A0A096N6Q2_PAPAN Loading...

Ras and Rab interactor 1

Ras effector protein, which may serve as an inhibitory modulator of neuronal plasticity in aversive memory formation. Can affect Ras signaling at different levels. First, by competing with RAF1 protein for binding to activated Ras. Second, by enhancing signaling from ABL1 and ABL2, which regulate cytoskeletal remodeling. Third, by activating RAB5A, possibly by functioning as a guanine nucleotide exchange factor (GEF) for RAB5A, by exchanging bound GDP for free GTP, and facilitating Ras-activated receptor endocytosis.

AlphaFold DB , UniProt , Accession A0A096N6Q2, Species PAPAN (Papio anubis, Olive baboon), Gene RIN1, Length 783 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	33.8	Very low	36.5	Very low	222 Å²	222	130.3 Å²	130.3	100%	1.094	83%	0.827	S	S	*	*				0	92.4	0	-64.3	174.1	179.4	0	0	111.4
2	E	33.8	Very low	37.1	Very low	168 Å²	168	130.3 Å²	130.3	79%	0.785	83%	0.829	S	S	*	*			cis	176.3	138.7	-25.1	-109.3	143.5	112.7	0	0	107.2
3	S	32.8	Very low	36.5	Very low	111 Å²	111	126.5 Å²	126.5	78%	0.776	83%	0.83	S	S	*	*			trans	-45.5	-176	160.8	-35.4	0	0	0	0	115.9
4	P	53.7	Low	35.8	Very low	136 Å²	136	123.9 Å²	123.9	88%	0.883	82%	0.824	S	S	*	*			cis	-111.1	-151.9	-16.1	37.4	-19.9	0	0	0	110
5	G	31.5	Very low	35.9	Very low	59 Å²	59	124.3 Å²	124.3	61%	0.608	83%	0.825	S	S	*	*			cis	-162.6	-176.1	-0.6	0	0	0	0	0	107.7
6	E	33.7	Very low	35.4	Very low	200 Å²	200	123.1 Å²	123.1	94%	0.935	82%	0.819	S	S	*	*			cis	70.4	136.9	17.2	-56.3	-155.5	118.7	0	0	115.7
7	S	34.8	Very low	36.1	Very low	116 Å²	116	122.1 Å²	122.1	81%	0.811	81%	0.812	S	S	*	*			cis	-161.4	161.1	28.3	60	0	0	0	0	115.9
8	G	31.6	Very low	35.6	Very low	73 Å²	73	122.4 Å²	122.4	75%	0.753	81%	0.81	S	S	*	*			trans	84.5	156.8	154.1	0	0	0	0	0	117
9	T	31.6	Very low	35.1	Very low	154 Å²	154	120.5 Å²	120.5	95%	0.945	80%	0.799	S	S	*	*			cis	-156.8	163	-10.3	40.7	0	0	0	0	106.5
10	G	27.8	Very low	34.6	Very low	66 Å²	66	124.2 Å²	124.2	68%	0.68	80%	0.802	S	S	*	*			cis	174	151.3	-0.8	0	0	0	0	0	107.8
11	P	56.1	Low	34.1	Very low	128 Å²	128	124.1 Å²	124.1	83%	0.831	80%	0.799	S	S	*	*			trans	-99.2	-164.5	-168.9	44.9	-39.6	0	0	0	111.7
12	P	44.1	Very low	34.6	Very low	131 Å²	131	119.6 Å²	119.6	85%	0.851	79%	0.786	S	S	*	*				-143.5	178.4	63.9	38.6	-18.6	0	0	0	115.2
13	G	28.6	Very low	34.2	Very low	81 Å²	81	115 Å²	115	84%	0.835	78%	0.784	S	S	*	*			trans	162.4	44.3	171.5	0	0	0	0	0	118
14	A	27.6	Very low	34	Very low	90 Å²	90	118.3 Å²	118.3	74%	0.744	79%	0.787	S	S	*	*			trans	-88.1	171.1	174.4	0	0	0	0	0	111.7
15	P	37.7	Very low	32.9	Very low	130 Å²	130	117.8 Å²	117.8	84%	0.844	78%	0.776	S	S	*	*				-139.4	157.4	74.6	35.9	-19.2	0	0	0	116.9
