-S620 WeakPolarHBondContact O-CB 3.49Å; L616-S620 PolarHBondContact O-N 3.45Å; K617-S620 WeakPolarHBondContact O-CB 3.5Å; K617-S620 PolarHBondContact O-N 2.99Å; S620-M622 VanDerWaalsContact C-N 3.34Å; S620-M622 PolarHBondContact O-N 3.26Å; S620-I623 PolarHBondContact O-N 3.14Å; S620-R624 WeakPolarHBondContact O-CB 3.33Å; S620-R624 WeakPolarHBondContact O-CG 3.37Å; S620-R624 PolarHBondContact O-N 2.89Å; S620-R624 PolarHBondContact OG-NE 3.32Å; S620-D673 WeakPolarHBondContact CB-OD2 3.44Å; S620-D673 PolarHBondContact OG-OD1 3.41Å; S620-D673 PolarHBondContact OG-OD2 3.1Å
621	G	96.5	Very high	93.8	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.8	-40.5	179.1	0	0	0	0	0	113.5	G537 V541 K617 R624 L625	G537-G621 CarbonylContact O-C 3.56Å; G537-G621 WeakPolarHBondContact O-CA 3.42Å; V541-G621 WeakPolarHBondContact CG1-O 3.35Å; K617-G621 PolarHBondContact O-N 3.48Å; G621-R624 PolarHBondContact O-N 3.5Å; G621-L625 WeakPolarHBondContact O-CB 3.35Å; G621-L625 PolarHBondContact O-N 2.92Å
622	M	96.8	Very high	94	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-66.1	-42.8	175.5	-74.4	-171.3	-73.3	0	0	112.8	V534 G537 E538 L573 K576 C577 R618 M619 S620 L625 Y626	V534-M622 HydrophobicContact CG1-SD 3.97Å; G537-M622 PolarHBondContact O-N 3.28Å; E538-M622 HydrophobicContact CB-CG 4.15Å; E538-M622 HydrophobicContact CB-SD 4.22Å; E538-M622 HydrophobicContact CG-CE 4.31Å; E538-M622 HydrophobicContact CG-SD 4.23Å; L573-M622 HydrophobicContact CD1-CB 3.85Å; L573-M622 HydrophobicContact CD1-CG 4.39Å; K576-M622 HydrophobicContact CB-CE 4.29Å; K576-M622 HydrophobicContact CB-SD 3.79Å; K576-M622 HydrophobicContact CD-SD 4.45Å; C577-M622 HydrophobicContact CB-CB 4.42Å; C577-M622 HydrophobicContact CB-CE 3.86Å; C577-M622 HydrophobicContact CB-SD 4.13Å; R618-M622 HydrophobicContact CG-CE 4.39Å; R618-M622 WeakPolarHBondContact O-CE 3.23Å; R618-M622 WeakPolarHBondContact O-CG 3.5Å; R618-M622 PolarHBondContact O-N 2.87Å; M619-M622 HydrophobicContact CE-CE 4.38Å; M619-M622 PolarHBondContact O-N 3.28Å; M619-M622 HydrophobicContact SD-CE 3.53Å; M619-M622 VanDerWaalsContact SD-CE 3.53Å; S620-M622 VanDerWaalsContact C-N 3.34Å; S620-M622 PolarHBondContact O-N 3.26Å; M622-L625 PolarHBondContact O-N 2.88Å; M622-Y626 WeakPolarHBondContact O-CB 3.49Å; M622-Y626 PolarHBondContact O-N 2.77Å
623	I	96.3	Very high	94.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-70.5	-35.9	176.3	-67.3	-61	0	0	0	111.8	M619 S620 Y626 A627 W653 L670 F674	M619-I623 WeakPolarHBondContact O-CG1 3.45Å; M619-I623 PolarHBondContact O-N 3.04Å; S620-I623 PolarHBondContact O-N 3.14Å; I623-Y626 PolarHBondContact O-N 3.23Å; I623-A627 WeakPolarHBondContact O-CB 3.28Å; I623-A627 PolarHBondContact O-N 2.69Å; I623-W653 HydrophobicContact CD1-CZ2 4.39Å; I623-W653 HydrophobicContact CG2-CH2 4.45Å; I623-W653 HydrophobicContact CG2-CZ2 4.23Å; I623-L670 HydrophobicContact CB-CD2 4.26Å; I623-L670 HydrophobicContact CG1-CD1 4.25Å; I623-L670 HydrophobicContact CG1-CD2 3.94Å; I623-F674 HydrophobicContact CG2-CB 3.92Å; I623-F674 HydrophobicContact CG2-CD2 4.01Å; I623-F674 HydrophobicContact CG2-CG 4.47Å
624	R	97	Very high	94.1	Very high	6 Å²	6	20.2 Å²	20.2	2%	0.023	10%	0.097	C	C	.	.	H	α-helix	trans	-62.6	-42.8	172.5	-73.5	170.3	174.1	-82.1	-1.4	111.7	V541 H545 S620 G621 A627 A628 D673 E676 V677	V541-R624 HydrophobicContact CG1-CB 3.91Å; H545-R624 PolarHBondContact ND1-NH1 3.22Å; H545-R624 PolarHBondContact ND1-NH2 3.38Å; S620-R624 WeakPolarHBondContact O-CB 3.33Å; S620-R624 WeakPolarHBondContact O-CG 3.37Å; S620-R624 PolarHBondContact O-N 2.89Å; S620-R624 PolarHBondContact OG-NE 3.32Å; G621-R624 PolarHBondContact O-N 3.5Å; R624-A627 PolarHBondContact O-N 3.25Å; R624-A628 PolarHBondContact O-N 2.8Å; R624-D673 HydrophobicContact CG-CB 4.05Å; R624-D673 IonicContact CZ-OD1 2.74Å; R624-D673 IonicContact NE-OD1 3.62Å; R624-D673 PolarHBondContact NE-OD1 2.79Å; R624-D673 IonicContact NH2-OD1 2.63Å; R624-D673 PolarHBondContact NH2-OD1 2.91Å; R624-E676 IonicContact CZ-OE2 3.27Å; R624-E676 IonicContact NH1-OE2 2.69Å; R624-E676 PolarHBondContact NH1-OE2 3.46Å; R624-E676 IonicContact NH2-OE2 3.54Å; R624-E676 PolarHBondContact NH2-OE2 2.85Å; R624-V677 HydrophobicContact CB-CG2 4.14Å; R624-V677 HydrophobicContact CG-CG2 3.94Å
625	L	96.8	Very high	93.9	Very high	12 Å²	12	20.2 Å²	20.2	6%	0.063	10%	0.095	C	C	.	.	H	α-helix	trans	-63.3	-46.6	173.5	177.8	60	0	0	0	111.6	F533 I551 G621 M622 A627 A628 V629	F533-L625 VanDerWaalsContact O-CD2 3.26Å; F533-L625 WeakPolarHBondContact O-CD2 3.44Å; I551-L625 HydrophobicContact CB-CD1 4.03Å; I551-L625 HydrophobicContact CG2-CD1 3.74Å; I551-L625 HydrophobicContact CG2-CD2 4.37Å; G621-L625 WeakPolarHBondContact O-CB 3.35Å; G621-L625 PolarHBondContact O-N 2.92Å; M622-L625 PolarHBondContact O-N 2.88Å; L625-A627 VanDerWaalsContact C-N 3.34Å; L625-A627 PolarHBondContact O-N 3.31Å; L625-A628 WeakPolarHBondContact O-CB 3.28Å; L625-A628 PolarHBondContact O-N 2.82Å; L625-A628 VanDerWaalsContact O-N 3.12Å; L625-V629 HydrophobicContact CD1-CG2 4.38Å; L625-V629 WeakPolarHBondContact O-CG2 3.44Å; L625-V629 PolarHBondContact O-N 2.74Å
626	Y	96.3	Very high	93.5	Very high	14 Å²	14	24.5 Å²	24.5	6%	0.055	11%	0.112	C	C	.	.	H	α-helix	trans	-57.5	-46.3	175.6	178.4	-104.8	0	0	0	112.1	L570 L573 M622 I623 A628 V629 I630 H645 W653 F674	L570-Y626 HydrophobicContact CD2-CD2 4.4Å; L570-Y626 HydrophobicContact CD2-CE2 3.92Å; L573-Y626 HydrophobicContact CD2-CD2 3.32Å; L573-Y626 HydrophobicContact CD2-CE2 4.08Å; L573-Y626 HydrophobicContact CD2-CG 3.87Å; M622-Y626 WeakPolarHBondContact O-CB 3.49Å; M622-Y626 PolarHBondContact O-N 2.77Å; I623-Y626 PolarHBondContact O-N 3.23Å; Y626-A628 PolarHBondContact O-N 3.05Å; Y626-V629 PolarHBondContact O-N 2.66Å; Y626-I630 HydrophobicContact CE1-CG2 4.43Å; Y626-I630 HydrophobicContact CE2-CG2 4.44Å; Y626-I630 WeakPolarHBondContact O-CG1 3.43Å; Y626-I630 PolarHBondContact O-N 2.94Å; Y626-I630 VanDerWaalsContact O-N 3.14Å; Y626-H645 AromaticContact CE2-NE2 3.14Å; Y626-H645 WeakPolarHBondContact CE2-NE2 3.47Å; Y626-H645 AromaticContact CZ-NE2 3.42Å; Y626-H645 PolarHBondContact OH-NE2 3.48Å; Y626-H645 VanDerWaalsContact OH-NE2 3.11Å; Y626-W653 HydrophobicContact CE1-CG 4.4Å; Y626-F674 HydrophobicContact CD1-CE2 4.13Å; Y626-F674 HydrophobicContact CE1-CE2 4.26Å
627	A	95.9	Very high	92.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63	-25.4	176.5	0	0	0	0	0	113.5	I623 R624 L625 I630 Q631 F674 V677 C678	I623-A627 WeakPolarHBondContact O-CB 3.28Å; I623-A627 PolarHBondContact O-N 2.69Å; R624-A627 PolarHBondContact O-N 3.25Å; L625-A627 VanDerWaalsContact C-N 3.34Å; L625-A627 PolarHBondContact O-N 3.31Å; A627-I630 WeakPolarHBondContact O-CG1 3.31Å; A627-Q631 PolarHBondContact O-NE2 3.25Å; A627-F674 HydrophobicContact CB-CD2 3.71Å; A627-F674 HydrophobicContact CB-CE2 3.95Å; A627-F674 HydrophobicContact CB-CG 4.38Å; A627-V677 HydrophobicContact CB-CB 3.81Å; A627-V677 HydrophobicContact CB-CG1 3.53Å; A627-C678 HydrophobicContact CB-CB 4.13Å
628	A	95.4	Very high	90.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-78.9	-45.2	170.6	0	0	0	0	0	111.8	A548 R624 L625 Y626 I630 Q631 L632 V677	A548-A628 HydrophobicContact CB-CB 4.06Å; A548-A628 VanDerWaalsContact O-CB 3.29Å; A548-A628 WeakPolarHBondContact O-CB 3.49Å; R624-A628 PolarHBondContact O-N 2.8Å; L625-A628 WeakPolarHBondContact O-CB 3.28Å; L625-A628 PolarHBondContact O-N 2.82Å; L625-A628 VanDerWaalsContact O-N 3.12Å; Y626-A628 PolarHBondContact O-N 3.05Å; A628-I630 PolarHBondContact O-N 3.25Å; A628-Q631 WeakPolarHBondContact O-CG 3.31Å; A628-Q631 PolarHBondContact O-N 2.85Å; A628-L632 HydrophobicContact CB-CD1 3.96Å; A628-L632 WeakPolarHBondContact O-CB 3.43Å; A628-L632 WeakPolarHBondContact O-CD1 3.38Å; A628-L632 WeakPolarHBondContact O-CG 3.44Å; A628-L632 PolarHBondContact O-N 2.73Å; A628-L632 VanDerWaalsContact O-N 3.1Å; A628-V677 HydrophobicContact CB-CG1 4.36Å
629	V	94.8	Very high	89.1	Confident	8 Å²	8	30.5 Å²	30.5	5%	0.048	17%	0.166	C	C	.	.	H	α-helix	trans	-57.7	-44.2	179.5	173.9	0	0	0	0	112	A555 W559 L625 Y626 Q631	A555-V629 HydrophobicContact CB-CG2 4.04Å; W559-V629 HydrophobicContact CE3-CG1 3.97Å; W559-V629 HydrophobicContact CZ3-CG1 3.82Å; L625-V629 HydrophobicContact CD1-CG2 4.38Å; L625-V629 WeakPolarHBondContact O-CG2 3.44Å; L625-V629 PolarHBondContact O-N 2.74Å; Y626-V629 PolarHBondContact O-N 2.66Å; V629-Q631 PolarHBondContact O-N 3.41Å
630	I	93.4	Very high	87.4	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-16.1	-177.3	59	175.4	0	0	0	115.7	Y626 A627 A628 H645 G646 L647 F674 C678	Y626-I630 HydrophobicContact CE1-CG2 4.43Å; Y626-I630 HydrophobicContact CE2-CG2 4.44Å; Y626-I630 WeakPolarHBondContact O-CG1 3.43Å; Y626-I630 PolarHBondContact O-N 2.94Å; Y626-I630 VanDerWaalsContact O-N 3.14Å; A627-I630 WeakPolarHBondContact O-CG1 3.31Å; A628-I630 PolarHBondContact O-N 3.25Å; I630-H645 WeakPolarHBondContact CA-O 3.39Å; I630-H645 VanDerWaalsContact CG2-CD2 3.45Å; I630-H645 WeakPolarHBondContact CG2-CD2 3.38Å; I630-G646 CarbonylContact O-C 3.43Å; I630-L647 PolarHBondContact O-N 2.99Å; I630-L647 VanDerWaalsContact O-N 3.11Å; I630-F674 HydrophobicContact CD1-CE2 3.74Å; I630-F674 HydrophobicContact CD1-CZ 3.6Å; I630-C678 HydrophobicContact CD1-CB 4.45Å; I630-C678 VanDerWaalsContact CD1-SG 3.58Å
631	Q	91.3	Very high	85.8	Confident	38 Å²	38	41.8 Å²	41.8	18%	0.178	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-18.7	-175.9	77.7	179.1	-70.4	0	0	113.8	A627 A628 V629 L647 V677 A681	A627-Q631 PolarHBondContact O-NE2 3.25Å; A628-Q631 WeakPolarHBondContact O-CG 3.31Å; A628-Q631 PolarHBondContact O-N 2.85Å; V629-Q631 PolarHBondContact O-N 3.41Å; Q631-L647 HydrophobicContact CB-CD2 3.67Å; Q631-V677 PolarHBondContact NE2-O 3.45Å; Q631-A681 HydrophobicContact CB-CB 3.96Å
632	L	91.3	Very high	84.4	Confident	21 Å²	21	47 Å²	47	11%	0.11	27%	0.265	C	S	.	.			trans	-96.1	143.8	-176.7	-63.9	171.7	0	0	0	110.6	F549 V553 S556 A628	F549-L632 HydrophobicContact CB-CD1 4.26Å; F549-L632 HydrophobicContact CD1-CD1 3.94Å; F549-L632 HydrophobicContact CD1-CD2 4.38Å; F549-L632 WeakPolarHBondContact O-CD1 3.32Å; V553-L632 HydrophobicContact CB-CB 4.13Å; V553-L632 HydrophobicContact CB-CD1 4.11Å; V553-L632 HydrophobicContact CG2-CB 4.16Å; S556-L632 WeakPolarHBondContact CB-O 3.34Å; S556-L632 PolarHBondContact OG-O 2.9Å; A628-L632 HydrophobicContact CB-CD1 3.96Å; A628-L632 WeakPolarHBondContact O-CB 3.43Å; A628-L632 WeakPolarHBondContact O-CD1 3.38Å; A628-L632 WeakPolarHBondContact O-CG 3.44Å; A628-L632 PolarHBondContact O-N 2.73Å; A628-L632 VanDerWaalsContact O-N 3.1Å
633	R	89.1	Confident	83.2	Confident	88 Å²	88	49 Å²	49	33%	0.332	28%	0.277	S	S	.	.			trans	-125.4	145.3	170	-168.6	178.8	-164.6	147.1	6.2	109.6	V553 E560 K639 G641 V643	V553-R633 VanDerWaalsContact CG2-O 3.32Å; V553-R633 WeakPolarHBondContact CG2-O 3.42Å; E560-R633 VanDerWaalsContact CD-NH2 3.32Å; E560-R633 IonicContact OE1-CZ 2.77Å; E560-R633 IonicContact OE1-NE 2.82Å; E560-R633 IonicContact OE1-NH2 3.51Å; E560-R633 PolarHBondContact OE1-NH2 3.23Å; E560-R633 IonicContact OE2-CZ 3.22Å; E560-R633 IonicContact OE2-NE 2.93Å; E560-R633 PolarHBondContact OE2-NE 3.47Å; E560-R633 IonicContact OE2-NH2 3.67Å; E560-R633 PolarHBondContact OE2-NH2 3.4Å; R633-K639 PolarHBondContact NH2-O 2.92Å; R633-K639 VanDerWaalsContact NH2-O 3.1Å; R633-G641 VanDerWaalsContact CZ-O 3.25Å; R633-G641 PolarHBondContact NH1-O 3.27Å; R633-G641 PolarHBondContact NH2-O 3.15Å; R633-V643 HydrophobicContact CB-CG2 4.41Å; R633-V643 HydrophobicContact CG-CG2 4.18Å