16	S	27.1	Very low	32.7	Very low	105 Å²	105	123 Å²	123	73%	0.734	79%	0.785	S	S	*	*			trans	-82.5	-148.4	166.6	-30.7	0	0	0	0	109.5
17	P	46.8	Very low	32.5	Very low	106 Å²	106	119.2 Å²	119.2	69%	0.688	78%	0.775	S	S	*	*			cis	-126.5	179.1	-11.2	24.2	2.2	0	0	0	112.9
18	T	27.3	Very low	32	Very low	127 Å²	127	121.8 Å²	121.8	78%	0.779	78%	0.775	S	S	*	*				172.2	160.2	80.7	34.9	0	0	0	0	111.3
19	S	26.7	Very low	31.7	Very low	87 Å²	87	127.2 Å²	127.2	61%	0.608	78%	0.777	S	S	*	*			cis	-170.4	158.6	-33.6	52.8	0	0	0	0	112.3
20	F	24.6	Very low	32.5	Very low	194 Å²	194	125.2 Å²	125.2	85%	0.851	77%	0.767	S	S	*	*			trans	71.8	163.3	157.6	-69.7	-62.2	0	0	0	122.6
21	T	23.4	Very low	32.6	Very low	122 Å²	122	126.5 Å²	126.5	75%	0.748	77%	0.771	S	S	*	*			trans	-144.1	-150.2	-156.3	55.6	0	0	0	0	107.1
22	P	46.3	Very low	31.3	Very low	127 Å²	127	129.1 Å²	129.1	83%	0.825	77%	0.772	S	S	*	*			cis	-133.3	-178.5	-17.3	37.3	-17.9	0	0	0	115.1
23	G	25.4	Very low	30.6	Very low	71 Å²	71	130.4 Å²	130.4	73%	0.732	77%	0.772	S	S	*	*			trans	171.6	90	165.7	0	0	0	0	0	118.3
24	H	28.1	Very low	31.4	Very low	182 Å²	182	131.5 Å²	131.5	84%	0.843	77%	0.765	S	S	*	*				35.3	141.3	124.5	-144.5	-83.5	0	0	0	121.4
25	L	30.1	Very low	31.4	Very low	125 Å²	125	135.3 Å²	135.3	65%	0.654	77%	0.771	S	S	*	*			cis	-174.7	161.5	-27.4	-138.6	158.8	0	0	0	107.6
26	E	28.1	Very low	31.1	Very low	169 Å²	169	139.2 Å²	139.2	79%	0.79	77%	0.771	S	S	*	*			trans	73.1	160.5	166.2	-52.9	-165.9	142.4	0	0	120.4
27	T	28	Very low	31.2	Very low	120 Å²	120	141.7 Å²	141.7	74%	0.736	78%	0.776	S	S	*	*			cis	-166.9	165.4	-38.5	-77.5	0	0	0	0	109.3
28	E	25.5	Very low	30.9	Very low	170 Å²	170	142.4 Å²	142.4	79%	0.794	78%	0.778	S	S	*	*			trans	94.8	100.9	167.1	-58.9	-141.6	99.9	0	0	122.9
29	K	25.2	Very low	31.4	Very low	187 Å²	187	142.4 Å²	142.4	81%	0.813	78%	0.78	S	S	*	*				37.6	157.3	108.7	-90	-172.5	172.1	179.2	0	122.6
30	P	47.8	Very low	31.5	Very low	111 Å²	111	145.8 Å²	145.8	72%	0.721	79%	0.791	S	S	*	*				-146.5	179.9	-54.1	39.8	-18.6	0	0	0	116.5
31	A	29.9	Very low	32.1	Very low	93 Å²	93	141.2 Å²	141.2	77%	0.769	79%	0.789	S	S	*	*			trans	87.9	151.9	142.1	0	0	0	0	0	124.4
32	Q	29.5	Very low	32.6	Very low	183 Å²	183	141.1 Å²	141.1	86%	0.855	79%	0.794	S	S	*	*			trans	80.8	97.4	159	-71.2	179.4	3.6	0	0	122.9
33	D	28.5	Very low	32.2	Very low	158 Å²	158	139.1 Å²	139.1	85%	0.845	80%	0.796	S	S	*	*				67.9	156.5	121.5	-87.2	34.4	0	0	0	124.2
34	P	46.7	Very low	32.4	Very low	105 Å²	105	139.4 Å²	139.4	68%	0.682	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-101.9	156	-153.2	38.8	-36.1	0	0	0	115.8
35	L	26.9	Very low	33	Very low	169 Å²	169	140.6 Å²	140.6	89%	0.885	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-100.7	136	166.5	-151.3	77.9	0	0	0	110.7
36	Y	30.3	Very low	33.2	Very low	212 Å²	212	139.6 Å²	139.6	83%	0.831	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-81.9	140.1	169.2	-83.4	-102.4	0	0	0	110.4
37	D	29.9	Very low	33.8	Very low	157 Å²	157	135.9 Å²	135.9	84%	0.84	82%	0.822	S	S	*	*			trans	-122.1	131.1	169.8	-128	-28.7	0	0	0	110.4
38	V	40.6	Very low	33.9	Very low	122 Å²	122	133 Å²	133	74%	0.739	82%	0.816	S	S	*	*			trans	-132.8	106	-175.8	-179.1	0	0	0	0	109.9
39	P	37.8	Very low	34.5	Very low	126 Å²	126	131.4 Å²	131.4	82%	0.818	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-85.2	123.2	173.5	30.5	-29.2	0	0	0	111.2
40	N	29.8	Very low	35.2	Very low	159 Å²	159	131.3 Å²	131.3	85%	0.85	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-93.6	169.9	174.4	-158	-1.9	0	0	0	111.4	S42	N40-S42 PolarHBondContact O-N 3.43Å
41	A	36.9	Very low	34.9	Very low	97 Å²	97	136.9 Å²	136.9	80%	0.802	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-76	117.9	-167	0	0	0	0	0	115.1
42	S	33.9	Very low	35.3	Very low	121 Å²	121	138.7 Å²	138.7	85%	0.846	83%	0.833	S	S	*	*			trans	-157.7	154.4	150.7	62	0	0	0	0	109.6	N40	N40-S42 PolarHBondContact O-N 3.43Å
43	G	37.2	Very low	36.4	Very low	84 Å²	84	133.1 Å²	133.1	87%	0.866	83%	0.826	S	S	*	*			trans	-101.1	150.9	-166.5	0	0	0	0	0	115.8
44	G	29.1	Very low	37.9	Very low	78 Å²	78	134.8 Å²	134.8	80%	0.804	82%	0.82	S	S	*	*			trans	-172	133.5	169	0	0	0	0	0	110.8
45	Q	42.3	Very low	39.1	Very low	206 Å²	206	135.9 Å²	135.9	96%	0.963	82%	0.824	S	S	*	*			trans	-86.5	130.3	178.7	-76.2	-178	-28.8	0	0	111.5
46	A	33.8	Very low	41.8	Very low	104 Å²	104	128.5 Å²	128.5	86%	0.86	79%	0.786	S	S	*	*			trans	-134.7	115.7	158.5	0	0	0	0	0	108.1
47	G	39.6	Very low	44.5	Very low	92 Å²	92	120.8 Å²	120.8	95%	0.948	76%	0.764	S	S	*	*			trans	-89.2	129.4	-171	0	0	0	0	0	113.4
48	G	30.4	Very low	47.3	Very low	59 Å²	59	115.5 Å²	115.5	61%	0.608	74%	0.735	S	S	*	*			trans	-138.5	135.8	164.6	0	0	0	0	0	109.9	Q50	G48-Q50 PolarHBondContact O-N 3.39Å
49	P	37.8	Very low	49.7	Very low	137 Å²	137	114.4 Å²	114.4	89%	0.89	72%	0.718	S	S	*	*			trans	-72.8	94.3	-176.8	28.8	-34.1	0	0	0	111.3	R51	P49-R51 PolarHBondContact O-N 3.05Å
50	Q	41.2	Very low	52.1	Low	184 Å²	184	110.6 Å²	110.6	86%	0.86	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-53.7	124.4	165	-75.7	-90	-2.5	0	0	109.2	G48	G48-Q50 PolarHBondContact O-N 3.39Å
51	R	40.2	Very low	55.1	Low	228 Å²	228	104.1 Å²	104.1	86%	0.86	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-60.8	137.8	172.4	-69.8	177.9	175	170.9	-2.3	108.9	P49 G53	P49-R51 PolarHBondContact O-N 3.05Å; R51-G53 PolarHBondContact O-N 3.08Å; R51-G53 VanDerWaalsContact O-N 3.09Å
52	P	39.2	Very low	57.8	Low	131 Å²	131	99.5 Å²	99.5	85%	0.851	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-60.8	117.6	179.2	24.5	-33.3	0	0	0	110.2