634	W	89.9	Confident	82.2	Confident	12 Å²	12	51.5 Å²	51.5	5%	0.045	29%	0.294	C	S	.	.			trans	-65.4	121.9	173.2	-171.1	-115.2	0	0	0	111.3	L490 R491 F494 V553 V554 Y636 W745	L490-W634 HydrophobicContact CD2-CZ3 4.27Å; L490-W634 HydrophobicContact CG-CH2 4.46Å; L490-W634 HydrophobicContact CG-CZ3 4.35Å; R491-W634 HydrophobicContact CB-CH2 4.44Å; R491-W634 HydrophobicContact CB-CZ2 4.34Å; R491-W634 HydrophobicContact CG-CZ2 4.32Å; F494-W634 HydrophobicContact CB-CH2 3.47Å; F494-W634 VanDerWaalsContact CB-CH2 3.47Å; F494-W634 HydrophobicContact CB-CZ2 3.43Å; F494-W634 VanDerWaalsContact CB-CZ2 3.43Å; F494-W634 HydrophobicContact CB-CZ3 4.28Å; F494-W634 AromaticContact CD1-CE2 3.68Å; F494-W634 HydrophobicContact CD1-CH2 4.46Å; F494-W634 AromaticContact CD1-CZ2 3.61Å; F494-W634 HydrophobicContact CD1-CZ2 3.61Å; F494-W634 AromaticContact CD1-NE1 3.68Å; F494-W634 AromaticContact CD2-CD2 3.8Å; F494-W634 HydrophobicContact CD2-CD2 3.8Å; F494-W634 AromaticContact CD2-CE2 3.63Å; F494-W634 AromaticContact CD2-CE3 3.92Å; F494-W634 HydrophobicContact CD2-CE3 3.92Å; F494-W634 AromaticContact CD2-CH2 3.84Å; F494-W634 HydrophobicContact CD2-CH2 3.84Å; F494-W634 AromaticContact CD2-CZ2 3.67Å; F494-W634 HydrophobicContact CD2-CZ2 3.67Å; F494-W634 AromaticContact CD2-CZ3 3.95Å; F494-W634 HydrophobicContact CD2-CZ3 3.95Å; F494-W634 AromaticContact CE1-CE2 3.88Å; F494-W634 HydrophobicContact CE1-CZ2 4.29Å; F494-W634 AromaticContact CE1-NE1 3.47Å; F494-W634 AromaticContact CE2-CD2 3.78Å; F494-W634 HydrophobicContact CE2-CD2 3.78Å; F494-W634 AromaticContact CE2-CE2 3.83Å; F494-W634 HydrophobicContact CE2-CE3 4.2Å; F494-W634 HydrophobicContact CE2-CG 4.04Å; F494-W634 HydrophobicContact CE2-CZ2 4.33Å; F494-W634 AromaticContact CE2-NE1 3.99Å; F494-W634 HydrophobicContact CG-CD2 4.23Å; F494-W634 AromaticContact CG-CE2 3.56Å; F494-W634 AromaticContact CG-CH2 3.68Å; F494-W634 HydrophobicContact CG-CH2 3.68Å; F494-W634 AromaticContact CG-CZ2 3.26Å; F494-W634 HydrophobicContact CG-CZ2 3.26Å; F494-W634 HydrophobicContact CG-CZ3 4.27Å; F494-W634 AromaticContact CZ-CD1 3.79Å; F494-W634 HydrophobicContact CZ-CD2 4.19Å; F494-W634 AromaticContact CZ-CE2 3.95Å; F494-W634 HydrophobicContact CZ-CG 4.13Å; F494-W634 AromaticContact CZ-NE1 3.64Å; V553-W634 HydrophobicContact CG1-CE3 4.36Å; V553-W634 HydrophobicContact CG1-CZ3 4.25Å; V553-W634 HydrophobicContact CG2-CE3 4.16Å; V554-W634 HydrophobicContact CG2-CH2 4.46Å; V554-W634 HydrophobicContact CG2-CZ3 3.86Å; W634-Y636 VanDerWaalsContact C-N 3.31Å; W634-Y636 AromaticContact CE2-CD2 3.83Å; W634-Y636 HydrophobicContact CH2-CD2 4.4Å; W634-Y636 AromaticContact CZ2-CD2 3.7Å; W634-Y636 HydrophobicContact CZ2-CD2 3.7Å; W634-Y636 HydrophobicContact CZ2-CE2 4.31Å; W634-Y636 PolarHBondContact O-N 3.14Å; W634-W745 HydrophobicContact CE3-CH2 4.39Å; W634-W745 HydrophobicContact CH2-CZ3 4.44Å; W634-W745 HydrophobicContact CZ3-CH2 4.05Å; W634-W745 HydrophobicContact CZ3-CZ3 4.24Å
635	P	86.3	Confident	81.7	Confident	67 Å²	67	51.5 Å²	51.5	44%	0.435	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-14.2	-170	30.6	-36.2	0	0	0	114.2	W745	P635-W745 HydrophobicContact CG-CD2 3.94Å; P635-W745 HydrophobicContact CG-CE3 3.8Å; P635-W745 HydrophobicContact CG-CH2 3.67Å; P635-W745 HydrophobicContact CG-CZ2 3.81Å; P635-W745 HydrophobicContact CG-CZ3 3.67Å
636	Y	83.3	Confident	81.3	Confident	90 Å²	90	51.4 Å²	51.4	35%	0.353	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	12.6	-178.6	-48.6	-68.1	0	0	0	113.2	R491 W634 W745	R491-Y636 HydrophobicContact CB-CE2 4.22Å; R491-Y636 HydrophobicContact CG-CD2 4.31Å; R491-Y636 HydrophobicContact CG-CE2 4.36Å; W634-Y636 VanDerWaalsContact C-N 3.31Å; W634-Y636 AromaticContact CE2-CD2 3.83Å; W634-Y636 HydrophobicContact CH2-CD2 4.4Å; W634-Y636 AromaticContact CZ2-CD2 3.7Å; W634-Y636 HydrophobicContact CZ2-CD2 3.7Å; W634-Y636 HydrophobicContact CZ2-CE2 4.31Å; W634-Y636 PolarHBondContact O-N 3.14Å; Y636-W745 AromaticContact CE2-CE3 3.88Å; Y636-W745 HydrophobicContact CE2-CE3 3.88Å; Y636-W745 AromaticContact CE2-CZ3 3.85Å; Y636-W745 HydrophobicContact CE2-CZ3 3.85Å
637	G	70.2	Confident	81.1	Confident	41 Å²	41	52.3 Å²	52.3	42%	0.423	30%	0.301	S	S	.	.			trans	-75.2	139.6	178.1	0	0	0	0	0	113
638	S	59	Low	80.9	Confident	123 Å²	123	56.5 Å²	56.5	86%	0.86	32%	0.324	S	S	*	.	S	Bend	trans	-85	-11.6	178.8	56.5	0	0	0	0	114.6
639	K	61	Low	80.7	Confident	108 Å²	108	58.7 Å²	58.7	47%	0.47	33%	0.334	S	S	.	.			trans	-92	130.6	-177.9	-60.2	175	-171.9	170.8	0	110.3	E560 R633 G641	E560-K639 HydrophobicContact CG-CD 4.47Å; E560-K639 PolarHBondContact O-NZ 3.44Å; E560-K639 WeakPolarHBondContact OE1-CB 3.45Å; R633-K639 PolarHBondContact NH2-O 2.92Å; R633-K639 VanDerWaalsContact NH2-O 3.1Å; K639-G641 VanDerWaalsContact C-N 3.28Å
640	Q	58.8	Low	80.7	Confident	202 Å²	202	58.3 Å²	58.3	94%	0.944	33%	0.332	S	S	*	.			trans	-92.4	19.6	168.9	-69.9	172.1	-30.6	0	0	112.5
641	G	63.1	Low	80.7	Confident	42 Å²	42	61.6 Å²	61.6	43%	0.433	34%	0.344	S	S	.	.	S	Bend	trans	-69.6	176.5	-179.4	0	0	0	0	0	113.7	R633 K639	R633-G641 VanDerWaalsContact CZ-O 3.25Å; R633-G641 PolarHBondContact NH1-O 3.27Å; R633-G641 PolarHBondContact NH2-O 3.15Å; K639-G641 VanDerWaalsContact C-N 3.28Å
642	S	65.4	Low	80.8	Confident	111 Å²	111	64.6 Å²	64.6	78%	0.776	35%	0.353	S	S	*	.			trans	-62.7	137.2	168.8	48.8	0	0	0	0	111.3
643	V	72.5	Confident	80.9	Confident	41 Å²	41	63.8 Å²	63.8	25%	0.248	35%	0.349	C	S	.	.			trans	-61.2	131.5	169	179.3	0	0	0	0	108.2	R633 H645	R633-V643 HydrophobicContact CB-CG2 4.41Å; R633-V643 HydrophobicContact CG-CG2 4.18Å; V643-H645 PolarHBondContact O-N 3.35Å; V643-H645 VanDerWaalsContact O-N 3.14Å
644	P	74.8	Confident	81.1	Confident	54 Å²	54	59.6 Å²	59.6	35%	0.351	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-34.3	-172	-29.1	35.5	0	0	0	114.9	W559 E560	W559-P644 VanDerWaalsContact CD1-CB 3.45Å; W559-P644 HydrophobicContact CD2-CB 4.36Å; W559-P644 HydrophobicContact CG-CB 3.99Å; W559-P644 HydrophobicContact CG-CG 4.2Å; E560-P644 HydrophobicContact CB-CG 4.42Å
645	H	87.3	Confident	81.2	Confident	5 Å²	5	60.5 Å²	60.5	2%	0.023	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	76.1	-176.6	-172.2	77.8	0	0	0	110	W559 Y626 I630 V643 H649	W559-H645 HydrophobicContact CD2-CB 4.39Å; W559-H645 HydrophobicContact CE3-CB 4.25Å; W559-H645 HydrophobicContact CH2-CB 3.22Å; W559-H645 AromaticContact CH2-CD2 3.66Å; W559-H645 AromaticContact CH2-CG 3.31Å; W559-H645 AromaticContact CH2-ND1 3.92Å; W559-H645 HydrophobicContact CZ2-CB 3.43Å; W559-H645 VanDerWaalsContact CZ2-CB 3.43Å; W559-H645 AromaticContact CZ2-CG 3.86Å; W559-H645 HydrophobicContact CZ3-CB 3.69Å; W559-H645 AromaticContact CZ3-CD2 3.99Å; W559-H645 AromaticContact CZ3-CG 3.96Å; Y626-H645 AromaticContact CE2-NE2 3.14Å; Y626-H645 WeakPolarHBondContact CE2-NE2 3.47Å; Y626-H645 AromaticContact CZ-NE2 3.42Å; Y626-H645 PolarHBondContact OH-NE2 3.48Å; Y626-H645 VanDerWaalsContact OH-NE2 3.11Å; I630-H645 WeakPolarHBondContact CA-O 3.39Å; I630-H645 VanDerWaalsContact CG2-CD2 3.45Å; I630-H645 WeakPolarHBondContact CG2-CD2 3.38Å; V643-H645 PolarHBondContact O-N 3.35Å; V643-H645 VanDerWaalsContact O-N 3.14Å; H645-H649 VanDerWaalsContact CE1-CB 3.46Å; H645-H649 WeakPolarHBondContact CE1-CB 3.46Å; H645-H649 AromaticContact CE1-CD2 3.97Å; H645-H649 AromaticContact CE1-CG 3.32Å; H645-H649 AromaticContact CE1-ND1 3.42Å; H645-H649 PolarHBondContact CE1-ND1 3Å; H645-H649 AromaticContact ND1-CD2 3.6Å; H645-H649 AromaticContact ND1-CE1 3.73Å; H645-H649 AromaticContact ND1-CG 3.41Å; H645-H649 AromaticContact ND1-ND1 3.5Å; H645-H649 PolarHBondContact ND1-ND1 2.88Å; H645-H649 AromaticContact ND1-NE2 3.86Å; H645-H649 AromaticContact NE2-CG 3.98Å
646	G	88	Confident	81.3	Confident	10 Å²	10	58.2 Å²	58.2	10%	0.103	33%	0.326	C	S	.	.			trans	-89.9	-169.8	-170.4	0	0	0	0	0	116.2	I630 N648 H649	I630-G646 CarbonylContact O-C 3.43Å; G646-N648 VanDerWaalsContact C-OD1 3.24Å; G646-N648 WeakPolarHBondContact CA-OD1 3.37Å; G646-N648 PolarHBondContact O-N 3.47Å; G646-N648 PolarHBondContact O-OD1 2.91Å; G646-H649 PolarHBondContact O-N 3.39Å
647	L	91.9	Very high	81.6	Confident	33 Å²	33	54 Å²	54	17%	0.173	31%	0.31	C	S	.	.	H	α-helix	trans	-55.3	-19.6	-179.2	-69	176.4	0	0	0	115	I630 Q631 H649 G650 W651 A681 L682 Q685 Y686	I630-L647 PolarHBondContact O-N 2.99Å; I630-L647 VanDerWaalsContact O-N 3.11Å; Q631-L647 HydrophobicContact CB-CD2 3.67Å; L647-H649 VanDerWaalsContact C-N 3.29Å; L647-H649 PolarHBondContact O-N 3.19Å; L647-G650 WeakPolarHBondContact O-CA 3.47Å; L647-G650 PolarHBondContact O-N 2.95Å; L647-G650 VanDerWaalsContact O-N 3.13Å; L647-W651 PolarHBondContact O-N 2.83Å; L647-A681 HydrophobicContact CD1-CB 4.2Å; L647-A681 HydrophobicContact CD2-CB 3.95Å; L647-L682 HydrophobicContact CB-CD2 4.2Å; L647-L682 HydrophobicContact CD2-CD2 4.01Å; L647-L682 HydrophobicContact CD2-CG 4.42Å; L647-Q685 HydrophobicContact CD1-CB 4.04Å; L647-Q685 HydrophobicContact CD1-CG 4.22Å; L647-Y686 HydrophobicContact CB-CE2 4.44Å
648	N	92.4	Very high	82.6	Confident	88 Å²	88	52.3 Å²	52.3	47%	0.471	29%	0.291	S	S	.	.	H	α-helix	trans	-61.5	-35.4	171.8	61.3	-60.4	0	0	0	112.3	G646 G650 W651 R652 Y686	G646-N648 VanDerWaalsContact C-OD1 3.24Å; G646-N648 WeakPolarHBondContact CA-OD1 3.37Å; G646-N648 PolarHBondContact O-N 3.47Å; G646-N648 PolarHBondContact O-OD1 2.91Å; N648-G650 VanDerWaalsContact C-N 3.34Å; N648-W651 PolarHBondContact O-N 2.71Å; N648-R652 PolarHBondContact O-N 3.02Å; N648-Y686 WeakPolarHBondContact CA-OH 3.48Å; N648-Y686 PolarHBondContact N-OH 2.99Å
649	H	91.9	Very high	84	Confident	47 Å²	47	51.5 Å²	51.5	22%	0.218	28%	0.277	C	S	.	.	H	α-helix	trans	-72.9	-29.9	174	-62.4	-93.5	0	0	0	111.5	H645 G646 L647 R652 W653	H645-H649 VanDerWaalsContact CE1-CB 3.46Å; H645-H649 WeakPolarHBondContact CE1-CB 3.46Å; H645-H649 AromaticContact CE1-CD2 3.97Å; H645-H649 AromaticContact CE1-CG 3.32Å; H645-H649 AromaticContact CE1-ND1 3.42Å; H645-H649 PolarHBondContact CE1-ND1 3Å; H645-H649 AromaticContact ND1-CD2 3.6Å; H645-H649 AromaticContact ND1-CE1 3.73Å; H645-H649 AromaticContact ND1-CG 3.41Å; H645-H649 AromaticContact ND1-ND1 3.5Å; H645-H649 PolarHBondContact ND1-ND1 2.88Å; H645-H649 AromaticContact ND1-NE2 3.86Å; H645-H649 AromaticContact NE2-CG 3.98Å; G646-H649 PolarHBondContact O-N 3.39Å; L647-H649 VanDerWaalsContact C-N 3.29Å; L647-H649 PolarHBondContact O-N 3.19Å; H649-R652 PolarHBondContact O-N 3.33Å; H649-W653 VanDerWaalsContact O-CB 3.32Å; H649-W653 WeakPolarHBondContact O-CB 3.33Å; H649-W653 PolarHBondContact O-N 2.98Å
650	G	93.3	Very high	85.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.9	-40.6	171.1	0	0	0	0	0	113.7	L647 N648 W653 L654	L647-G650 WeakPolarHBondContact O-CA 3.47Å; L647-G650 PolarHBondContact O-N 2.95Å; L647-G650 VanDerWaalsContact O-N 3.13Å; N648-G650 VanDerWaalsContact C-N 3.34Å; G650-W653 PolarHBondContact O-N 2.89Å; G650-L654 PolarHBondContact O-N 3.02Å
651	W	94.6	Very high	86.5	Confident	72 Å²	72	41 Å²	41	27%	0.273	23%	0.23	S	C	.	.	H	α-helix	trans	-62.5	-46.3	171.3	-178.9	-88.3	0	0	0	111.6	L647 N648 W653 L654 A655 Y686 Q689 F690 L693	L647-W651 PolarHBondContact O-N 2.83Å; N648-W651 PolarHBondContact O-N 2.71Å; W651-W653 VanDerWaalsContact C-N 3.34Å; W651-W653 PolarHBondContact O-N 3.3Å; W651-L654 PolarHBondContact O-N 2.94Å; W651-A655 WeakPolarHBondContact O-CB 3.26Å; W651-A655 PolarHBondContact O-N 3.36Å; W651-Y686 HydrophobicContact CB-CE2 3.91Å; W651-Y686 HydrophobicContact CD2-CD2 4.42Å; W651-Y686 HydrophobicContact CD2-CG 4.47Å; W651-Y686 HydrophobicContact CE3-CD1 4.31Å; W651-Y686 AromaticContact CE3-CD2 3.65Å; W651-Y686 HydrophobicContact CE3-CD2 3.65Å; W651-Y686 HydrophobicContact CE3-CE2 4.15Å; W651-Y686 AromaticContact CE3-CG 3.75Å; W651-Y686 HydrophobicContact CE3-CG 3.75Å; W651-Y686 HydrophobicContact CG-CE2 4.47Å; W651-Y686 HydrophobicContact CZ3-CD2 4.33Å; W651-Y686 HydrophobicContact CZ3-CG 4.11Å; W651-Q689 HydrophobicContact CH2-CB 3.87Å; W651-Q689 HydrophobicContact CZ3-CB 4.43Å; W651-F690 HydrophobicContact CZ3-CB 4.17Å; W651-F690 HydrophobicContact CZ3-CD2 4.39Å; W651-L693 HydrophobicContact CH2-CB 4.25Å; W651-L693 HydrophobicContact CH2-CD1 3.93Å; W651-L693 HydrophobicContact CZ2-CD1 4.17Å; W651-L693 HydrophobicContact CZ3-CD1 4.17Å
652	R	92.4	Very high	87.7	Confident	101 Å²	101	39.5 Å²	39.5	38%	0.381	21%	0.213	S	C	.	.	H	α-helix	trans	-59.2	-43.4	175.1	-174	176.6	-178.6	140.4	5.2	111.6	E432 S434 T435 N648 H649 A655 Q656	E432-R652 IonicContact OE2-NH2 3.05Å; S434-R652 PolarHBondContact OG-NH2 3.28Å; T435-R652 PolarHBondContact OG1-NE 2.87Å; T435-R652 PolarHBondContact OG1-NH2 3.12Å; N648-R652 PolarHBondContact O-N 3.02Å; H649-R652 PolarHBondContact O-N 3.33Å; R652-A655 PolarHBondContact O-N 3.23Å; R652-Q656 VanDerWaalsContact O-CB 3.24Å; R652-Q656 WeakPolarHBondContact O-CB 3.4Å; R652-Q656 PolarHBondContact O-N 3.5Å