53	G	51.3	Low	60.6	Low	67 Å²	67	97.2 Å²	97.2	69%	0.691	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-65.7	136.4	-177.6	0	0	0	0	0	112.2	R51 V55	R51-G53 PolarHBondContact O-N 3.08Å; R51-G53 VanDerWaalsContact O-N 3.09Å; G53-V55 PolarHBondContact O-N 2.85Å
54	R	61.6	Low	63.2	Low	192 Å²	192	95 Å²	95	73%	0.725	56%	0.561	S	S	*	*			trans	-61.4	115.9	173.9	178.1	173.8	171.1	-84.2	-0.8	109.5	V56 E60	R54-V56 PolarHBondContact O-N 2.97Å; R54-E60 IonicContact CZ-OE1 3.2Å; R54-E60 IonicContact NH1-OE1 2.71Å; R54-E60 PolarHBondContact NH1-OE1 3.15Å; R54-E60 IonicContact NH1-OE2 3.85Å; R54-E60 IonicContact NH2-OE1 2.75Å; R54-E60 PolarHBondContact NH2-OE1 3.19Å; R54-E60 IonicContact NH2-OE2 3.65Å
55	V	70.4	Confident	66.2	Low	128 Å²	128	91.3 Å²	91.3	78%	0.776	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-60.7	122.2	-178	-178.2	0	0	0	0	110.3	G53 S57	G53-V55 PolarHBondContact O-N 2.85Å; V55-S57 PolarHBondContact O-N 3.04Å
56	V	83.9	Confident	68.7	Low	14 Å²	14	87 Å²	87	9%	0.085	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-72.6	121.2	-177.9	-166.8	0	0	0	0	110.7	R54 E60 R61 L174	R54-V56 PolarHBondContact O-N 2.97Å; V56-E60 HydrophobicContact CG1-CB 3.58Å; V56-R61 HydrophobicContact CG1-CG 4.12Å; V56-R61 PolarHBondContact O-NE 3.41Å; V56-R61 PolarHBondContact O-NH2 3.42Å; V56-L174 HydrophobicContact CB-CD1 4.22Å; V56-L174 HydrophobicContact CG1-CD1 3.7Å; V56-L174 HydrophobicContact CG2-CD1 4.38Å
57	S	88.6	Confident	71.5	Confident	51 Å²	51	85.1 Å²	85.1	36%	0.357	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-73.2	166.1	-176.8	69.2	0	0	0	0	113.4	V55 R59 E60 R61	V55-S57 PolarHBondContact O-N 3.04Å; S57-R59 VanDerWaalsContact C-N 3.32Å; S57-R59 PolarHBondContact O-N 2.88Å; S57-E60 VanDerWaalsContact CB-OE2 3.25Å; S57-E60 WeakPolarHBondContact CB-OE2 3.14Å; S57-E60 PolarHBondContact N-OE2 3.35Å; S57-E60 PolarHBondContact O-N 3.21Å; S57-E60 WeakPolarHBondContact OG-CG 3.42Å; S57-E60 PolarHBondContact OG-N 3.49Å; S57-E60 PolarHBondContact OG-OE2 3.28Å; S57-R61 VanDerWaalsContact O-CG 3.31Å; S57-R61 WeakPolarHBondContact O-CG 3.27Å; S57-R61 PolarHBondContact O-N 3.07Å
58	L	87.9	Confident	74	Confident	46 Å²	46	80.7 Å²	80.7	24%	0.241	43%	0.431	C	S	.	.	H	α-helix	trans	-58.7	-41.5	176.7	-175.5	68.7	0	0	0	112.5	R61 L62 C149 H150 L161	L58-R61 PolarHBondContact O-N 2.78Å; L58-L62 HydrophobicContact CD1-CD1 4.47Å; L58-L62 HydrophobicContact CG-CD1 4.04Å; L58-L62 WeakPolarHBondContact O-CG 3.37Å; L58-L62 PolarHBondContact O-N 2.86Å; L58-C149 HydrophobicContact CD2-CB 3.75Å; L58-H150 VanDerWaalsContact CD2-CE1 3.46Å; L58-H150 WeakPolarHBondContact CD2-CE1 3.29Å; L58-L161 HydrophobicContact CD1-CD1 3.49Å; L58-L161 VanDerWaalsContact CD1-CD1 3.49Å; L58-L161 HydrophobicContact CD1-CG 4.4Å