653	W	93.3	Very high	88.7	Confident	5 Å²	5	37 Å²	37	2%	0.019	19%	0.19	C	C	.	.	H	α-helix	trans	-59	-51.3	177.6	-174.5	92.4	0	0	0	111.7	Y579 P582 I623 Y626 H649 G650 W651 Q656 M657 L670 L671 F674	Y579-W653 PolarHBondContact O-NE1 3.32Å; P582-W653 HydrophobicContact CG-CG 4.2Å; I623-W653 HydrophobicContact CD1-CZ2 4.39Å; I623-W653 HydrophobicContact CG2-CH2 4.45Å; I623-W653 HydrophobicContact CG2-CZ2 4.23Å; Y626-W653 HydrophobicContact CE1-CG 4.4Å; H649-W653 VanDerWaalsContact O-CB 3.32Å; H649-W653 WeakPolarHBondContact O-CB 3.33Å; H649-W653 PolarHBondContact O-N 2.98Å; G650-W653 PolarHBondContact O-N 2.89Å; W651-W653 VanDerWaalsContact C-N 3.34Å; W651-W653 PolarHBondContact O-N 3.3Å; W653-Q656 PolarHBondContact O-N 2.9Å; W653-M657 HydrophobicContact CD2-CG 3.96Å; W653-M657 HydrophobicContact CE3-CG 4.13Å; W653-M657 HydrophobicContact CH2-CE 4.06Å; W653-M657 HydrophobicContact CH2-CG 3.97Å; W653-M657 HydrophobicContact CZ2-CE 3.97Å; W653-M657 HydrophobicContact CZ2-CG 3.79Å; W653-M657 HydrophobicContact CZ2-SD 4.06Å; W653-M657 HydrophobicContact CZ3-CG 4.13Å; W653-M657 WeakPolarHBondContact O-CB 3.08Å; W653-M657 VanDerWaalsContact O-CG 3.29Å; W653-M657 WeakPolarHBondContact O-CG 3.5Å; W653-M657 PolarHBondContact O-N 2.94Å; W653-L670 HydrophobicContact CH2-CB 4.4Å; W653-L670 HydrophobicContact CZ2-CB 4.47Å; W653-L671 HydrophobicContact CH2-CD2 4.3Å; W653-L671 HydrophobicContact CZ3-CD2 4.04Å; W653-F674 HydrophobicContact CD2-CD2 4.05Å; W653-F674 HydrophobicContact CD2-CE2 4.09Å; W653-F674 HydrophobicContact CD2-CG 4.38Å; W653-F674 HydrophobicContact CD2-CZ 4.44Å; W653-F674 HydrophobicContact CE3-CB 4.26Å; W653-F674 AromaticContact CE3-CD1 3.62Å; W653-F674 HydrophobicContact CE3-CD1 3.62Å; W653-F674 AromaticContact CE3-CD2 3.67Å; W653-F674 HydrophobicContact CE3-CD2 3.67Å; W653-F674 AromaticContact CE3-CE1 3.8Å; W653-F674 HydrophobicContact CE3-CE1 3.8Å; W653-F674 AromaticContact CE3-CE2 3.86Å; W653-F674 HydrophobicContact CE3-CE2 3.86Å; W653-F674 AromaticContact CE3-CG 3.56Å; W653-F674 HydrophobicContact CE3-CG 3.56Å; W653-F674 AromaticContact CE3-CZ 3.93Å; W653-F674 HydrophobicContact CE3-CZ 3.93Å; W653-F674 HydrophobicContact CG-CE2 4.43Å; W653-F674 HydrophobicContact CH2-CB 3.69Å; W653-F674 HydrophobicContact CH2-CD2 4.22Å; W653-F674 AromaticContact CH2-CG 3.91Å; W653-F674 HydrophobicContact CH2-CG 3.91Å; W653-F674 HydrophobicContact CZ3-CB 3.47Å; W653-F674 VanDerWaalsContact CZ3-CB 3.47Å; W653-F674 AromaticContact CZ3-CD1 3.52Å; W653-F674 HydrophobicContact CZ3-CD1 3.52Å; W653-F674 AromaticContact CZ3-CD2 3.77Å; W653-F674 HydrophobicContact CZ3-CD2 3.77Å; W653-F674 HydrophobicContact CZ3-CE1 4.19Å; W653-F674 HydrophobicContact CZ3-CE2 4.41Å; W653-F674 AromaticContact CZ3-CG 3.28Å; W653-F674 HydrophobicContact CZ3-CG 3.28Å
654	L	93.5	Very high	89.2	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-48.9	176.8	-78.8	174.5	0	0	0	112.3	G650 W651 Q656 M657 L658 L671 F674 L675 L682 F690 L693	G650-L654 PolarHBondContact O-N 3.02Å; W651-L654 PolarHBondContact O-N 2.94Å; L654-Q656 VanDerWaalsContact C-N 3.29Å; L654-Q656 PolarHBondContact O-N 3.49Å; L654-M657 PolarHBondContact O-N 3.45Å; L654-L658 VanDerWaalsContact O-CG 3.3Å; L654-L658 WeakPolarHBondContact O-CG 3.39Å; L654-L658 PolarHBondContact O-N 3.17Å; L654-L671 HydrophobicContact CD2-CD2 3.93Å; L654-F674 HydrophobicContact CD1-CD1 4.36Å; L654-F674 HydrophobicContact CD1-CE1 3.94Å; L654-F674 HydrophobicContact CD2-CD1 3.9Å; L654-F674 HydrophobicContact CD2-CE1 4.14Å; L654-F674 HydrophobicContact CG-CD1 4Å; L654-F674 HydrophobicContact CG-CE1 3.7Å; L654-L675 HydrophobicContact CD1-CD2 3.94Å; L654-L675 HydrophobicContact CD2-CD2 4.03Å; L654-L675 HydrophobicContact CD2-CG 4.32Å; L654-L682 HydrophobicContact CD1-CD1 3.71Å; L654-F690 HydrophobicContact CD1-CE2 4.02Å; L654-L693 HydrophobicContact CB-CD1 4.19Å; L654-L693 HydrophobicContact CB-CD2 4.34Å; L654-L693 HydrophobicContact CD1-CD2 4.17Å
655	A	92	Very high	89.7	Confident	30 Å²	30	34.7 Å²	34.7	25%	0.248	18%	0.178	C	C	.	.	H	α-helix	trans	-60.5	-40.1	-179.4	0	0	0	0	0	111.9	W651 R652 N659	W651-A655 WeakPolarHBondContact O-CB 3.26Å; W651-A655 PolarHBondContact O-N 3.36Å; R652-A655 PolarHBondContact O-N 3.23Å; A655-N659 WeakPolarHBondContact O-CB 3.44Å; A655-N659 PolarHBondContact O-N 2.65Å; A655-N659 PolarHBondContact O-ND2 2.7Å
656	Q	88.8	Confident	89.8	Confident	19 Å²	19	35.1 Å²	35.1	9%	0.089	18%	0.18	C	C	.	.	H	α-helix	trans	-74.1	-38.7	179.3	-159.8	-175.6	-58.8	0	0	112.2	T435 V581 P582 R652 W653 L654 L658 N659 M660	T435-Q656 PolarHBondContact OG1-OE1 3.05Å; V581-Q656 PolarHBondContact O-NE2 3.31Å; P582-Q656 HydrophobicContact CB-CB 4Å; P582-Q656 HydrophobicContact CB-CG 3.97Å; P582-Q656 HydrophobicContact CG-CB 3.86Å; P582-Q656 HydrophobicContact CG-CG 4.22Å; P582-Q656 PolarHBondContact O-NE2 2.94Å; R652-Q656 VanDerWaalsContact O-CB 3.24Å; R652-Q656 WeakPolarHBondContact O-CB 3.4Å; R652-Q656 PolarHBondContact O-N 3.5Å; W653-Q656 PolarHBondContact O-N 2.9Å; L654-Q656 VanDerWaalsContact C-N 3.29Å; L654-Q656 PolarHBondContact O-N 3.49Å; Q656-L658 VanDerWaalsContact C-N 3.34Å; Q656-L658 PolarHBondContact O-N 3.29Å; Q656-N659 PolarHBondContact O-N 2.87Å; Q656-M660 WeakPolarHBondContact O-CG 3.38Å
657	M	89.6	Confident	90	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-58.1	-44.1	172	-75.9	-70.6	-76.2	0	0	111.9	P582 W653 L654 N659 M660 T667 L671 Y701	P582-M657 HydrophobicContact CB-CG 3.94Å; P582-M657 HydrophobicContact CB-SD 3.81Å; P582-M657 HydrophobicContact CG-CG 3.99Å; P582-M657 HydrophobicContact CG-SD 4.32Å; W653-M657 HydrophobicContact CD2-CG 3.96Å; W653-M657 HydrophobicContact CE3-CG 4.13Å; W653-M657 HydrophobicContact CH2-CE 4.06Å; W653-M657 HydrophobicContact CH2-CG 3.97Å; W653-M657 HydrophobicContact CZ2-CE 3.97Å; W653-M657 HydrophobicContact CZ2-CG 3.79Å; W653-M657 HydrophobicContact CZ2-SD 4.06Å; W653-M657 HydrophobicContact CZ3-CG 4.13Å; W653-M657 WeakPolarHBondContact O-CB 3.08Å; W653-M657 VanDerWaalsContact O-CG 3.29Å; W653-M657 WeakPolarHBondContact O-CG 3.5Å; W653-M657 PolarHBondContact O-N 2.94Å; L654-M657 PolarHBondContact O-N 3.45Å; M657-N659 VanDerWaalsContact C-N 3.28Å; M657-N659 PolarHBondContact O-N 2.59Å; M657-M660 PolarHBondContact O-N 3.13Å; M657-M660 HydrophobicContact SD-CE 4.28Å; M657-T667 HydrophobicContact CE-CG2 4.05Å; M657-L671 HydrophobicContact CB-CD2 4.13Å; M657-L671 HydrophobicContact CE-CG 4.43Å; M657-Y701 PolarHBondContact O-OH 3.17Å; M657-Y701 VanDerWaalsContact O-OH 3.1Å
658	L	90.4	Very high	90	Very high	7 Å²	7	33 Å²	33	4%	0.037	17%	0.167	C	C	.	.	H	α-helix	trans	-76.4	-12.5	-179.7	-60.5	177.2	0	0	0	113.9	L427 L654 Q656 L671 L693 L697 Y701	L427-L658 WeakPolarHBondContact CD2-O 3.5Å; L654-L658 VanDerWaalsContact O-CG 3.3Å; L654-L658 WeakPolarHBondContact O-CG 3.39Å; L654-L658 PolarHBondContact O-N 3.17Å; Q656-L658 VanDerWaalsContact C-N 3.34Å; Q656-L658 PolarHBondContact O-N 3.29Å; L658-L671 HydrophobicContact CD2-CD1 4.07Å; L658-L671 HydrophobicContact CD2-CD2 4.36Å; L658-L693 HydrophobicContact CD1-CD1 4.33Å; L658-L693 HydrophobicContact CD1-CD2 3.64Å; L658-L693 HydrophobicContact CD1-CG 3.75Å; L658-L697 HydrophobicContact CD1-CB 4.28Å; L658-L697 HydrophobicContact CD2-CB 4.31Å; L658-L697 HydrophobicContact CD2-CD1 3.82Å; L658-L697 HydrophobicContact CD2-CG 4.47Å; L658-Y701 HydrophobicContact CB-CD2 4.44Å; L658-Y701 HydrophobicContact CD2-CD1 3.59Å; L658-Y701 HydrophobicContact CD2-CD2 4.14Å; L658-Y701 HydrophobicContact CD2-CE1 3.9Å; L658-Y701 HydrophobicContact CD2-CE2 4.42Å; L658-Y701 HydrophobicContact CD2-CG 3.73Å; L658-Y701 WeakPolarHBondContact O-CD2 3.43Å; L658-Y701 VanDerWaalsContact O-CE2 3.27Å; L658-Y701 WeakPolarHBondContact O-CE2 3.36Å
659	N	88.9	Confident	90.1	Very high	105 Å²	105	29.1 Å²	29.1	56%	0.561	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	1.9	176.7	-75.5	-15	0	0	0	113.6	Q428 A655 Q656 M657	Q428-N659 PolarHBondContact N-O 3.45Å; A655-N659 WeakPolarHBondContact O-CB 3.44Å; A655-N659 PolarHBondContact O-N 2.65Å; A655-N659 PolarHBondContact O-ND2 2.7Å; Q656-N659 PolarHBondContact O-N 2.87Å; M657-N659 VanDerWaalsContact C-N 3.28Å; M657-N659 PolarHBondContact O-N 2.59Å
660	M	85.8	Confident	90.3	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.01	14%	0.136	C	C	.	.	S	Bend	trans	-115	160.8	175.6	-57.5	-173	-64.4	0	0	112	Q428 P582 Y584 Q656 M657 Y701	Q428-M660 VanDerWaalsContact O-CA 3.25Å; Q428-M660 WeakPolarHBondContact O-CA 3.45Å; Q428-M660 VanDerWaalsContact O-CB 3.3Å; Q428-M660 WeakPolarHBondContact O-CB 3.3Å; Q428-M660 VanDerWaalsContact O-CG 3.23Å; Q428-M660 WeakPolarHBondContact O-CG 3.49Å; P582-M660 HydrophobicContact CB-CE 3.48Å; P582-M660 VanDerWaalsContact CB-CE 3.48Å; P582-M660 VanDerWaalsContact O-CE 3.27Å; P582-M660 WeakPolarHBondContact O-CE 3.46Å; Y584-M660 HydrophobicContact CD2-CE 4.07Å; Y584-M660 HydrophobicContact CD2-SD 4.03Å; Y584-M660 HydrophobicContact CE1-CE 4.4Å; Y584-M660 HydrophobicContact CE2-CB 3.9Å; Y584-M660 HydrophobicContact CE2-CE 3.51Å; Y584-M660 HydrophobicContact CE2-SD 3.95Å; Q656-M660 WeakPolarHBondContact O-CG 3.38Å; M657-M660 PolarHBondContact O-N 3.13Å; M657-M660 HydrophobicContact SD-CE 4.28Å; M660-Y701 VanDerWaalsContact O-CE2 3.27Å; M660-Y701 WeakPolarHBondContact O-CE2 3.21Å; M660-Y701 PolarHBondContact O-OH 3.32Å
661	E	85.9	Confident	90.4	Very high	88 Å²	88	26.9 Å²	26.9	41%	0.411	14%	0.136	S	C	.	.	P	Polyproline II helix	trans	-65	134.3	170.7	-64.9	-172.3	146	0	0	111	L427 N429 Y584	L427-E661 HydrophobicContact CB-CG 4.03Å; N429-E661 PolarHBondContact ND2-OE2 2.75Å; N429-E661 WeakPolarHBondContact OD1-CB 3.42Å; N429-E661 VanDerWaalsContact OD1-CG 3.24Å; N429-E661 WeakPolarHBondContact OD1-CG 3.49Å; N429-E661 PolarHBondContact OD1-OE2 3.12Å; Y584-E661 VanDerWaalsContact CE2-O 3.28Å; Y584-E661 WeakPolarHBondContact CE2-O 3.37Å
662	P	88.9	Confident	90.4	Very high	11 Å²	11	24.7 Å²	24.7	7%	0.071	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-71.1	137	-178.7	27	-32.7	0	0	0	111.5	T667 Y701 R704 I705 V708	P662-T667 HydrophobicContact CB-CG2 3.9Å; P662-Y701 WeakPolarHBondContact CA-OH 3.42Å; P662-Y701 HydrophobicContact CB-CE1 4Å; P662-Y701 HydrophobicContact CG-CE1 4.41Å; P662-R704 HydrophobicContact CG-CB 3.91Å; P662-I705 HydrophobicContact CB-CG1 3.81Å; P662-I705 HydrophobicContact CG-CG1 4.09Å; P662-V708 HydrophobicContact CB-CG2 4.35Å; P662-V708 HydrophobicContact CG-CG1 4.49Å; P662-V708 HydrophobicContact CG-CG2 4.06Å
663	L	86.8	Confident	90.6	Very high	59 Å²	59	20 Å²	20	31%	0.309	11%	0.111	S	C	.	.	P	Polyproline II helix	trans	-82.3	136.3	162.6	-59.4	-174.7	0	0	0	111.1	Y579 Y584 I666 T667	Y579-L663 HydrophobicContact CE1-CD1 4.18Å; Y584-L663 HydrophobicContact CD1-CD1 3.4Å; Y584-L663 HydrophobicContact CD1-CG 3.96Å; Y584-L663 HydrophobicContact CD2-CG 4.34Å; Y584-L663 HydrophobicContact CE1-CD1 3.54Å; Y584-L663 HydrophobicContact CE1-CG 3.78Å; Y584-L663 HydrophobicContact CE2-CG 4.2Å; Y584-L663 HydrophobicContact CG-CD1 3.93Å; Y584-L663 HydrophobicContact CG-CG 4.21Å; L663-I666 HydrophobicContact CB-CB 4.33Å; L663-I666 HydrophobicContact CD1-CD1 4.22Å; L663-T667 PolarHBondContact N-OG1 2.78Å; L663-T667 VanDerWaalsContact O-CB 3.31Å; L663-T667 WeakPolarHBondContact O-CB 3.22Å; L663-T667 PolarHBondContact O-N 2.95Å; L663-T667 VanDerWaalsContact O-N 3.13Å; L663-T667 PolarHBondContact O-OG1 3.49Å; L663-T667 VanDerWaalsContact O-OG1 3.11Å
664	A	83.6	Confident	90.7	Very high	32 Å²	32	19.8 Å²	19.8	26%	0.264	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	138.1	173.7	0	0	0	0	0	111.8	I666	A664-I666 PolarHBondContact O-N 2.77Å
665	D	84.1	Confident	90.8	Very high	14 Å²	14	19.8 Å²	19.8	8%	0.075	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	-58	-174.1	-157.9	-16.8	0	0	0	115.7	L616 T667 A668 T669 E713 S716	L616-D665 HydrophobicContact CD1-CB 4.27Å; L616-D665 WeakPolarHBondContact CD1-OD2 3.45Å; D665-T667 PolarHBondContact O-N 3.27Å; D665-A668 PolarHBondContact O-N 3.35Å; D665-T669 WeakPolarHBondContact O-CB 3.41Å; D665-T669 PolarHBondContact O-N 3.08Å; D665-T669 PolarHBondContact O-OG1 3.39Å; D665-T669 PolarHBondContact OD1-OG1 2.76Å; D665-T669 VanDerWaalsContact OD1-OG1 3.08Å; D665-E713 HydrophobicContact CB-CB 4.4Å; D665-S716 WeakPolarHBondContact OD1-CB 3.41Å; D665-S716 PolarHBondContact OD1-OG 3.38Å
666	I	90	Very high	91	Very high	13 Å²	13	20.5 Å²	20.5	7%	0.067	11%	0.108	C	C	.	.	H	α-helix	trans	-51	-53.3	-176.4	-58.2	172.9	0	0	0	111.4	Y579 F615 L616 L663 A664 A668 T669 L670	Y579-I666 HydrophobicContact CD1-CG2 4.06Å; Y579-I666 HydrophobicContact CE1-CD1 4.49Å; Y579-I666 HydrophobicContact CE1-CG2 4.07Å; Y579-I666 HydrophobicContact CG-CG2 4.28Å; F615-I666 HydrophobicContact CE1-CD1 3.93Å; F615-I666 HydrophobicContact CE1-CG1 4.16Å; F615-I666 HydrophobicContact CZ-CD1 4.45Å; L616-I666 HydrophobicContact CD2-CB 4.34Å; L616-I666 HydrophobicContact CD2-CG1 3.85Å; L663-I666 HydrophobicContact CB-CB 4.33Å; L663-I666 HydrophobicContact CD1-CD1 4.22Å; A664-I666 PolarHBondContact O-N 2.77Å; I666-A668 PolarHBondContact O-N 2.95Å; I666-T669 PolarHBondContact O-N 3.19Å; I666-L670 HydrophobicContact CG2-CD1 3.83Å; I666-L670 HydrophobicContact CG2-CG 4.34Å; I666-L670 WeakPolarHBondContact O-CG 3.31Å; I666-L670 PolarHBondContact O-N 2.93Å
667	T	91.6	Very high	91.3	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-69.5	-37	-173.1	-54.4	0	0	0	0	111.5	Y584 M657 P662 L663 D665 L671 Y701	Y584-T667 PolarHBondContact OH-OG1 3.13Å; M657-T667 HydrophobicContact CE-CG2 4.05Å; P662-T667 HydrophobicContact CB-CG2 3.9Å; L663-T667 PolarHBondContact N-OG1 2.78Å; L663-T667 VanDerWaalsContact O-CB 3.31Å; L663-T667 WeakPolarHBondContact O-CB 3.22Å; L663-T667 PolarHBondContact O-N 2.95Å; L663-T667 VanDerWaalsContact O-N 3.13Å; L663-T667 PolarHBondContact O-OG1 3.49Å; L663-T667 VanDerWaalsContact O-OG1 3.11Å; D665-T667 PolarHBondContact O-N 3.27Å; T667-L671 HydrophobicContact CG2-CD1 3.87Å; T667-L671 HydrophobicContact CG2-CG 4.35Å; T667-L671 VanDerWaalsContact O-CB 3.26Å; T667-L671 WeakPolarHBondContact O-CB 3.39Å; T667-L671 WeakPolarHBondContact O-CD1 3.07Å; T667-L671 WeakPolarHBondContact O-CG 3.31Å; T667-L671 PolarHBondContact O-N 3.32Å; T667-L671 VanDerWaalsContact O-N 3.09Å; T667-Y701 HydrophobicContact CG2-CE1 4.07Å
668	A	92.6	Very high	91.6	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-66.4	-45.6	176	0	0	0	0	0	111.9	D665 I666 F672 I705 V717	D665-A668 PolarHBondContact O-N 3.35Å; I666-A668 PolarHBondContact O-N 2.95Å; A668-F672 WeakPolarHBondContact O-CB 3.48Å; A668-F672 PolarHBondContact O-N 2.89Å; A668-F672 VanDerWaalsContact O-N 3.14Å; A668-I705 HydrophobicContact CB-CG2 3.95Å; A668-V717 HydrophobicContact CB-CG2 4.1Å
669	T	94.3	Very high	91.8	Very high	5 Å²	5	19.3 Å²	19.3	3%	0.031	10%	0.103	C	C	.	.	H	α-helix	trans	-60.5	-56	177.3	-72.3	0	0	0	0	111	D665 I666 L671 F672 D673 S716 R719	D665-T669 WeakPolarHBondContact O-CB 3.41Å; D665-T669 PolarHBondContact O-N 3.08Å; D665-T669 PolarHBondContact O-OG1 3.39Å; D665-T669 PolarHBondContact OD1-OG1 2.76Å; D665-T669 VanDerWaalsContact OD1-OG1 3.08Å; I666-T669 PolarHBondContact O-N 3.19Å; T669-L671 PolarHBondContact O-N 2.85Å; T669-F672 PolarHBondContact O-N 3.42Å; T669-D673 WeakPolarHBondContact CG2-OD2 3.38Å; T669-D673 PolarHBondContact O-N 3.28Å; T669-D673 VanDerWaalsContact O-OD2 3.11Å; T669-S716 VanDerWaalsContact OG1-CB 3.26Å; T669-S716 WeakPolarHBondContact OG1-CB 3.42Å; T669-S716 PolarHBondContact OG1-OG 3.37Å; T669-R719 PolarHBondContact OG1-NH2 3.02Å
670	L	95	Very high	92.1	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-68.6	-33.6	-174.3	-59.4	-176.9	0	0	0	113.2	Y579 M619 I623 W653 I666 F674	Y579-L670 VanDerWaalsContact CB-CD1 3.44Å; Y579-L670 HydrophobicContact CD2-CD1 4.22Å; Y579-L670 HydrophobicContact CG-CD1 3.87Å; M619-L670 HydrophobicContact CB-CD2 4Å; I623-L670 HydrophobicContact CB-CD2 4.26Å; I623-L670 HydrophobicContact CG1-CD1 4.25Å; I623-L670 HydrophobicContact CG1-CD2 3.94Å; W653-L670 HydrophobicContact CH2-CB 4.4Å; W653-L670 HydrophobicContact CZ2-CB 4.47Å; I666-L670 HydrophobicContact CG2-CD1 3.83Å; I666-L670 HydrophobicContact CG2-CG 4.34Å; I666-L670 WeakPolarHBondContact O-CG 3.31Å; I666-L670 PolarHBondContact O-N 2.93Å; L670-F674 WeakPolarHBondContact O-CB 3.47Å; L670-F674 PolarHBondContact O-N 3.4Å
671	L	95.5	Very high	92.5	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-64.2	-44	171.9	-76	173.9	0	0	0	111.7	W653 L654 M657 L658 T667 T669 L675 L697 Y701 I705 L720	W653-L671 HydrophobicContact CH2-CD2 4.3Å; W653-L671 HydrophobicContact CZ3-CD2 4.04Å; L654-L671 HydrophobicContact CD2-CD2 3.93Å; M657-L671 HydrophobicContact CB-CD2 4.13Å; M657-L671 HydrophobicContact CE-CG 4.43Å; L658-L671 HydrophobicContact CD2-CD1 4.07Å; L658-L671 HydrophobicContact CD2-CD2 4.36Å; T667-L671 HydrophobicContact CG2-CD1 3.87Å; T667-L671 HydrophobicContact CG2-CG 4.35Å; T667-L671 VanDerWaalsContact O-CB 3.26Å; T667-L671 WeakPolarHBondContact O-CB 3.39Å; T667-L671 WeakPolarHBondContact O-CD1 3.07Å; T667-L671 WeakPolarHBondContact O-CG 3.31Å; T667-L671 PolarHBondContact O-N 3.32Å; T667-L671 VanDerWaalsContact O-N 3.09Å; T669-L671 PolarHBondContact O-N 2.85Å; L671-L675 VanDerWaalsContact O-CB 3.27Å; L671-L675 WeakPolarHBondContact O-CB 3.41Å; L671-L675 WeakPolarHBondContact O-CD1 3.39Å; L671-L675 WeakPolarHBondContact O-CG 3.5Å; L671-L675 PolarHBondContact O-N 3.29Å; L671-L697 HydrophobicContact CD1-CD1 4.05Å; L671-Y701 HydrophobicContact CD1-CD1 4.37Å; L671-Y701 HydrophobicContact CD1-CE1 4.07Å; L671-I705 HydrophobicContact CD1-CD1 4.31Å; L671-L720 HydrophobicContact CB-CD1 4.41Å; L671-L720 HydrophobicContact CB-CD2 4.2Å; L671-L720 HydrophobicContact CD1-CD2 4.49Å
672	F	95.7	Very high	92.9	Very high	27 Å²	27	11 Å²	11	12%	0.118	6%	0.063	C	C	.	.	H	α-helix	trans	-61.7	-50	175.9	165.1	-100.2	0	0	0	111.3	A668 T669 F674 L675 E676 L720 F723	A668-F672 WeakPolarHBondContact O-CB 3.48Å; A668-F672 PolarHBondContact O-N 2.89Å; A668-F672 VanDerWaalsContact O-N 3.14Å; T669-F672 PolarHBondContact O-N 3.42Å; F672-F674 PolarHBondContact O-N 2.79Å; F672-L675 PolarHBondContact O-N 3.23Å; F672-E676 WeakPolarHBondContact O-CB 3.3Å; F672-E676 PolarHBondContact O-N 2.84Å; F672-L720 HydrophobicContact CB-CB 4.2Å; F672-L720 HydrophobicContact CB-CD1 4.03Å; F672-F723 HydrophobicContact CD2-CB 3.81Å; F672-F723 HydrophobicContact CD2-CD2 4.3Å; F672-F723 HydrophobicContact CD2-CG 4.07Å; F672-F723 HydrophobicContact CE2-CB 3.9Å; F672-F723 AromaticContact CE2-CD2 3.98Å; F672-F723 HydrophobicContact CE2-CD2 3.98Å; F672-F723 HydrophobicContact CE2-CG 4.14Å
673	D	95.6	Very high	93.2	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.011	7%	0.065	C	C	.	.	H	α-helix	trans	-64.1	-40.3	-175.8	-65	-37.3	0	0	0	112.5	S620 R624 T669 V677	S620-D673 WeakPolarHBondContact CB-OD2 3.44Å; S620-D673 PolarHBondContact OG-OD1 3.41Å; S620-D673 PolarHBondContact OG-OD2 3.1Å; R624-D673 HydrophobicContact CG-CB 4.05Å; R624-D673 IonicContact CZ-OD1 2.74Å; R624-D673 IonicContact NE-OD1 3.62Å; R624-D673 PolarHBondContact NE-OD1 2.79Å; R624-D673 IonicContact NH2-OD1 2.63Å; R624-D673 PolarHBondContact NH2-OD1 2.91Å; T669-D673 WeakPolarHBondContact CG2-OD2 3.38Å; T669-D673 PolarHBondContact O-N 3.28Å; T669-D673 VanDerWaalsContact O-OD2 3.11Å; D673-V677 WeakPolarHBondContact O-CG2 3.33Å; D673-V677 PolarHBondContact O-N 3.39Å
674	F	96.4	Very high	93.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-67.8	-41.3	175.7	-175.7	-86.4	0	0	0	112.1	I623 Y626 A627 I630 W653 L654 L670 F672 V677 C678 L682	I623-F674 HydrophobicContact CG2-CB 3.92Å; I623-F674 HydrophobicContact CG2-CD2 4.01Å; I623-F674 HydrophobicContact CG2-CG 4.47Å; Y626-F674 HydrophobicContact CD1-CE2 4.13Å; Y626-F674 HydrophobicContact CE1-CE2 4.26Å; A627-F674 HydrophobicContact CB-CD2 3.71Å; A627-F674 HydrophobicContact CB-CE2 3.95Å; A627-F674 HydrophobicContact CB-CG 4.38Å; I630-F674 HydrophobicContact CD1-CE2 3.74Å; I630-F674 HydrophobicContact CD1-CZ 3.6Å; W653-F674 HydrophobicContact CD2-CD2 4.05Å; W653-F674 HydrophobicContact CD2-CE2 4.09Å; W653-F674 HydrophobicContact CD2-CG 4.38Å; W653-F674 HydrophobicContact CD2-CZ 4.44Å; W653-F674 HydrophobicContact CE3-CB 4.26Å; W653-F674 AromaticContact CE3-CD1 3.62Å; W653-F674 HydrophobicContact CE3-CD1 3.62Å; W653-F674 AromaticContact CE3-CD2 3.67Å; W653-F674 HydrophobicContact CE3-CD2 3.67Å; W653-F674 AromaticContact CE3-CE1 3.8Å; W653-F674 HydrophobicContact CE3-CE1 3.8Å; W653-F674 AromaticContact CE3-CE2 3.86Å; W653-F674 HydrophobicContact CE3-CE2 3.86Å; W653-F674 AromaticContact CE3-CG 3.56Å; W653-F674 HydrophobicContact CE3-CG 3.56Å; W653-F674 AromaticContact CE3-CZ 3.93Å; W653-F674 HydrophobicContact CE3-CZ 3.93Å; W653-F674 HydrophobicContact CG-CE2 4.43Å; W653-F674 HydrophobicContact CH2-CB 3.69Å; W653-F674 HydrophobicContact CH2-CD2 4.22Å; W653-F674 AromaticContact CH2-CG 3.91Å; W653-F674 HydrophobicContact CH2-CG 3.91Å; W653-F674 HydrophobicContact CZ3-CB 3.47Å; W653-F674 VanDerWaalsContact CZ3-CB 3.47Å; W653-F674 AromaticContact CZ3-CD1 3.52Å; W653-F674 HydrophobicContact CZ3-CD1 3.52Å; W653-F674 AromaticContact CZ3-CD2 3.77Å; W653-F674 HydrophobicContact CZ3-CD2 3.77Å; W653-F674 HydrophobicContact CZ3-CE1 4.19Å; W653-F674 HydrophobicContact CZ3-CE2 4.41Å; W653-F674 AromaticContact CZ3-CG 3.28Å; W653-F674 HydrophobicContact CZ3-CG 3.28Å; L654-F674 HydrophobicContact CD1-CD1 4.36Å; L654-F674 HydrophobicContact CD1-CE1 3.94Å; L654-F674 HydrophobicContact CD2-CD1 3.9Å; L654-F674 HydrophobicContact CD2-CE1 4.14Å; L654-F674 HydrophobicContact CG-CD1 4Å; L654-F674 HydrophobicContact CG-CE1 3.7Å; L670-F674 WeakPolarHBondContact O-CB 3.47Å; L670-F674 PolarHBondContact O-N 3.4Å; F672-F674 PolarHBondContact O-N 2.79Å; F674-V677 PolarHBondContact O-N 2.86Å; F674-C678 HydrophobicContact CE1-CB 4.14Å; F674-C678 HydrophobicContact CZ-CB 4.21Å; F674-C678 WeakPolarHBondContact O-CB 3.45Å; F674-C678 PolarHBondContact O-N 3.01Å; F674-L682 HydrophobicContact CE1-CD1 3.7Å; F674-L682 HydrophobicContact CZ-CD1 4.31Å
675	L	95.8	Very high	94.1	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-72.4	-34	178.8	-71.9	172	0	0	0	112.8	L654 L671 F672 V677 G679 F690 I694 L697 L720 F723	L654-L675 HydrophobicContact CD1-CD2 3.94Å; L654-L675 HydrophobicContact CD2-CD2 4.03Å; L654-L675 HydrophobicContact CD2-CG 4.32Å; L671-L675 VanDerWaalsContact O-CB 3.27Å; L671-L675 WeakPolarHBondContact O-CB 3.41Å; L671-L675 WeakPolarHBondContact O-CD1 3.39Å; L671-L675 WeakPolarHBondContact O-CG 3.5Å; L671-L675 PolarHBondContact O-N 3.29Å; F672-L675 PolarHBondContact O-N 3.23Å; L675-V677 VanDerWaalsContact C-N 3.34Å; L675-G679 VanDerWaalsContact O-CA 3.23Å; L675-G679 WeakPolarHBondContact O-CA 3.44Å; L675-G679 PolarHBondContact O-N 2.94Å; L675-F690 HydrophobicContact CD2-CE2 4.14Å; L675-F690 HydrophobicContact CD2-CZ 3.93Å; L675-I694 HydrophobicContact CD1-CD1 4.18Å; L675-I694 HydrophobicContact CD2-CD1 4.05Å; L675-L697 HydrophobicContact CD1-CD2 3.68Å; L675-L720 HydrophobicContact CD1-CD1 4.4Å; L675-F723 HydrophobicContact CB-CD1 4.45Å; L675-F723 HydrophobicContact CB-CE1 3.65Å; L675-F723 HydrophobicContact CB-CZ 3.96Å; L675-F723 HydrophobicContact CD1-CE1 4.42Å
676	E	95.4	Very high	94.6	Very high	46 Å²	46	21.2 Å²	21.2	22%	0.215	10%	0.099	C	C	.	.	H	α-helix	trans	-61.2	-44	172.2	-173.6	-178.2	-140.1	0	0	110.7	R624 F672 F723	R624-E676 IonicContact CZ-OE2 3.27Å; R624-E676 IonicContact NH1-OE2 2.69Å; R624-E676 PolarHBondContact NH1-OE2 3.46Å; R624-E676 IonicContact NH2-OE2 3.54Å; R624-E676 PolarHBondContact NH2-OE2 2.85Å; F672-E676 WeakPolarHBondContact O-CB 3.3Å; F672-E676 PolarHBondContact O-N 2.84Å; E676-F723 HydrophobicContact CB-CE2 4.37Å
677	V	95.8	Very high	94.8	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.012	12%	0.124	C	C	.	.	H	α-helix	trans	-77.7	-51	-178.5	172.8	0	0	0	0	112.6	F549 R624 A627 A628 Q631 D673 F674 L675	F549-V677 HydrophobicContact CE1-CG1 4.25Å; F549-V677 HydrophobicContact CZ-CG1 3.92Å; F549-V677 HydrophobicContact CZ-CG2 4.48Å; R624-V677 HydrophobicContact CB-CG2 4.14Å; R624-V677 HydrophobicContact CG-CG2 3.94Å; A627-V677 HydrophobicContact CB-CB 3.81Å; A627-V677 HydrophobicContact CB-CG1 3.53Å; A628-V677 HydrophobicContact CB-CG1 4.36Å; Q631-V677 PolarHBondContact NE2-O 3.45Å; D673-V677 WeakPolarHBondContact O-CG2 3.33Å; D673-V677 PolarHBondContact O-N 3.39Å; F674-V677 PolarHBondContact O-N 2.86Å; L675-V677 VanDerWaalsContact C-N 3.34Å