59	R	90.4	Very high	77	Confident	98 Å²	98	78 Å²	78	37%	0.37	40%	0.402	S	S	.	.	H	α-helix	trans	-65.8	-41.3	179.9	-169.6	175.1	-172.1	-92.9	-2.7	111.6	S57 L62 L63 D140 V142	S57-R59 VanDerWaalsContact C-N 3.32Å; S57-R59 PolarHBondContact O-N 2.88Å; R59-L62 PolarHBondContact O-N 3.5Å; R59-L63 HydrophobicContact CG-CD1 4.18Å; R59-L63 WeakPolarHBondContact O-CB 3.48Å; R59-L63 VanDerWaalsContact O-CG 3.28Å; R59-L63 WeakPolarHBondContact O-CG 3.44Å; R59-L63 PolarHBondContact O-N 2.76Å; R59-D140 IonicContact NH2-OD2 3.51Å; R59-D140 PolarHBondContact NH2-OD2 2.7Å; R59-V142 HydrophobicContact CG-CG1 4.06Å
60	E	88.9	Confident	79.7	Confident	46 Å²	46	72.6 Å²	72.6	22%	0.215	37%	0.366	C	S	.	.	H	α-helix	trans	-66.2	-41.8	176	-70.1	159.5	146.2	0	0	111.4	R54 V56 S57 L62 L63 L64	R54-E60 IonicContact CZ-OE1 3.2Å; R54-E60 IonicContact NH1-OE1 2.71Å; R54-E60 PolarHBondContact NH1-OE1 3.15Å; R54-E60 IonicContact NH1-OE2 3.85Å; R54-E60 IonicContact NH2-OE1 2.75Å; R54-E60 PolarHBondContact NH2-OE1 3.19Å; R54-E60 IonicContact NH2-OE2 3.65Å; V56-E60 HydrophobicContact CG1-CB 3.58Å; S57-E60 VanDerWaalsContact CB-OE2 3.25Å; S57-E60 WeakPolarHBondContact CB-OE2 3.14Å; S57-E60 PolarHBondContact N-OE2 3.35Å; S57-E60 PolarHBondContact O-N 3.21Å; S57-E60 WeakPolarHBondContact OG-CG 3.42Å; S57-E60 PolarHBondContact OG-N 3.49Å; S57-E60 PolarHBondContact OG-OE2 3.28Å; E60-L62 PolarHBondContact O-N 3.09Å; E60-L63 PolarHBondContact O-N 3.41Å; E60-L64 WeakPolarHBondContact O-CB 3.34Å; E60-L64 VanDerWaalsContact O-CG 3.27Å; E60-L64 WeakPolarHBondContact O-CG 3.22Å; E60-L64 PolarHBondContact O-N 2.86Å
61	R	93.3	Very high	82.1	Confident	24 Å²	24	64.9 Å²	64.9	9%	0.091	33%	0.33	C	S	.	.	H	α-helix	trans	-57.4	-49.8	173	-70.3	165.6	-170.3	-76.5	-8.5	111.7	V56 S57 L58 L63 L64 T65 L161 I165 H166 A168 L174	V56-R61 HydrophobicContact CG1-CG 4.12Å; V56-R61 PolarHBondContact O-NE 3.41Å; V56-R61 PolarHBondContact O-NH2 3.42Å; S57-R61 VanDerWaalsContact O-CG 3.31Å; S57-R61 WeakPolarHBondContact O-CG 3.27Å; S57-R61 PolarHBondContact O-N 3.07Å; L58-R61 PolarHBondContact O-N 2.78Å; R61-L63 PolarHBondContact O-N 2.7Å; R61-L64 PolarHBondContact O-N 3.09Å; R61-T65 PolarHBondContact O-N 2.94Å; R61-T65 PolarHBondContact O-OG1 3.5Å; R61-L161 HydrophobicContact CB-CD1 4.22Å; R61-I165 HydrophobicContact CB-CG2 4.35Å; R61-I165 PolarHBondContact NH1-O 3.49Å; R61-H166 PolarHBondContact NH1-O 3.13Å; R61-A168 VanDerWaalsContact CZ-O 3.26Å; R61-A168 PolarHBondContact NH1-O 2.93Å; R61-A168 PolarHBondContact NH2-O 3.1Å; R61-L174 HydrophobicContact CB-CD2 4.47Å; R61-L174 HydrophobicContact CG-CD1 3.81Å; R61-L174 HydrophobicContact CG-CD2 4.12Å
62	L	92.3	Very high	84.4	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.7	-42.6	178.7	-79.1	162.2	0	0	0	112.5	L58 R59 E60 R66 W69 F91 V142 I145 C146 L161	L58-L62 HydrophobicContact CD1-CD1 4.47Å; L58-L62 HydrophobicContact CG-CD1 4.04Å; L58-L62 WeakPolarHBondContact O-CG 3.37Å; L58-L62 PolarHBondContact O-N 2.86Å; R59-L62 PolarHBondContact O-N 3.5Å; E60-L62 PolarHBondContact O-N 3.09Å; L62-R66 PolarHBondContact O-N 2.92Å; L62-W69 HydrophobicContact CB-CZ2 4.43Å; L62-W69 HydrophobicContact CD2-CD2 4.46Å; L62-W69 HydrophobicContact CD2-CZ2 4.28Å; L62-W69 WeakPolarHBondContact O-CZ2 3.35Å; L62-W69 PolarHBondContact O-NE1 3.06Å; L62-F91 HydrophobicContact CD2-CZ 4.11Å; L62-V142 HydrophobicContact CB-CG1 3.78Å; L62-V142 HydrophobicContact CD1-CG1 4.36Å; L62-I145 HydrophobicContact CD1-CB 4.46Å; L62-I145 HydrophobicContact CD1-CG2 3.86Å; L62-I145 HydrophobicContact CD2-CG2 3.54Å; L62-I145 HydrophobicContact CG-CG2 4.38Å; L62-C146 VanDerWaalsContact CD1-SG 3.5Å; L62-L161 HydrophobicContact CD2-CD2 3.76Å; L62-L161 HydrophobicContact CD2-CG 4.5Å; L62-L161 HydrophobicContact CG-CD1 4.41Å; L62-L161 HydrophobicContact CG-CD2 4.42Å
63	L	92.5	Very high	86.7	Confident	73 Å²	73	61.2 Å²	61.2	38%	0.382	31%	0.313	S	S	.	.	H	α-helix	trans	-62.2	-49.6	176.3	-75.4	166	0	0	0	111.8	R59 E60 R61 R66 V142	R59-L63 HydrophobicContact CG-CD1 4.18Å; R59-L63 WeakPolarHBondContact O-CB 3.48Å; R59-L63 VanDerWaalsContact O-CG 3.28Å; R59-L63 WeakPolarHBondContact O-CG 3.44Å; R59-L63 PolarHBondContact O-N 2.76Å; E60-L63 PolarHBondContact O-N 3.41Å; R61-L63 PolarHBondContact O-N 2.7Å; L63-R66 VanDerWaalsContact O-CB 3.31Å; L63-R66 WeakPolarHBondContact O-CB 3.29Å; L63-R66 PolarHBondContact O-N 2.76Å; L63-V142 HydrophobicContact CD2-CG1 4.49Å; L63-V142 HydrophobicContact CD2-CG2 4.07Å; L63-V142 HydrophobicContact CG-CG1 4.3Å
64	L	92.3	Very high	88.3	Confident	38 Å²	38	58.8 Å²	58.8	20%	0.199	29%	0.287	C	S	.	.	H	α-helix	trans	-66.9	-43.6	-176.5	-69	168.2	0	0	0	112	E60 R61 R66 H171 L174 S178	E60-L64 WeakPolarHBondContact O-CB 3.34Å; E60-L64 VanDerWaalsContact O-CG 3.27Å; E60-L64 WeakPolarHBondContact O-CG 3.22Å; E60-L64 PolarHBondContact O-N 2.86Å; R61-L64 PolarHBondContact O-N 3.09Å; L64-R66 VanDerWaalsContact C-N 3.28Å; L64-R66 PolarHBondContact O-N 2.92Å; L64-H171 WeakPolarHBondContact CD2-NE2 3.4Å; L64-L174 HydrophobicContact CB-CB 4.12Å; L64-L174 HydrophobicContact CD1-CB 4.02Å; L64-L174 HydrophobicContact CD1-CD1 3.98Å; L64-S178 WeakPolarHBondContact O-CB 3.35Å; L64-S178 PolarHBondContact O-OG 3.46Å