678	C	94.7	Very high	94.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-104.7	-14.6	-168.8	-156.3	0	0	0	0	114.6	A627 I630 F674 N680 A681 L682	A627-C678 HydrophobicContact CB-CB 4.13Å; I630-C678 HydrophobicContact CD1-CB 4.45Å; I630-C678 VanDerWaalsContact CD1-SG 3.58Å; F674-C678 HydrophobicContact CE1-CB 4.14Å; F674-C678 HydrophobicContact CZ-CB 4.21Å; F674-C678 WeakPolarHBondContact O-CB 3.45Å; F674-C678 PolarHBondContact O-N 3.01Å; C678-N680 VanDerWaalsContact C-N 3.31Å; C678-N680 PolarHBondContact O-N 3.08Å; C678-A681 PolarHBondContact O-N 3.35Å; C678-L682 HydrophobicContact CB-CD1 4.11Å; C678-L682 PolarHBondContact O-N 3.47Å
679	G	94.8	Very high	95	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.7	-38	-172.2	0	0	0	0	0	114.2	L675 A681 L682 M683	L675-G679 VanDerWaalsContact O-CA 3.23Å; L675-G679 WeakPolarHBondContact O-CA 3.44Å; L675-G679 PolarHBondContact O-N 2.94Å; G679-A681 PolarHBondContact O-N 3.02Å; G679-L682 PolarHBondContact O-N 2.92Å; G679-M683 WeakPolarHBondContact O-CB 3.3Å; G679-M683 PolarHBondContact O-N 3.23Å
680	N	95.2	Very high	95.1	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-62.3	-37.7	174.4	169.3	44.8	0	0	0	113	C678 K684 I733 P735	C678-N680 VanDerWaalsContact C-N 3.31Å; C678-N680 PolarHBondContact O-N 3.08Å; N680-K684 PolarHBondContact ND2-NZ 3.25Å; N680-K684 WeakPolarHBondContact O-CD 3.47Å; N680-K684 WeakPolarHBondContact O-CG 3.28Å; N680-K684 PolarHBondContact O-N 3.27Å; N680-K684 WeakPolarHBondContact OD1-CE 3.49Å; N680-K684 PolarHBondContact OD1-NZ 3.01Å; N680-I733 HydrophobicContact CB-CG2 4.28Å; N680-P735 WeakPolarHBondContact ND2-CA 3.35Å
681	A	94.2	Very high	95.1	Very high	17 Å²	17	36.5 Å²	36.5	14%	0.14	18%	0.18	C	C	.	.	H	α-helix	trans	-74	-44.9	177.6	0	0	0	0	0	111.4	Q631 L647 C678 G679 M683 K684 Q685	Q631-A681 HydrophobicContact CB-CB 3.96Å; L647-A681 HydrophobicContact CD1-CB 4.2Å; L647-A681 HydrophobicContact CD2-CB 3.95Å; C678-A681 PolarHBondContact O-N 3.35Å; G679-A681 PolarHBondContact O-N 3.02Å; A681-M683 PolarHBondContact O-N 3.18Å; A681-K684 PolarHBondContact O-N 3.46Å; A681-Q685 WeakPolarHBondContact O-CB 3.3Å; A681-Q685 PolarHBondContact O-N 3.46Å
682	L	95.6	Very high	95.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.3	-39.2	177.5	-64.7	168.9	0	0	0	112.2	L647 L654 F674 C678 G679 K684 Q685 Y686 F690	L647-L682 HydrophobicContact CB-CD2 4.2Å; L647-L682 HydrophobicContact CD2-CD2 4.01Å; L647-L682 HydrophobicContact CD2-CG 4.42Å; L654-L682 HydrophobicContact CD1-CD1 3.71Å; F674-L682 HydrophobicContact CE1-CD1 3.7Å; F674-L682 HydrophobicContact CZ-CD1 4.31Å; C678-L682 HydrophobicContact CB-CD1 4.11Å; C678-L682 PolarHBondContact O-N 3.47Å; G679-L682 PolarHBondContact O-N 2.92Å; L682-K684 PolarHBondContact O-N 2.82Å; L682-Q685 PolarHBondContact O-N 3.29Å; L682-Y686 HydrophobicContact CB-CD2 4.43Å; L682-Y686 HydrophobicContact CD2-CD2 4Å; L682-Y686 HydrophobicContact CD2-CE2 3.7Å; L682-Y686 WeakPolarHBondContact O-CB 3.36Å; L682-Y686 PolarHBondContact O-N 2.84Å; L682-F690 HydrophobicContact CB-CD2 3.66Å; L682-F690 HydrophobicContact CB-CE2 3.56Å; L682-F690 HydrophobicContact CB-CG 4.45Å; L682-F690 HydrophobicContact CB-CZ 4.27Å; L682-F690 HydrophobicContact CD1-CE2 4.17Å
683	M	95	Very high	95.1	Very high	21 Å²	21	42.1 Å²	42.1	10%	0.103	21%	0.205	C	C	.	.	H	α-helix	trans	-59	-43	172.1	177.8	-170.9	69.3	0	0	112	G679 A681 Q687 F690 W691 Q732 I733	G679-M683 WeakPolarHBondContact O-CB 3.3Å; G679-M683 PolarHBondContact O-N 3.23Å; A681-M683 PolarHBondContact O-N 3.18Å; M683-Q687 WeakPolarHBondContact O-CA 3.4Å; M683-Q687 PolarHBondContact O-N 2.91Å; M683-F690 HydrophobicContact CB-CD1 3.74Å; M683-F690 HydrophobicContact CB-CE1 3.86Å; M683-F690 HydrophobicContact CG-CD1 4.34Å; M683-W691 HydrophobicContact CG-CZ2 4.16Å; M683-W691 HydrophobicContact SD-CZ2 3.68Å; M683-Q732 HydrophobicContact CE-CG 4.01Å; M683-Q732 HydrophobicContact SD-CG 4.38Å; M683-I733 HydrophobicContact SD-CB 4.21Å; M683-I733 HydrophobicContact SD-CG1 4.44Å; M683-I733 PolarHBondContact SD-N 3.34Å
684	K	93.8	Very high	95	Very high	125 Å²	125	42 Å²	42	54%	0.543	21%	0.205	S	C	.	.	H	α-helix	trans	-68.5	-40.4	177.7	-74.9	165.7	176.9	159.3	0	112.4	N680 A681 L682 Q687	N680-K684 PolarHBondContact ND2-NZ 3.25Å; N680-K684 WeakPolarHBondContact O-CD 3.47Å; N680-K684 WeakPolarHBondContact O-CG 3.28Å; N680-K684 PolarHBondContact O-N 3.27Å; N680-K684 WeakPolarHBondContact OD1-CE 3.49Å; N680-K684 PolarHBondContact OD1-NZ 3.01Å; A681-K684 PolarHBondContact O-N 3.46Å; L682-K684 PolarHBondContact O-N 2.82Å; K684-Q687 WeakPolarHBondContact O-CG 3.31Å; K684-Q687 PolarHBondContact O-NE2 3Å
685	Q	94.2	Very high	94.9	Very high	123 Å²	123	45.8 Å²	45.8	58%	0.575	22%	0.224	S	C	*	.	H	α-helix	trans	-75.5	-42.5	-176.5	-170.5	65.3	19.6	0	0	113.3	L647 A681 L682	L647-Q685 HydrophobicContact CD1-CB 4.04Å; L647-Q685 HydrophobicContact CD1-CG 4.22Å; A681-Q685 WeakPolarHBondContact O-CB 3.3Å; A681-Q685 PolarHBondContact O-N 3.46Å; L682-Q685 PolarHBondContact O-N 3.29Å
686	Y	95.3	Very high	94.8	Very high	62 Å²	62	49 Å²	49	24%	0.243	24%	0.241	C	C	.	.	H	α-helix	trans	-113.8	-7.7	-170.5	-58.3	-69.8	0	0	0	114.4	L647 N648 W651 L682 G688 Q689	L647-Y686 HydrophobicContact CB-CE2 4.44Å; N648-Y686 WeakPolarHBondContact CA-OH 3.48Å; N648-Y686 PolarHBondContact N-OH 2.99Å; W651-Y686 HydrophobicContact CB-CE2 3.91Å; W651-Y686 HydrophobicContact CD2-CD2 4.42Å; W651-Y686 HydrophobicContact CD2-CG 4.47Å; W651-Y686 HydrophobicContact CE3-CD1 4.31Å; W651-Y686 AromaticContact CE3-CD2 3.65Å; W651-Y686 HydrophobicContact CE3-CD2 3.65Å; W651-Y686 HydrophobicContact CE3-CE2 4.15Å; W651-Y686 AromaticContact CE3-CG 3.75Å; W651-Y686 HydrophobicContact CE3-CG 3.75Å; W651-Y686 HydrophobicContact CG-CE2 4.47Å; W651-Y686 HydrophobicContact CZ3-CD2 4.33Å; W651-Y686 HydrophobicContact CZ3-CG 4.11Å; L682-Y686 HydrophobicContact CB-CD2 4.43Å; L682-Y686 HydrophobicContact CD2-CD2 4Å; L682-Y686 HydrophobicContact CD2-CE2 3.7Å; L682-Y686 WeakPolarHBondContact O-CB 3.36Å; L682-Y686 PolarHBondContact O-N 2.84Å; Y686-G688 PolarHBondContact O-N 3.46Å; Y686-Q689 WeakPolarHBondContact O-CB 3.49Å; Y686-Q689 PolarHBondContact O-N 3.18Å
687	Q	93.9	Very high	94.8	Very high	129 Å²	129	46.8 Å²	46.8	60%	0.603	23%	0.231	S	C	*	.	H	α-helix	trans	47	-114.6	166.3	-55.2	-178.5	10.6	0	0	113.5	M683 K684 Q689 F690 W691	M683-Q687 WeakPolarHBondContact O-CA 3.4Å; M683-Q687 PolarHBondContact O-N 2.91Å; K684-Q687 WeakPolarHBondContact O-CG 3.31Å; K684-Q687 PolarHBondContact O-NE2 3Å; Q687-Q689 VanDerWaalsContact C-N 3.27Å; Q687-Q689 PolarHBondContact O-N 2.84Å; Q687-F690 WeakPolarHBondContact O-CB 3.38Å; Q687-F690 PolarHBondContact O-N 3.17Å; Q687-F690 VanDerWaalsContact O-N 3.13Å; Q687-W691 PolarHBondContact O-N 3.37Å; Q687-W691 VanDerWaalsContact O-N 3.08Å
688	G	93.9	Very high	94.6	Very high	49 Å²	49	50.4 Å²	50.4	51%	0.505	25%	0.247	S	C	.	.	H	α-helix	trans	-61.6	-28.7	-178.4	0	0	0	0	0	114.6	Y686 K692	Y686-G688 PolarHBondContact O-N 3.46Å; G688-K692 WeakPolarHBondContact O-CG 3.43Å; G688-K692 PolarHBondContact O-N 3.12Å; G688-K692 VanDerWaalsContact O-N 3.1Å
689	Q	95.5	Very high	94.5	Very high	105 Å²	105	54.6 Å²	54.6	49%	0.491	27%	0.269	S	S	.	.	H	α-helix	trans	-71.2	-38.2	175.5	-53.6	-62.3	-5.3	0	0	111	W651 Y686 Q687 K692 L693	W651-Q689 HydrophobicContact CH2-CB 3.87Å; W651-Q689 HydrophobicContact CZ3-CB 4.43Å; Y686-Q689 WeakPolarHBondContact O-CB 3.49Å; Y686-Q689 PolarHBondContact O-N 3.18Å; Q687-Q689 VanDerWaalsContact C-N 3.27Å; Q687-Q689 PolarHBondContact O-N 2.84Å; Q689-K692 WeakPolarHBondContact O-CB 3.49Å; Q689-K692 PolarHBondContact O-N 2.68Å; Q689-L693 PolarHBondContact O-N 2.95Å; Q689-L693 VanDerWaalsContact O-N 3.12Å
690	F	96.4	Very high	94.3	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.7	-41.3	174.5	-178.1	-98	0	0	0	111.8	W651 L654 L675 L682 M683 Q687 K692 L693 I694 I733	W651-F690 HydrophobicContact CZ3-CB 4.17Å; W651-F690 HydrophobicContact CZ3-CD2 4.39Å; L654-F690 HydrophobicContact CD1-CE2 4.02Å; L675-F690 HydrophobicContact CD2-CE2 4.14Å; L675-F690 HydrophobicContact CD2-CZ 3.93Å; L682-F690 HydrophobicContact CB-CD2 3.66Å; L682-F690 HydrophobicContact CB-CE2 3.56Å; L682-F690 HydrophobicContact CB-CG 4.45Å; L682-F690 HydrophobicContact CB-CZ 4.27Å; L682-F690 HydrophobicContact CD1-CE2 4.17Å; M683-F690 HydrophobicContact CB-CD1 3.74Å; M683-F690 HydrophobicContact CB-CE1 3.86Å; M683-F690 HydrophobicContact CG-CD1 4.34Å; Q687-F690 WeakPolarHBondContact O-CB 3.38Å; Q687-F690 PolarHBondContact O-N 3.17Å; Q687-F690 VanDerWaalsContact O-N 3.13Å; F690-K692 VanDerWaalsContact C-N 3.33Å; F690-K692 PolarHBondContact O-N 2.89Å; F690-L693 WeakPolarHBondContact O-CB 3.46Å; F690-L693 PolarHBondContact O-N 3.08Å; F690-L693 VanDerWaalsContact O-N 3.08Å; F690-I694 HydrophobicContact CD1-CG1 4.01Å; F690-I694 HydrophobicContact CE1-CD1 4Å; F690-I694 HydrophobicContact CE1-CG1 3.61Å; F690-I694 HydrophobicContact CE2-CD1 4.42Å; F690-I694 HydrophobicContact CZ-CD1 3.8Å; F690-I694 HydrophobicContact CZ-CG1 3.91Å; F690-I694 WeakPolarHBondContact O-CG1 3.1Å; F690-I694 PolarHBondContact O-N 3.21Å; F690-I733 HydrophobicContact CE1-CD1 3.52Å; F690-I733 HydrophobicContact CE1-CG1 4.49Å; F690-I733 HydrophobicContact CZ-CD1 3.71Å
691	W	95	Very high	94.1	Very high	55 Å²	55	60.5 Å²	60.5	21%	0.208	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-35.2	174.4	-75.1	114.2	0	0	0	113.5	M683 Q687 L693 I694 L695 S727 L728 R731 I733	M683-W691 HydrophobicContact CG-CZ2 4.16Å; M683-W691 HydrophobicContact SD-CZ2 3.68Å; Q687-W691 PolarHBondContact O-N 3.37Å; Q687-W691 VanDerWaalsContact O-N 3.08Å; W691-L693 VanDerWaalsContact C-N 3.33Å; W691-L693 PolarHBondContact O-N 3.3Å; W691-I694 HydrophobicContact CE3-CB 4.19Å; W691-I694 HydrophobicContact CE3-CG2 4.12Å; W691-I694 HydrophobicContact CZ3-CG2 4.07Å; W691-I694 PolarHBondContact O-N 3.39Å; W691-L695 WeakPolarHBondContact O-CG 3.4Å; W691-L695 PolarHBondContact O-N 2.8Å; W691-S727 VanDerWaalsContact CH2-O 3.25Å; W691-S727 WeakPolarHBondContact CH2-O 3.43Å; W691-L728 HydrophobicContact CE3-CD2 3.89Å; W691-L728 HydrophobicContact CZ3-CD2 3.82Å; W691-L728 HydrophobicContact CZ3-CG 4.32Å; W691-R731 VanDerWaalsContact CZ2-O 3.24Å; W691-R731 WeakPolarHBondContact CZ2-O 3.36Å; W691-I733 HydrophobicContact CH2-CG1 4.42Å
692	K	95	Very high	94	Very high	131 Å²	131	60 Å²	60	57%	0.57	29%	0.291	S	S	*	.	H	α-helix	trans	-60.8	-40.9	169.5	-74.1	165.3	54.1	-169.6	0	112.2	G688 Q689 F690 L695 L696	G688-K692 WeakPolarHBondContact O-CG 3.43Å; G688-K692 PolarHBondContact O-N 3.12Å; G688-K692 VanDerWaalsContact O-N 3.1Å; Q689-K692 WeakPolarHBondContact O-CB 3.49Å; Q689-K692 PolarHBondContact O-N 2.68Å; F690-K692 VanDerWaalsContact C-N 3.33Å; F690-K692 PolarHBondContact O-N 2.89Å; K692-L695 PolarHBondContact O-N 2.96Å; K692-L696 WeakPolarHBondContact O-CB 3.48Å; K692-L696 PolarHBondContact O-N 3.22Å
693	L	94.9	Very high	93.7	Very high	15 Å²	15	63.3 Å²	63.3	8%	0.079	31%	0.312	C	S	.	.	H	α-helix	trans	-67.5	-37.9	177.2	-174.8	152.1	0	0	0	111.9	W651 L654 L658 Q689 F690 W691 L696 L697	W651-L693 HydrophobicContact CH2-CB 4.25Å; W651-L693 HydrophobicContact CH2-CD1 3.93Å; W651-L693 HydrophobicContact CZ2-CD1 4.17Å; W651-L693 HydrophobicContact CZ3-CD1 4.17Å; L654-L693 HydrophobicContact CB-CD1 4.19Å; L654-L693 HydrophobicContact CB-CD2 4.34Å; L654-L693 HydrophobicContact CD1-CD2 4.17Å; L658-L693 HydrophobicContact CD1-CD1 4.33Å; L658-L693 HydrophobicContact CD1-CD2 3.64Å; L658-L693 HydrophobicContact CD1-CG 3.75Å; Q689-L693 PolarHBondContact O-N 2.95Å; Q689-L693 VanDerWaalsContact O-N 3.12Å; F690-L693 WeakPolarHBondContact O-CB 3.46Å; F690-L693 PolarHBondContact O-N 3.08Å; F690-L693 VanDerWaalsContact O-N 3.08Å; W691-L693 VanDerWaalsContact C-N 3.33Å; W691-L693 PolarHBondContact O-N 3.3Å; L693-L696 PolarHBondContact O-N 3.13Å; L693-L697 WeakPolarHBondContact O-CB 3.34Å; L693-L697 PolarHBondContact O-N 3.37Å