65	T	93.4	Very high	89.4	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	21.8	-179.3	70.1	0	0	0	0	113.3	R61 P67 V68 W69 I165 L174 I177	R61-T65 PolarHBondContact O-N 2.94Å; R61-T65 PolarHBondContact O-OG1 3.5Å; T65-P67 VanDerWaalsContact C-CD 3.43Å; T65-P67 VanDerWaalsContact C-N 3.33Å; T65-V68 WeakPolarHBondContact O-CB 3.39Å; T65-V68 PolarHBondContact O-N 2.87Å; T65-W69 PolarHBondContact O-NE1 3.2Å; T65-I165 HydrophobicContact CG2-CD1 4.21Å; T65-I165 HydrophobicContact CG2-CG1 4.07Å; T65-I165 HydrophobicContact CG2-CG2 3.84Å; T65-L174 HydrophobicContact CG2-CB 4.3Å; T65-L174 HydrophobicContact CG2-CD2 3.79Å; T65-I177 HydrophobicContact CG2-CG2 4.1Å
66	R	93.8	Very high	90	Very high	115 Å²	115	49.7 Å²	49.7	43%	0.434	25%	0.254	S	S	.	.	H	α-helix	trans	-51.9	-41	176.4	-174.6	173.5	-178.7	167.6	1.5	113.6	L62 L63 L64 V68 W69 L70	L62-R66 PolarHBondContact O-N 2.92Å; L63-R66 VanDerWaalsContact O-CB 3.31Å; L63-R66 WeakPolarHBondContact O-CB 3.29Å; L63-R66 PolarHBondContact O-N 2.76Å; L64-R66 VanDerWaalsContact C-N 3.28Å; L64-R66 PolarHBondContact O-N 2.92Å; R66-V68 PolarHBondContact O-N 2.7Å; R66-V68 VanDerWaalsContact O-N 3.09Å; R66-W69 HydrophobicContact CB-CZ2 4.04Å; R66-W69 HydrophobicContact CG-CH2 4.14Å; R66-W69 HydrophobicContact CG-CZ2 3.88Å; R66-W69 PolarHBondContact O-N 3.19Å; R66-L70 HydrophobicContact CG-CB 4Å; R66-L70 HydrophobicContact CG-CD2 3.9Å; R66-L70 VanDerWaalsContact O-CB 3.23Å; R66-L70 WeakPolarHBondContact O-CB 3.35Å; R66-L70 PolarHBondContact O-N 3.42Å
67	P	92.9	Very high	90	Very high	64 Å²	64	52.2 Å²	52.2	42%	0.416	28%	0.276	S	S	.	.	H	α-helix	trans	-62.8	-12	174.8	-24.4	36.5	0	0	0	115.6	T65 Q71 S178 G181	T65-P67 VanDerWaalsContact C-CD 3.43Å; T65-P67 VanDerWaalsContact C-N 3.33Å; P67-Q71 PolarHBondContact O-NE2 3.01Å; P67-S178 VanDerWaalsContact CD-OG 3.3Å; P67-S178 WeakPolarHBondContact CD-OG 3.42Å; P67-S178 WeakPolarHBondContact CG-OG 3.46Å; P67-G181 CarbonylContact O-C 3.47Å; P67-G181 WeakPolarHBondContact O-CA 3.4Å
68	V	92.7	Very high	89.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-91.3	-46	179.2	178.9	0	0	0	0	111.9	T65 R66 Q71 I165 I177 G181 F184 W185	T65-V68 WeakPolarHBondContact O-CB 3.39Å; T65-V68 PolarHBondContact O-N 2.87Å; R66-V68 PolarHBondContact O-N 2.7Å; R66-V68 VanDerWaalsContact O-N 3.09Å; V68-Q71 PolarHBondContact O-NE2 3.25Å; V68-I165 HydrophobicContact CB-CD1 4.34Å; V68-I165 HydrophobicContact CG1-CD1 3.98Å; V68-I177 HydrophobicContact CG2-CG2 4.12Å; V68-I177 WeakPolarHBondContact CG2-O 3.22Å; V68-G181 WeakPolarHBondContact CA-O 3.33Å; V68-F184 HydrophobicContact CB-CB 4.46Å; V68-F184 HydrophobicContact CG1-CB 3.67Å; V68-F184 HydrophobicContact CG1-CD1 3.29Å; V68-F184 HydrophobicContact CG1-CE1 4.11Å; V68-F184 HydrophobicContact CG1-CG 3.54Å; V68-F184 HydrophobicContact CG2-CB 4Å; V68-F184 HydrophobicContact CG2-CG 4.29Å; V68-W185 HydrophobicContact CG1-CZ2 4.21Å; V68-W185 PolarHBondContact O-NE1 3.1Å