694	I	94.9	Very high	93.5	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-66.2	-37.5	173.5	-66.8	-61	0	0	0	112	L675 F690 W691 K698 L724 L728	L675-I694 HydrophobicContact CD1-CD1 4.18Å; L675-I694 HydrophobicContact CD2-CD1 4.05Å; F690-I694 HydrophobicContact CD1-CG1 4.01Å; F690-I694 HydrophobicContact CE1-CD1 4Å; F690-I694 HydrophobicContact CE1-CG1 3.61Å; F690-I694 HydrophobicContact CE2-CD1 4.42Å; F690-I694 HydrophobicContact CZ-CD1 3.8Å; F690-I694 HydrophobicContact CZ-CG1 3.91Å; F690-I694 WeakPolarHBondContact O-CG1 3.1Å; F690-I694 PolarHBondContact O-N 3.21Å; W691-I694 HydrophobicContact CE3-CB 4.19Å; W691-I694 HydrophobicContact CE3-CG2 4.12Å; W691-I694 HydrophobicContact CZ3-CG2 4.07Å; W691-I694 PolarHBondContact O-N 3.39Å; I694-K698 WeakPolarHBondContact O-CB 3.29Å; I694-K698 PolarHBondContact O-N 3.26Å; I694-L724 HydrophobicContact CD1-CD2 4.15Å; I694-L724 HydrophobicContact CG2-CD2 3.99Å; I694-L728 HydrophobicContact CG2-CD1 4.31Å; I694-L728 HydrophobicContact CG2-CD2 4.06Å; I694-L728 HydrophobicContact CG2-CG 4.12Å
695	L	94.1	Very high	93.3	Very high	78 Å²	78	61.4 Å²	61.4	41%	0.408	30%	0.3	S	S	.	.	H	α-helix	trans	-67.1	-46.6	172.9	-71.6	169.6	0	0	0	111.6	W691 K692 L697 K698 D699 L728	W691-L695 WeakPolarHBondContact O-CG 3.4Å; W691-L695 PolarHBondContact O-N 2.8Å; K692-L695 PolarHBondContact O-N 2.96Å; L695-L697 VanDerWaalsContact C-N 3.3Å; L695-L697 PolarHBondContact O-N 3.25Å; L695-K698 PolarHBondContact O-N 2.97Å; L695-K698 VanDerWaalsContact O-N 3.12Å; L695-D699 WeakPolarHBondContact O-CB 3.32Å; L695-D699 PolarHBondContact O-N 3.19Å; L695-L728 HydrophobicContact CD2-CD1 4.45Å; L695-L728 HydrophobicContact CD2-CD2 3.95Å; L695-L728 HydrophobicContact CG-CD2 4.46Å
696	L	94.3	Very high	93.1	Very high	68 Å²	68	59 Å²	59	36%	0.356	29%	0.289	S	S	.	.	H	α-helix	trans	-54.9	-46.2	173.7	-179	72	0	0	0	111.7	K692 L693 E700 Y701	K692-L696 WeakPolarHBondContact O-CB 3.48Å; K692-L696 PolarHBondContact O-N 3.22Å; L693-L696 PolarHBondContact O-N 3.13Å; L696-E700 HydrophobicContact CD1-CB 3.95Å; L696-E700 HydrophobicContact CD1-CG 4.09Å; L696-E700 WeakPolarHBondContact CD1-OE1 3.38Å; L696-E700 PolarHBondContact O-N 3.38Å; L696-Y701 PolarHBondContact O-N 3.25Å; L696-Y701 VanDerWaalsContact O-N 3.07Å
697	L	93.9	Very high	92.8	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.312	C	S	.	.	I	π-helix	trans	-59	-47	175.5	168.7	53.3	0	0	0	111.4	L658 L671 L675 L693 L695 Y701 F702 L720 L724	L658-L697 HydrophobicContact CD1-CB 4.28Å; L658-L697 HydrophobicContact CD2-CB 4.31Å; L658-L697 HydrophobicContact CD2-CD1 3.82Å; L658-L697 HydrophobicContact CD2-CG 4.47Å; L671-L697 HydrophobicContact CD1-CD1 4.05Å; L675-L697 HydrophobicContact CD1-CD2 3.68Å; L693-L697 WeakPolarHBondContact O-CB 3.34Å; L693-L697 PolarHBondContact O-N 3.37Å; L695-L697 VanDerWaalsContact C-N 3.3Å; L695-L697 PolarHBondContact O-N 3.25Å; L697-Y701 HydrophobicContact CD1-CD1 3.95Å; L697-Y701 HydrophobicContact CD1-CG 4.49Å; L697-Y701 CarbonylContact O-C 3.56Å; L697-F702 WeakPolarHBondContact O-CB 3.35Å; L697-F702 PolarHBondContact O-N 2.84Å; L697-L720 HydrophobicContact CD1-CD2 4.48Å; L697-L724 HydrophobicContact CD2-CD1 4.22Å; L697-L724 HydrophobicContact CD2-CD2 3.84Å; L697-L724 HydrophobicContact CG-CD1 3.92Å; L697-L724 HydrophobicContact CG-CD2 4.21Å
698	K	92.8	Very high	92.4	Very high	78 Å²	78	57.3 Å²	57.3	34%	0.339	30%	0.303	S	S	.	.	I	π-helix	trans	-67.8	-44.7	179.1	174.8	-179.4	153.9	-71.2	0	113.5	I694 L695 F702 L728	I694-K698 WeakPolarHBondContact O-CB 3.29Å; I694-K698 PolarHBondContact O-N 3.26Å; L695-K698 PolarHBondContact O-N 2.97Å; L695-K698 VanDerWaalsContact O-N 3.12Å; K698-F702 WeakPolarHBondContact O-CB 3.49Å; K698-L728 HydrophobicContact CB-CD1 4.45Å; K698-L728 HydrophobicContact CD-CD1 3.32Å; K698-L728 HydrophobicContact CG-CD1 4.47Å
699	D	91.1	Very high	92.1	Very high	87 Å²	87	55.5 Å²	55.5	47%	0.465	28%	0.282	S	S	.	.	I	π-helix	trans	-98.7	-29.4	-162.9	-69.6	-46.5	0	0	0	113.7	L695	L695-D699 WeakPolarHBondContact O-CB 3.32Å; L695-D699 PolarHBondContact O-N 3.19Å
700	E	91	Very high	91.5	Very high	121 Å²	121	53.3 Å²	53.3	57%	0.565	28%	0.278	S	S	*	.	I	π-helix	trans	-113.8	-30.8	179.3	-66.9	-171.8	-130.9	0	0	114.2	L696 R704	L696-E700 HydrophobicContact CD1-CB 3.95Å; L696-E700 HydrophobicContact CD1-CG 4.09Å; L696-E700 WeakPolarHBondContact CD1-OE1 3.38Å; L696-E700 PolarHBondContact O-N 3.38Å; E700-R704 PolarHBondContact O-NE 3.02Å; E700-R704 VanDerWaalsContact O-NE 3.13Å
701	Y	91.6	Very high	90.6	Very high	7 Å²	7	59 Å²	59	3%	0.027	32%	0.318	C	S	.	.	I	π-helix	trans	-93.9	-37	-176.6	-156.8	-98.8	0	0	0	112.8	L427 M657 L658 M660 P662 T667 L671 L696 L697 R704 I705	L427-Y701 HydrophobicContact CD2-CE2 4.34Å; M657-Y701 PolarHBondContact O-OH 3.17Å; M657-Y701 VanDerWaalsContact O-OH 3.1Å; L658-Y701 HydrophobicContact CB-CD2 4.44Å; L658-Y701 HydrophobicContact CD2-CD1 3.59Å; L658-Y701 HydrophobicContact CD2-CD2 4.14Å; L658-Y701 HydrophobicContact CD2-CE1 3.9Å; L658-Y701 HydrophobicContact CD2-CE2 4.42Å; L658-Y701 HydrophobicContact CD2-CG 3.73Å; L658-Y701 WeakPolarHBondContact O-CD2 3.43Å; L658-Y701 VanDerWaalsContact O-CE2 3.27Å; L658-Y701 WeakPolarHBondContact O-CE2 3.36Å; M660-Y701 VanDerWaalsContact O-CE2 3.27Å; M660-Y701 WeakPolarHBondContact O-CE2 3.21Å; M660-Y701 PolarHBondContact O-OH 3.32Å; P662-Y701 WeakPolarHBondContact CA-OH 3.42Å; P662-Y701 HydrophobicContact CB-CE1 4Å; P662-Y701 HydrophobicContact CG-CE1 4.41Å; T667-Y701 HydrophobicContact CG2-CE1 4.07Å; L671-Y701 HydrophobicContact CD1-CD1 4.37Å; L671-Y701 HydrophobicContact CD1-CE1 4.07Å; L696-Y701 PolarHBondContact O-N 3.25Å; L696-Y701 VanDerWaalsContact O-N 3.07Å; L697-Y701 HydrophobicContact CD1-CD1 3.95Å; L697-Y701 HydrophobicContact CD1-CG 4.49Å; L697-Y701 CarbonylContact O-C 3.56Å; Y701-R704 WeakPolarHBondContact O-CA 3.39Å; Y701-R704 VanDerWaalsContact O-CB 3.31Å; Y701-R704 WeakPolarHBondContact O-CB 3.37Å; Y701-R704 PolarHBondContact O-N 3.08Å; Y701-I705 HydrophobicContact CD1-CD1 3.75Å; Y701-I705 HydrophobicContact CD1-CG1 3.99Å; Y701-I705 HydrophobicContact CE1-CD1 3.91Å; Y701-I705 HydrophobicContact CE1-CG1 3.98Å; Y701-I705 PolarHBondContact O-N 2.9Å; Y701-I705 VanDerWaalsContact O-N 3.17Å
702	F	91.2	Very high	89.6	Confident	7 Å²	7	59.9 Å²	59.9	3%	0.031	35%	0.345	C	S	.	.	H	α-helix	trans	-58.1	-43.3	-179.8	-151.8	-86.4	0	0	0	113.7	L697 K698 R704 I705 E706 V717 L720 K721 L724	L697-F702 WeakPolarHBondContact O-CB 3.35Å; L697-F702 PolarHBondContact O-N 2.84Å; K698-F702 WeakPolarHBondContact O-CB 3.49Å; F702-R704 PolarHBondContact O-N 3.44Å; F702-I705 WeakPolarHBondContact O-CB 3.28Å; F702-I705 PolarHBondContact O-N 3.19Å; F702-I705 VanDerWaalsContact O-N 3.1Å; F702-E706 HydrophobicContact CD1-CG 3.82Å; F702-E706 HydrophobicContact CE1-CG 3.69Å; F702-E706 WeakPolarHBondContact CE1-OE1 3.42Å; F702-E706 PolarHBondContact O-N 3.41Å; F702-V717 HydrophobicContact CE1-CG1 3.61Å; F702-V717 HydrophobicContact CE2-CG1 4.35Å; F702-V717 HydrophobicContact CZ-CG1 3.41Å; F702-V717 VanDerWaalsContact CZ-CG1 3.41Å; F702-V717 WeakPolarHBondContact CZ-O 3.47Å; F702-L720 HydrophobicContact CD2-CD2 4.41Å; F702-L720 HydrophobicContact CD2-CG 4.5Å; F702-L720 HydrophobicContact CE2-CB 4.14Å; F702-L720 HydrophobicContact CE2-CD2 4.07Å; F702-L720 HydrophobicContact CE2-CG 3.93Å; F702-K721 HydrophobicContact CE1-CB 4.2Å; F702-K721 HydrophobicContact CE1-CD 3.65Å; F702-K721 HydrophobicContact CE1-CG 3.84Å; F702-K721 HydrophobicContact CE2-CB 4.08Å; F702-K721 HydrophobicContact CE2-CG 4.29Å; F702-K721 HydrophobicContact CZ-CB 3.51Å; F702-K721 HydrophobicContact CZ-CD 3.88Å; F702-K721 HydrophobicContact CZ-CG 3.64Å; F702-L724 HydrophobicContact CD2-CD1 3.96Å; F702-L724 HydrophobicContact CE2-CD1 4.22Å
703	P	90.7	Very high	88.7	Confident	68 Å²	68	57 Å²	57	44%	0.442	33%	0.333	S	S	.	.	H	α-helix	trans	-62.5	-25.6	175.6	-23.2	35.6	0	0	0	113.3	A707	P703-A707 WeakPolarHBondContact O-CB 3.31Å; P703-A707 PolarHBondContact O-N 3.22Å
704	R	90.7	Very high	88.2	Confident	105 Å²	105	58.5 Å²	58.5	40%	0.396	34%	0.34	S	S	.	.	H	α-helix	trans	-73.7	-39.4	175.2	-55.1	174.2	-175.7	-94.5	3.1	111	L427 P662 E700 Y701 F702 A707 V708	L427-R704 VanDerWaalsContact CD1-NH1 3.27Å; P662-R704 HydrophobicContact CG-CB 3.91Å; E700-R704 PolarHBondContact O-NE 3.02Å; E700-R704 VanDerWaalsContact O-NE 3.13Å; Y701-R704 WeakPolarHBondContact O-CA 3.39Å; Y701-R704 VanDerWaalsContact O-CB 3.31Å; Y701-R704 WeakPolarHBondContact O-CB 3.37Å; Y701-R704 PolarHBondContact O-N 3.08Å; F702-R704 PolarHBondContact O-N 3.44Å; R704-A707 PolarHBondContact O-N 2.88Å; R704-V708 WeakPolarHBondContact O-CG2 3.45Å; R704-V708 PolarHBondContact O-N 3.03Å
705	I	89.8	Confident	87.8	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	36%	0.363	C	S	.	.	H	α-helix	trans	-62	-45.4	171.9	-63.2	174.4	0	0	0	110.2	P662 A668 L671 Y701 F702 A707 V708 T709 V717 L720	P662-I705 HydrophobicContact CB-CG1 3.81Å; P662-I705 HydrophobicContact CG-CG1 4.09Å; A668-I705 HydrophobicContact CB-CG2 3.95Å; L671-I705 HydrophobicContact CD1-CD1 4.31Å; Y701-I705 HydrophobicContact CD1-CD1 3.75Å; Y701-I705 HydrophobicContact CD1-CG1 3.99Å; Y701-I705 HydrophobicContact CE1-CD1 3.91Å; Y701-I705 HydrophobicContact CE1-CG1 3.98Å; Y701-I705 PolarHBondContact O-N 2.9Å; Y701-I705 VanDerWaalsContact O-N 3.17Å; F702-I705 WeakPolarHBondContact O-CB 3.28Å; F702-I705 PolarHBondContact O-N 3.19Å; F702-I705 VanDerWaalsContact O-N 3.1Å; I705-A707 VanDerWaalsContact C-N 3.26Å; I705-A707 PolarHBondContact O-N 3.25Å; I705-V708 WeakPolarHBondContact O-CG2 3.42Å; I705-V708 PolarHBondContact O-N 2.89Å; I705-T709 WeakPolarHBondContact O-CB 3.32Å; I705-T709 PolarHBondContact O-N 2.88Å; I705-T709 PolarHBondContact O-OG1 3.42Å; I705-V717 HydrophobicContact CG2-CB 4.42Å; I705-V717 HydrophobicContact CG2-CG1 4.04Å; I705-V717 HydrophobicContact CG2-CG2 3.67Å; I705-L720 HydrophobicContact CD1-CD2 4.01Å
706	E	88.6	Confident	87.5	Confident	73 Å²	73	57.2 Å²	57.2	34%	0.341	35%	0.345	S	S	.	.	H	α-helix	trans	-64	-29.2	176.5	-68	-174.1	140.8	0	0	112.6	F702 M714 V717 K721	F702-E706 HydrophobicContact CD1-CG 3.82Å; F702-E706 HydrophobicContact CE1-CG 3.69Å; F702-E706 WeakPolarHBondContact CE1-OE1 3.42Å; F702-E706 PolarHBondContact O-N 3.41Å; E706-M714 HydrophobicContact CG-CE 4.25Å; E706-V717 HydrophobicContact CG-CG1 3.94Å; E706-K721 IonicContact OE1-NZ 2.73Å; E706-K721 PolarHBondContact OE1-NZ 2.85Å; E706-K721 IonicContact OE2-NZ 3.22Å
707	A	88.6	Confident	87.3	Confident	86 Å²	86	54 Å²	54	71%	0.711	33%	0.328	S	S	*	.	H	α-helix	trans	-79.3	-26	178.8	0	0	0	0	0	114.9	P703 R704 I705	P703-A707 WeakPolarHBondContact O-CB 3.31Å; P703-A707 PolarHBondContact O-N 3.22Å; R704-A707 PolarHBondContact O-N 2.88Å; I705-A707 VanDerWaalsContact C-N 3.26Å; I705-A707 PolarHBondContact O-N 3.25Å
708	V	87.5	Confident	87.2	Confident	69 Å²	69	58 Å²	58	42%	0.418	35%	0.349	S	S	.	.	H	α-helix	trans	-96.1	-18.9	179.6	-59.8	0	0	0	0	114.1	P662 R704 I705	P662-V708 HydrophobicContact CB-CG2 4.35Å; P662-V708 HydrophobicContact CG-CG1 4.49Å; P662-V708 HydrophobicContact CG-CG2 4.06Å; R704-V708 WeakPolarHBondContact O-CG2 3.45Å; R704-V708 PolarHBondContact O-N 3.03Å; I705-V708 WeakPolarHBondContact O-CG2 3.42Å; I705-V708 PolarHBondContact O-N 2.89Å
709	T	86.8	Confident	87.1	Confident	12 Å²	12	58.9 Å²	58.9	7%	0.074	35%	0.35	C	S	.	.	S	Bend	trans	-93.2	131.5	-172.1	-52.1	0	0	0	0	110.9	I705 E713 M714 V717	I705-T709 WeakPolarHBondContact O-CB 3.32Å; I705-T709 PolarHBondContact O-N 2.88Å; I705-T709 PolarHBondContact O-OG1 3.42Å; T709-E713 HydrophobicContact CG2-CB 3.56Å; T709-M714 HydrophobicContact CG2-SD 3.98Å; T709-V717 HydrophobicContact CG2-CG2 3.83Å
710	S	83.1	Confident	87.3	Confident	59 Å²	59	54.7 Å²	54.7	41%	0.413	33%	0.328	S	S	.	.			trans	-73.1	159.1	178.4	81.8	0	0	0	0	111.9	G712 E713 M714	S710-G712 PolarHBondContact O-N 3.19Å; S710-G712 PolarHBondContact OG-N 3.48Å; S710-E713 WeakPolarHBondContact CB-OE2 3.46Å; S710-E713 PolarHBondContact N-OE2 3.11Å; S710-E713 VanDerWaalsContact N-OE2 3.12Å; S710-E713 PolarHBondContact O-N 3.31Å; S710-E713 VanDerWaalsContact OG-CD 3.28Å; S710-E713 PolarHBondContact OG-OE2 3.37Å; S710-M714 WeakPolarHBondContact O-CG 3.31Å; S710-M714 PolarHBondContact O-N 2.9Å
711	S	77.4	Confident	87.4	Confident	119 Å²	119	52.6 Å²	52.6	83%	0.832	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-14.6	179.1	-171.5	0	0	0	0	114.5
712	G	72.8	Confident	87.5	Confident	74 Å²	74	58 Å²	58	76%	0.763	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-27	173.5	0	0	0	0	0	113.9	S710	S710-G712 PolarHBondContact O-N 3.19Å; S710-G712 PolarHBondContact OG-N 3.48Å
713	E	77.6	Confident	87.7	Confident	70 Å²	70	59.3 Å²	59.3	33%	0.327	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-0.5	-169.7	-64.5	154.4	141.9	0	0	112.6	D665 T709 S710 G715 S716	D665-E713 HydrophobicContact CB-CB 4.4Å; T709-E713 HydrophobicContact CG2-CB 3.56Å; S710-E713 WeakPolarHBondContact CB-OE2 3.46Å; S710-E713 PolarHBondContact N-OE2 3.11Å; S710-E713 VanDerWaalsContact N-OE2 3.12Å; S710-E713 PolarHBondContact O-N 3.31Å; S710-E713 VanDerWaalsContact OG-CD 3.28Å; S710-E713 PolarHBondContact OG-OE2 3.37Å; E713-G715 PolarHBondContact O-N 2.78Å; E713-S716 PolarHBondContact O-N 2.9Å
714	M	84.3	Confident	87.8	Confident	46 Å²	46	56.2 Å²	56.2	23%	0.227	33%	0.327	C	S	.	.	H	α-helix	trans	-60.6	-11.7	-177	-67.3	-63	-79.7	0	0	114.8	E706 T709 S710 S716 V717 I718	E706-M714 HydrophobicContact CG-CE 4.25Å; T709-M714 HydrophobicContact CG2-SD 3.98Å; S710-M714 WeakPolarHBondContact O-CG 3.31Å; S710-M714 PolarHBondContact O-N 2.9Å; M714-S716 PolarHBondContact O-N 3.03Å; M714-V717 HydrophobicContact CE-CB 4.28Å; M714-V717 HydrophobicContact CE-CG1 4.05Å; M714-V717 WeakPolarHBondContact O-CB 3.5Å; M714-V717 PolarHBondContact O-N 2.95Å; M714-V717 VanDerWaalsContact O-N 3.15Å; M714-V717 HydrophobicContact SD-CB 4.18Å; M714-V717 HydrophobicContact SD-CG1 4.42Å; M714-V717 HydrophobicContact SD-CG2 3.96Å; M714-I718 HydrophobicContact CB-CD1 4.25Å; M714-I718 WeakPolarHBondContact O-CB 3.4Å; M714-I718 WeakPolarHBondContact O-CD1 3.49Å; M714-I718 VanDerWaalsContact O-CG1 3.26Å; M714-I718 WeakPolarHBondContact O-CG1 3.44Å; M714-I718 PolarHBondContact O-N 3.27Å
715	G	86.1	Confident	87.9	Confident	46 Å²	46	54.9 Å²	54.9	47%	0.474	33%	0.326	S	S	.	.	H	α-helix	trans	-58.6	-27.7	177.6	0	0	0	0	0	114	E713 R719	E713-G715 PolarHBondContact O-N 2.78Å; G715-R719 WeakPolarHBondContact O-CG 3.32Å; G715-R719 PolarHBondContact O-NE 3.12Å
716	S	87.1	Confident	88.1	Confident	6 Å²	6	59.1 Å²	59.1	4%	0.042	35%	0.352	C	S	.	.	H	α-helix	trans	-81.7	-39.5	175.5	-55.4	0	0	0	0	112.2	D665 T669 E713 M714 R719 L720	D665-S716 WeakPolarHBondContact OD1-CB 3.41Å; D665-S716 PolarHBondContact OD1-OG 3.38Å; T669-S716 VanDerWaalsContact OG1-CB 3.26Å; T669-S716 WeakPolarHBondContact OG1-CB 3.42Å; T669-S716 PolarHBondContact OG1-OG 3.37Å; E713-S716 PolarHBondContact O-N 2.9Å; M714-S716 PolarHBondContact O-N 3.03Å; S716-R719 PolarHBondContact O-N 3.32Å; S716-R719 PolarHBondContact OG-NH2 3.39Å; S716-L720 PolarHBondContact O-N 3.31Å
717	V	90.4	Very high	88.3	Confident	1 Å²	1	56 Å²	56	1%	0.006	34%	0.338	C	S	.	.	H	α-helix	trans	-61.5	-47.5	174.8	-173	0	0	0	0	110.3	A668 F702 I705 E706 T709 M714 R719 L720 K721	A668-V717 HydrophobicContact CB-CG2 4.1Å; F702-V717 HydrophobicContact CE1-CG1 3.61Å; F702-V717 HydrophobicContact CE2-CG1 4.35Å; F702-V717 HydrophobicContact CZ-CG1 3.41Å; F702-V717 VanDerWaalsContact CZ-CG1 3.41Å; F702-V717 WeakPolarHBondContact CZ-O 3.47Å; I705-V717 HydrophobicContact CG2-CB 4.42Å; I705-V717 HydrophobicContact CG2-CG1 4.04Å; I705-V717 HydrophobicContact CG2-CG2 3.67Å; E706-V717 HydrophobicContact CG-CG1 3.94Å; T709-V717 HydrophobicContact CG2-CG2 3.83Å; M714-V717 HydrophobicContact CE-CB 4.28Å; M714-V717 HydrophobicContact CE-CG1 4.05Å; M714-V717 WeakPolarHBondContact O-CB 3.5Å; M714-V717 PolarHBondContact O-N 2.95Å; M714-V717 VanDerWaalsContact O-N 3.15Å; M714-V717 HydrophobicContact SD-CB 4.18Å; M714-V717 HydrophobicContact SD-CG1 4.42Å; M714-V717 HydrophobicContact SD-CG2 3.96Å; V717-R719 PolarHBondContact O-N 3.47Å; V717-L720 PolarHBondContact O-N 3Å; V717-K721 PolarHBondContact O-N 3.08Å
718	I	91.5	Very high	88.5	Confident	82 Å²	82	54 Å²	54	42%	0.421	32%	0.315	S	S	.	.	H	α-helix	trans	-60.6	-41.3	179.4	-68.1	163	0	0	0	111.9	M714 K721 Q722	M714-I718 HydrophobicContact CB-CD1 4.25Å; M714-I718 WeakPolarHBondContact O-CB 3.4Å; M714-I718 WeakPolarHBondContact O-CD1 3.49Å; M714-I718 VanDerWaalsContact O-CG1 3.26Å; M714-I718 WeakPolarHBondContact O-CG1 3.44Å; M714-I718 PolarHBondContact O-N 3.27Å; I718-K721 WeakPolarHBondContact O-CB 3.47Å; I718-K721 PolarHBondContact O-N 3.48Å; I718-Q722 HydrophobicContact CG2-CG 4.45Å; I718-Q722 WeakPolarHBondContact O-CG 3.25Å; I718-Q722 PolarHBondContact O-N 2.93Å
719	R	92.3	Very high	88.7	Confident	97 Å²	97	58 Å²	58	37%	0.366	33%	0.327	S	S	.	.	H	α-helix	trans	-60.3	-47.3	175.7	-75.8	179	-70.7	140	-7.7	111.7	T669 G715 S716 V717 K721 Q722 F723	T669-R719 PolarHBondContact OG1-NH2 3.02Å; G715-R719 WeakPolarHBondContact O-CG 3.32Å; G715-R719 PolarHBondContact O-NE 3.12Å; S716-R719 PolarHBondContact O-N 3.32Å; S716-R719 PolarHBondContact OG-NH2 3.39Å; V717-R719 PolarHBondContact O-N 3.47Å; R719-K721 PolarHBondContact O-N 3.04Å; R719-Q722 PolarHBondContact O-N 3.25Å; R719-F723 WeakPolarHBondContact O-CB 3.37Å; R719-F723 PolarHBondContact O-N 3.26Å
720	L	93.9	Very high	89	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.7	-41.9	175.4	-176.8	59.2	0	0	0	111.5	L671 F672 L675 L697 F702 I705 S716 V717 F723 L724	L671-L720 HydrophobicContact CB-CD1 4.41Å; L671-L720 HydrophobicContact CB-CD2 4.2Å; L671-L720 HydrophobicContact CD1-CD2 4.49Å; F672-L720 HydrophobicContact CB-CB 4.2Å; F672-L720 HydrophobicContact CB-CD1 4.03Å; L675-L720 HydrophobicContact CD1-CD1 4.4Å; L697-L720 HydrophobicContact CD1-CD2 4.48Å; F702-L720 HydrophobicContact CD2-CD2 4.41Å; F702-L720 HydrophobicContact CD2-CG 4.5Å; F702-L720 HydrophobicContact CE2-CB 4.14Å; F702-L720 HydrophobicContact CE2-CD2 4.07Å; F702-L720 HydrophobicContact CE2-CG 3.93Å; I705-L720 HydrophobicContact CD1-CD2 4.01Å; S716-L720 PolarHBondContact O-N 3.31Å; V717-L720 PolarHBondContact O-N 3Å; L720-F723 PolarHBondContact O-N 3.11Å; L720-L724 HydrophobicContact CD1-CD1 4.01Å; L720-L724 HydrophobicContact CD1-CG 4.11Å; L720-L724 HydrophobicContact CG-CD1 3.87Å; L720-L724 HydrophobicContact CG-CG 4.41Å; L720-L724 WeakPolarHBondContact O-CB 3.29Å; L720-L724 VanDerWaalsContact O-CG 3.26Å; L720-L724 WeakPolarHBondContact O-CG 3.32Å; L720-L724 PolarHBondContact O-N 3.01Å
721	K	93.3	Very high	89.3	Confident	76 Å²	76	67.7 Å²	67.7	33%	0.33	36%	0.363	S	S	.	.	H	α-helix	trans	-58	-51.3	177	-147.4	167.6	-167	160.7	0	111.9	F702 E706 V717 I718 R719 F723 L724 E725	F702-K721 HydrophobicContact CE1-CB 4.2Å; F702-K721 HydrophobicContact CE1-CD 3.65Å; F702-K721 HydrophobicContact CE1-CG 3.84Å; F702-K721 HydrophobicContact CE2-CB 4.08Å; F702-K721 HydrophobicContact CE2-CG 4.29Å; F702-K721 HydrophobicContact CZ-CB 3.51Å; F702-K721 HydrophobicContact CZ-CD 3.88Å; F702-K721 HydrophobicContact CZ-CG 3.64Å; E706-K721 IonicContact OE1-NZ 2.73Å; E706-K721 PolarHBondContact OE1-NZ 2.85Å; E706-K721 IonicContact OE2-NZ 3.22Å; V717-K721 PolarHBondContact O-N 3.08Å; I718-K721 WeakPolarHBondContact O-CB 3.47Å; I718-K721 PolarHBondContact O-N 3.48Å; R719-K721 PolarHBondContact O-N 3.04Å; K721-F723 VanDerWaalsContact C-N 3.34Å; K721-F723 PolarHBondContact O-N 2.94Å; K721-L724 PolarHBondContact O-N 3.41Å; K721-E725 WeakPolarHBondContact O-CB 3.47Å; K721-E725 WeakPolarHBondContact O-CG 3.46Å; K721-E725 PolarHBondContact O-N 3.08Å
722	Q	94.1	Very high	90	Very high	122 Å²	122	67.3 Å²	67.3	57%	0.57	35%	0.348	S	S	*	.	H	α-helix	trans	-62.5	-39.6	-179.7	-71.2	174.7	-1.6	0	0	112	I718 R719 T726	I718-Q722 HydrophobicContact CG2-CG 4.45Å; I718-Q722 WeakPolarHBondContact O-CG 3.25Å; I718-Q722 PolarHBondContact O-N 2.93Å; R719-Q722 PolarHBondContact O-N 3.25Å; Q722-T726 VanDerWaalsContact O-CB 3.27Å; Q722-T726 WeakPolarHBondContact O-CB 3.35Å; Q722-T726 PolarHBondContact O-N 3.29Å; Q722-T726 PolarHBondContact O-OG1 2.91Å
723	F	94.4	Very high	90.9	Very high	33 Å²	33	63.8 Å²	63.8	15%	0.145	31%	0.312	C	S	.	.	H	α-helix	trans	-63.4	-48.8	175.2	178.3	-89.7	0	0	0	112.3	F672 L675 E676 R719 L720 K721 T726 S727 I733	F672-F723 HydrophobicContact CD2-CB 3.81Å; F672-F723 HydrophobicContact CD2-CD2 4.3Å; F672-F723 HydrophobicContact CD2-CG 4.07Å; F672-F723 HydrophobicContact CE2-CB 3.9Å; F672-F723 AromaticContact CE2-CD2 3.98Å; F672-F723 HydrophobicContact CE2-CD2 3.98Å; F672-F723 HydrophobicContact CE2-CG 4.14Å; L675-F723 HydrophobicContact CB-CD1 4.45Å; L675-F723 HydrophobicContact CB-CE1 3.65Å; L675-F723 HydrophobicContact CB-CZ 3.96Å; L675-F723 HydrophobicContact CD1-CE1 4.42Å; E676-F723 HydrophobicContact CB-CE2 4.37Å; R719-F723 WeakPolarHBondContact O-CB 3.37Å; R719-F723 PolarHBondContact O-N 3.26Å; L720-F723 PolarHBondContact O-N 3.11Å; K721-F723 VanDerWaalsContact C-N 3.34Å; K721-F723 PolarHBondContact O-N 2.94Å; F723-T726 PolarHBondContact O-N 3.47Å; F723-S727 VanDerWaalsContact O-CB 3.32Å; F723-S727 WeakPolarHBondContact O-CB 3.33Å; F723-S727 PolarHBondContact O-N 2.72Å; F723-S727 PolarHBondContact O-OG 2.94Å; F723-I733 HydrophobicContact CE1-CD1 4.15Å; F723-I733 HydrophobicContact CE2-CG2 4.4Å; F723-I733 HydrophobicContact CZ-CD1 4.07Å; F723-I733 HydrophobicContact CZ-CG1 4.43Å; F723-I733 HydrophobicContact CZ-CG2 3.85Å
724	L	93.9	Very high	91.5	Very high	3 Å²	3	64.6 Å²	64.6	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-64.7	-46.4	179.9	-67.8	169.1	0	0	0	111.4	I694 L697 F702 L720 K721 T726 S727 L728	I694-L724 HydrophobicContact CD1-CD2 4.15Å; I694-L724 HydrophobicContact CG2-CD2 3.99Å; L697-L724 HydrophobicContact CD2-CD1 4.22Å; L697-L724 HydrophobicContact CD2-CD2 3.84Å; L697-L724 HydrophobicContact CG-CD1 3.92Å; L697-L724 HydrophobicContact CG-CD2 4.21Å; F702-L724 HydrophobicContact CD2-CD1 3.96Å; F702-L724 HydrophobicContact CE2-CD1 4.22Å; L720-L724 HydrophobicContact CD1-CD1 4.01Å; L720-L724 HydrophobicContact CD1-CG 4.11Å; L720-L724 HydrophobicContact CG-CD1 3.87Å; L720-L724 HydrophobicContact CG-CG 4.41Å; L720-L724 WeakPolarHBondContact O-CB 3.29Å; L720-L724 VanDerWaalsContact O-CG 3.26Å; L720-L724 WeakPolarHBondContact O-CG 3.32Å; L720-L724 PolarHBondContact O-N 3.01Å; K721-L724 PolarHBondContact O-N 3.41Å; L724-T726 PolarHBondContact O-N 2.87Å; L724-S727 PolarHBondContact O-N 3.11Å; L724-L728 WeakPolarHBondContact O-CB 3.37Å; L724-L728 WeakPolarHBondContact O-CG 3.33Å; L724-L728 PolarHBondContact O-N 3.1Å
725	E	93.6	Very high	91.8	Very high	78 Å²	78	65.9 Å²	65.9	36%	0.364	34%	0.337	S	S	.	.	H	α-helix	trans	-59.5	-45.1	175.7	-82	-168.3	-136.6	0	0	112.4	K721 L728 K729	K721-E725 WeakPolarHBondContact O-CB 3.47Å; K721-E725 WeakPolarHBondContact O-CG 3.46Å; K721-E725 PolarHBondContact O-N 3.08Å; E725-L728 PolarHBondContact O-N 3.35Å; E725-K729 WeakPolarHBondContact O-CB 3.38Å; E725-K729 VanDerWaalsContact O-CD 3.31Å; E725-K729 WeakPolarHBondContact O-CD 3.48Å; E725-K729 WeakPolarHBondContact O-CG 3.49Å; E725-K729 PolarHBondContact O-N 3.31Å; E725-K729 IonicContact OE2-NZ 2.74Å; E725-K729 PolarHBondContact OE2-NZ 3.07Å
726	T	93.8	Very high	92.1	Very high	90 Å²	90	64.2 Å²	64.2	55%	0.552	32%	0.318	S	S	*	.	H	α-helix	trans	-63.3	-47.5	179	-58.1	0	0	0	0	110.5	Q722 F723 L724 L728 K729 S730	Q722-T726 VanDerWaalsContact O-CB 3.27Å; Q722-T726 WeakPolarHBondContact O-CB 3.35Å; Q722-T726 PolarHBondContact O-N 3.29Å; Q722-T726 PolarHBondContact O-OG1 2.91Å; F723-T726 PolarHBondContact O-N 3.47Å; L724-T726 PolarHBondContact O-N 2.87Å; T726-L728 VanDerWaalsContact C-N 3.33Å; T726-L728 PolarHBondContact O-N 3.1Å; T726-K729 PolarHBondContact O-N 3.14Å; T726-S730 PolarHBondContact O-N 3.44Å; T726-S730 PolarHBondContact O-OG 3.46Å; T726-S730 VanDerWaalsContact O-OG 3.04Å
727	S	92	Very high	92	Very high	6 Å²	6	71.1 Å²	71.1	4%	0.042	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-36.8	-179.7	-58	0	0	0	0	113	W691 F723 L724 S730 R731 Q732	W691-S727 VanDerWaalsContact CH2-O 3.25Å; W691-S727 WeakPolarHBondContact CH2-O 3.43Å; F723-S727 VanDerWaalsContact O-CB 3.32Å; F723-S727 WeakPolarHBondContact O-CB 3.33Å; F723-S727 PolarHBondContact O-N 2.72Å; F723-S727 PolarHBondContact O-OG 2.94Å; L724-S727 PolarHBondContact O-N 3.11Å; S727-S730 WeakPolarHBondContact CA-OG 3.31Å; S727-S730 PolarHBondContact O-OG 3Å; S727-S730 VanDerWaalsContact O-OG 3.05Å; S727-R731 CarbonylContact O-C 3.59Å; S727-R731 VanDerWaalsContact O-CA 3.27Å; S727-R731 WeakPolarHBondContact O-CA 3.44Å; S727-R731 PolarHBondContact O-N 2.91Å; S727-Q732 PolarHBondContact O-N 3.34Å
728	L	92.1	Very high	91.7	Very high	44 Å²	44	72.2 Å²	72.2	23%	0.23	36%	0.358	C	S	.	.	H	α-helix	trans	-76.5	-34.3	177.2	-74.2	165.4	0	0	0	112.6	W691 I694 L695 K698 L724 E725 T726 R731	W691-L728 HydrophobicContact CE3-CD2 3.89Å; W691-L728 HydrophobicContact CZ3-CD2 3.82Å; W691-L728 HydrophobicContact CZ3-CG 4.32Å; I694-L728 HydrophobicContact CG2-CD1 4.31Å; I694-L728 HydrophobicContact CG2-CD2 4.06Å; I694-L728 HydrophobicContact CG2-CG 4.12Å; L695-L728 HydrophobicContact CD2-CD1 4.45Å; L695-L728 HydrophobicContact CD2-CD2 3.95Å; L695-L728 HydrophobicContact CG-CD2 4.46Å; K698-L728 HydrophobicContact CB-CD1 4.45Å; K698-L728 HydrophobicContact CD-CD1 3.32Å; K698-L728 HydrophobicContact CG-CD1 4.47Å; L724-L728 WeakPolarHBondContact O-CB 3.37Å; L724-L728 WeakPolarHBondContact O-CG 3.33Å; L724-L728 PolarHBondContact O-N 3.1Å; E725-L728 PolarHBondContact O-N 3.35Å; T726-L728 VanDerWaalsContact C-N 3.33Å; T726-L728 PolarHBondContact O-N 3.1Å; L728-R731 PolarHBondContact O-N 3.1Å
729	K	93	Very high	91.6	Very high	154 Å²	154	72.3 Å²	72.3	67%	0.67	36%	0.357	S	S	*	.	H	α-helix	trans	-68.2	-41.1	174.6	-71.5	164	-165.9	171.1	0	111.7	E725 T726	E725-K729 WeakPolarHBondContact O-CB 3.38Å; E725-K729 VanDerWaalsContact O-CD 3.31Å; E725-K729 WeakPolarHBondContact O-CD 3.48Å; E725-K729 WeakPolarHBondContact O-CG 3.49Å; E725-K729 PolarHBondContact O-N 3.31Å; E725-K729 IonicContact OE2-NZ 2.74Å; E725-K729 PolarHBondContact OE2-NZ 3.07Å; T726-K729 PolarHBondContact O-N 3.14Å
730	S	91.8	Very high	91.5	Very high	65 Å²	65	68.9 Å²	68.9	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-77	-21.8	174.5	61.5	0	0	0	0	113.8	T726 S727 Q732	T726-S730 PolarHBondContact O-N 3.44Å; T726-S730 PolarHBondContact O-OG 3.46Å; T726-S730 VanDerWaalsContact O-OG 3.04Å; S727-S730 WeakPolarHBondContact CA-OG 3.31Å; S727-S730 PolarHBondContact O-OG 3Å; S727-S730 VanDerWaalsContact O-OG 3.05Å; S730-Q732 PolarHBondContact O-N 2.69Å; S730-Q732 PolarHBondContact OG-N 3.02Å; S730-Q732 PolarHBondContact OG-O 3.49Å
731	R	90	Very high	91.3	Very high	209 Å²	209	71.2 Å²	71.2	79%	0.789	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	26.6	-163.8	-56.5	-177.5	176.2	-172	-1.4	113.4	W691 S727 L728	W691-R731 VanDerWaalsContact CZ2-O 3.24Å; W691-R731 WeakPolarHBondContact CZ2-O 3.36Å; S727-R731 CarbonylContact O-C 3.59Å; S727-R731 VanDerWaalsContact O-CA 3.27Å; S727-R731 WeakPolarHBondContact O-CA 3.44Å; S727-R731 PolarHBondContact O-N 2.91Å; L728-R731 PolarHBondContact O-N 3.1Å
732	Q	91.5	Very high	91	Very high	111 Å²	111	70.9 Å²	70.9	52%	0.519	37%	0.373	S	S	.	.	S	Bend	trans	-151.8	129	-177.4	-172.6	179	7.6	0	0	111.4	M683 S727 S730	M683-Q732 HydrophobicContact CE-CG 4.01Å; M683-Q732 HydrophobicContact SD-CG 4.38Å; S727-Q732 PolarHBondContact O-N 3.34Å; S730-Q732 PolarHBondContact O-N 2.69Å; S730-Q732 PolarHBondContact OG-N 3.02Å; S730-Q732 PolarHBondContact OG-O 3.49Å
733	I	93	Very high	90.7	Very high	1 Å²	1	69.8 Å²	69.8	1%	0.005	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-82	124.9	164.3	-60.2	-172.1	0	0	0	108.8	N680 M683 F690 W691 F723	N680-I733 HydrophobicContact CB-CG2 4.28Å; M683-I733 HydrophobicContact SD-CB 4.21Å; M683-I733 HydrophobicContact SD-CG1 4.44Å; M683-I733 PolarHBondContact SD-N 3.34Å; F690-I733 HydrophobicContact CE1-CD1 3.52Å; F690-I733 HydrophobicContact CE1-CG1 4.49Å; F690-I733 HydrophobicContact CZ-CD1 3.71Å; W691-I733 HydrophobicContact CH2-CG1 4.42Å; F723-I733 HydrophobicContact CE1-CD1 4.15Å; F723-I733 HydrophobicContact CE2-CG2 4.4Å; F723-I733 HydrophobicContact CZ-CD1 4.07Å; F723-I733 HydrophobicContact CZ-CG1 4.43Å; F723-I733 HydrophobicContact CZ-CG2 3.85Å
734	S	89.6	Confident	90.6	Very high	87 Å²	87	69 Å²	69	61%	0.608	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-60	150.4	175.9	-60.8	0	0	0	0	112.2
735	P	90.1	Very high	90.4	Very high	73 Å²	73	71.5 Å²	71.5	47%	0.474	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-59.9	144.8	166.4	28.2	-34.4	0	0	0	110.8	N680	N680-P735 WeakPolarHBondContact ND2-CA 3.35Å
736	P	91.9	Very high	90.1	Very high	11 Å²	11	77.4 Å²	77.4	7%	0.071	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-67.5	149.1	-179.6	27.3	-34.2	0	0	0	111.9	F549 Q739	F549-P736 HydrophobicContact CE1-CB 4.2Å; F549-P736 HydrophobicContact CE1-CG 3.6Å; F549-P736 HydrophobicContact CE2-CB 4.17Å; F549-P736 HydrophobicContact CE2-CG 4.4Å; F549-P736 HydrophobicContact CZ-CB 3.47Å; F549-P736 VanDerWaalsContact CZ-CB 3.47Å; F549-P736 HydrophobicContact CZ-CG 3.41Å; F549-P736 VanDerWaalsContact CZ-CG 3.41Å; P736-Q739 HydrophobicContact CG-CB 4.24Å; P736-Q739 WeakPolarHBondContact O-CB 3.45Å; P736-Q739 PolarHBondContact O-N 3.04Å
737	K	86.8	Confident	89.6	Confident	150 Å²	150	76.2 Å²	76.2	65%	0.652	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	141.3	170.4	-58.9	173.1	-176	165.3	0	109.4	E546 F549	E546-K737 HydrophobicContact CG-CB 4.36Å; E546-K737 WeakPolarHBondContact OE1-CB 3.46Å; F549-K737 WeakPolarHBondContact CE2-O 3.41Å
738	G	83.9	Confident	89.5	Confident	24 Å²	24	79.8 Å²	79.8	25%	0.247	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	2.4	-172.7	0	0	0	0	0	115.9	F549 L740	F549-G738 WeakPolarHBondContact CB-O 3.38Å; F549-G738 WeakPolarHBondContact CD2-O 3.39Å; F549-G738 WeakPolarHBondContact CG-O 3.41Å; G738-L740 PolarHBondContact O-N 3.33Å
739	Q	88.3	Confident	89.3	Confident	84 Å²	84	81.6 Å²	81.6	39%	0.393	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-60	123.2	176.3	-172.4	170.2	9.5	0	0	111.4	P736 S741	P736-Q739 HydrophobicContact CG-CB 4.24Å; P736-Q739 WeakPolarHBondContact O-CB 3.45Å; P736-Q739 PolarHBondContact O-N 3.04Å; Q739-S741 PolarHBondContact O-N 3.48Å
740	L	90.3	Very high	89.1	Confident	26 Å²	26	77.6 Å²	77.6	14%	0.136	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-60.5	118.3	-175.8	-56.8	178.1	0	0	0	111.7	F549 P550 V553 G738 F744 W745	F549-L740 HydrophobicContact CB-CD2 4.3Å; F549-L740 HydrophobicContact CB-CG 4Å; P550-L740 HydrophobicContact CB-CD2 4.37Å; V553-L740 HydrophobicContact CB-CD1 4.29Å; V553-L740 HydrophobicContact CG1-CD1 3.66Å; G738-L740 PolarHBondContact O-N 3.33Å; L740-F744 HydrophobicContact CB-CD1 4.02Å; L740-F744 HydrophobicContact CB-CE1 4.48Å; L740-F744 HydrophobicContact CD1-CD1 4.34Å; L740-F744 HydrophobicContact CD1-CE1 3.98Å; L740-F744 HydrophobicContact CD2-CD1 3.89Å; L740-F744 HydrophobicContact CD2-CD2 4.31Å; L740-F744 HydrophobicContact CD2-CE1 3.84Å; L740-F744 HydrophobicContact CD2-CE2 4.25Å; L740-F744 HydrophobicContact CD2-CG 4.14Å; L740-F744 HydrophobicContact CD2-CZ 4.03Å; L740-F744 HydrophobicContact CG-CD1 4.28Å; L740-F744 HydrophobicContact CG-CE1 4.3Å; L740-W745 HydrophobicContact CB-CZ2 4.33Å; L740-W745 HydrophobicContact CD1-CH2 4.13Å; L740-W745 HydrophobicContact CD1-CZ2 3.51Å
741	S	90	Very high	89	Confident	49 Å²	49	78.4 Å²	78.4	34%	0.343	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-85.5	164.6	-174.3	70	0	0	0	0	112.9	Q739 T743 F744 W745	Q739-S741 PolarHBondContact O-N 3.48Å; S741-T743 PolarHBondContact O-N 3.36Å; S741-T743 VanDerWaalsContact O-N 3.12Å; S741-T743 PolarHBondContact OG-N 3.35Å; S741-T743 PolarHBondContact OG-OG1 3.03Å; S741-F744 PolarHBondContact O-N 3.46Å; S741-F744 PolarHBondContact OG-N 3.24Å; S741-W745 PolarHBondContact O-N 3.23Å
742	A	87.4	Confident	88.9	Confident	68 Å²	68	70.2 Å²	70.2	56%	0.562	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	0	167.9	0	0	0	0	0	113.9	R746	A742-R746 VanDerWaalsContact O-CZ 3.27Å; A742-R746 PolarHBondContact O-NE 3.16Å; A742-R746 PolarHBondContact O-NH2 2.95Å
743	T	88.1	Confident	88.7	Confident	100 Å²	100	67.5 Å²	67.5	61%	0.613	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-39.5	167.5	47.7	0	0	0	0	111.4	S741 W745 R746 S747	S741-T743 PolarHBondContact O-N 3.36Å; S741-T743 VanDerWaalsContact O-N 3.12Å; S741-T743 PolarHBondContact OG-N 3.35Å; S741-T743 PolarHBondContact OG-OG1 3.03Å; T743-W745 VanDerWaalsContact C-N 3.32Å; T743-W745 PolarHBondContact O-N 3.42Å; T743-R746 CarbonylContact O-C 3.46Å; T743-R746 WeakPolarHBondContact O-CA 3.34Å; T743-R746 PolarHBondContact O-N 3.42Å; T743-S747 PolarHBondContact O-N 3.08Å
744	F	91.4	Very high	88.4	Confident	16 Å²	16	72.2 Å²	72.2	7%	0.07	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-56.4	-42.4	173.5	170.5	-90.9	0	0	0	112.4	T484 S486 G487 L490 L740 S741 R746 S747	T484-F744 WeakPolarHBondContact O-CD2 3.47Å; T484-F744 WeakPolarHBondContact O-CE2 3.34Å; S486-F744 VanDerWaalsContact C-CE2 3.45Å; S486-F744 WeakPolarHBondContact O-CZ 3.25Å; G487-F744 WeakPolarHBondContact CA-O 3.49Å; G487-F744 PolarHBondContact N-O 3.29Å; L490-F744 HydrophobicContact CB-CZ 4.16Å; L490-F744 HydrophobicContact CD2-CE1 3.87Å; L490-F744 HydrophobicContact CD2-CZ 3.8Å; L740-F744 HydrophobicContact CB-CD1 4.02Å; L740-F744 HydrophobicContact CB-CE1 4.48Å; L740-F744 HydrophobicContact CD1-CD1 4.34Å; L740-F744 HydrophobicContact CD1-CE1 3.98Å; L740-F744 HydrophobicContact CD2-CD1 3.89Å; L740-F744 HydrophobicContact CD2-CD2 4.31Å; L740-F744 HydrophobicContact CD2-CE1 3.84Å; L740-F744 HydrophobicContact CD2-CE2 4.25Å; L740-F744 HydrophobicContact CD2-CG 4.14Å; L740-F744 HydrophobicContact CD2-CZ 4.03Å; L740-F744 HydrophobicContact CG-CD1 4.28Å; L740-F744 HydrophobicContact CG-CE1 4.3Å; S741-F744 PolarHBondContact O-N 3.46Å; S741-F744 PolarHBondContact OG-N 3.24Å; F744-R746 PolarHBondContact O-N 2.67Å; F744-R746 VanDerWaalsContact O-N 3.15Å; F744-S747 PolarHBondContact O-N 2.9Å; F744-S747 PolarHBondContact O-OG 3.02Å
745	W	90.1	Very high	88.3	Confident	55 Å²	55	71.1 Å²	71.1	21%	0.208	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-74.1	3.9	176.2	-62.1	114	0	0	0	114.8	L490 V553 W634 P635 Y636 L740 S741 T743	L490-W745 HydrophobicContact CD2-CH2 3.9Å; L490-W745 HydrophobicContact CD2-CZ3 4.1Å; V553-W745 HydrophobicContact CG1-CH2 3.85Å; V553-W745 HydrophobicContact CG1-CZ2 4.17Å; V553-W745 HydrophobicContact CG2-CH2 4.16Å; V553-W745 HydrophobicContact CG2-CZ2 4.12Å; W634-W745 HydrophobicContact CE3-CH2 4.39Å; W634-W745 HydrophobicContact CH2-CZ3 4.44Å; W634-W745 HydrophobicContact CZ3-CH2 4.05Å; W634-W745 HydrophobicContact CZ3-CZ3 4.24Å; P635-W745 HydrophobicContact CG-CD2 3.94Å; P635-W745 HydrophobicContact CG-CE3 3.8Å; P635-W745 HydrophobicContact CG-CH2 3.67Å; P635-W745 HydrophobicContact CG-CZ2 3.81Å; P635-W745 HydrophobicContact CG-CZ3 3.67Å; Y636-W745 AromaticContact CE2-CE3 3.88Å; Y636-W745 HydrophobicContact CE2-CE3 3.88Å; Y636-W745 AromaticContact CE2-CZ3 3.85Å; Y636-W745 HydrophobicContact CE2-CZ3 3.85Å; L740-W745 HydrophobicContact CB-CZ2 4.33Å; L740-W745 HydrophobicContact CD1-CH2 4.13Å; L740-W745 HydrophobicContact CD1-CZ2 3.51Å; S741-W745 PolarHBondContact O-N 3.23Å; T743-W745 VanDerWaalsContact C-N 3.32Å; T743-W745 PolarHBondContact O-N 3.42Å
746	R	86.6	Confident	88.2	Confident	203 Å²	203	70.9 Å²	70.9	77%	0.766	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-119	0.8	174.7	-80.6	-175.4	-77.7	178.7	-5.9	113.2	A742 T743 F744	A742-R746 VanDerWaalsContact O-CZ 3.27Å; A742-R746 PolarHBondContact O-NE 3.16Å; A742-R746 PolarHBondContact O-NH2 2.95Å; T743-R746 CarbonylContact O-C 3.46Å; T743-R746 WeakPolarHBondContact O-CA 3.34Å; T743-R746 PolarHBondContact O-N 3.42Å; F744-R746 PolarHBondContact O-N 2.67Å; F744-R746 VanDerWaalsContact O-N 3.15Å
747	S	83	Confident	87.8	Confident	65 Å²	65	76.4 Å²	76.4	46%	0.455	40%	0.404	S	S	.	.			trans	-105.5	0	162.4	56.6	0	0	0	0	111.2	S486 G487 S488 T743 F744	S486-S747 WeakPolarHBondContact CB-O 3.38Å; S486-S747 VanDerWaalsContact OG-C 3.31Å; S486-S747 PolarHBondContact OG-O 3.49Å; G487-S747 WeakPolarHBondContact CA-OXT 3.44Å; G487-S747 PolarHBondContact N-OXT 3.39Å; S488-S747 WeakPolarHBondContact CB-OXT 3.32Å; S488-S747 PolarHBondContact N-OXT 2.8Å; S488-S747 PolarHBondContact OG-O 3.35Å; T743-S747 PolarHBondContact O-N 3.08Å; F744-S747 PolarHBondContact O-N 2.9Å; F744-S747 PolarHBondContact O-OG 3.02Å

Retrieved 747 of 747 residues in 1201.4 ms (Link to these results)

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