69	W	92.8	Very high	89.8	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.008	26%	0.263	C	S	.	.	H	α-helix	trans	-96	-18.9	-176.8	60.5	-100.2	0	0	0	114.1	L62 T65 R66 Q71 F91 L92 V93 L141 V142 I145	L62-W69 HydrophobicContact CB-CZ2 4.43Å; L62-W69 HydrophobicContact CD2-CD2 4.46Å; L62-W69 HydrophobicContact CD2-CZ2 4.28Å; L62-W69 WeakPolarHBondContact O-CZ2 3.35Å; L62-W69 PolarHBondContact O-NE1 3.06Å; T65-W69 PolarHBondContact O-NE1 3.2Å; R66-W69 HydrophobicContact CB-CZ2 4.04Å; R66-W69 HydrophobicContact CG-CH2 4.14Å; R66-W69 HydrophobicContact CG-CZ2 3.88Å; R66-W69 PolarHBondContact O-N 3.19Å; W69-Q71 PolarHBondContact O-N 3.5Å; W69-F91 HydrophobicContact CB-CE2 4.16Å; W69-F91 HydrophobicContact CD2-CE2 4.42Å; W69-F91 HydrophobicContact CE3-CE2 4.37Å; W69-F91 HydrophobicContact CG-CE2 4.35Å; W69-L92 CarbonylContact O-C 3.58Å; W69-L92 WeakPolarHBondContact O-CA 3.23Å; W69-V93 HydrophobicContact CE3-CG2 4.37Å; W69-V93 HydrophobicContact CZ3-CG2 4.42Å; W69-V93 PolarHBondContact O-N 3.44Å; W69-L141 HydrophobicContact CZ3-CD2 4.14Å; W69-L141 HydrophobicContact CZ3-CG 4.4Å; W69-V142 HydrophobicContact CH2-CG2 4.09Å; W69-V142 HydrophobicContact CZ2-CG2 4.14Å; W69-I145 HydrophobicContact CD2-CD1 4.49Å; W69-I145 HydrophobicContact CE3-CD1 3.7Å; W69-I145 HydrophobicContact CH2-CD1 3.69Å; W69-I145 HydrophobicContact CZ2-CD1 4.46Å; W69-I145 HydrophobicContact CZ3-CD1 3.24Å
70	L	93.8	Very high	89.5	Confident	23 Å²	23	47.8 Å²	47.8	12%	0.12	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-98.3	75.9	177.9	-172.1	59.5	0	0	0	111.4	R66 L72 V93 L141	R66-L70 HydrophobicContact CG-CB 4Å; R66-L70 HydrophobicContact CG-CD2 3.9Å; R66-L70 VanDerWaalsContact O-CB 3.23Å; R66-L70 WeakPolarHBondContact O-CB 3.35Å; R66-L70 PolarHBondContact O-N 3.42Å; L70-L72 HydrophobicContact CD1-CD2 3.79Å; L70-L72 HydrophobicContact CD1-CG 4.1Å; L70-L72 HydrophobicContact CG-CD2 4.31Å; L70-L72 HydrophobicContact CG-CG 4.05Å; L70-L72 PolarHBondContact O-N 3.14Å; L70-V93 CarbonylContact C-O 3.5Å; L70-V93 HydrophobicContact CD1-CB 3.74Å; L70-V93 HydrophobicContact CD1-CG1 3.66Å; L70-L141 HydrophobicContact CD1-CD2 3.99Å
71	Q	92.5	Very high	89.2	Confident	22 Å²	22	52.4 Å²	52.4	10%	0.103	28%	0.282	C	S	.	.			trans	-90.4	66.9	-177.2	-60.6	-59.1	-18.4	0	0	112.2	P67 V68 W69 Q73 A74 V93 R94 I182	P67-Q71 PolarHBondContact O-NE2 3.01Å; V68-Q71 PolarHBondContact O-NE2 3.25Å; W69-Q71 PolarHBondContact O-N 3.5Å; Q71-Q73 PolarHBondContact O-N 3.05Å; Q71-Q73 VanDerWaalsContact O-N 3.11Å; Q71-A74 HydrophobicContact CB-CB 3.72Å; Q71-A74 WeakPolarHBondContact O-CB 3.38Å; Q71-A74 PolarHBondContact O-N 3.21Å; Q71-V93 CarbonylContact C-O 3.54Å; Q71-V93 PolarHBondContact N-O 3.21Å; Q71-R94 WeakPolarHBondContact O-CA 3.26Å; Q71-R94 WeakPolarHBondContact O-CB 3.39Å; Q71-I182 HydrophobicContact CG-CD1 3.78Å
72	L	89.1	Confident	89	Confident	86 Å²	86	52.3 Å²	52.3	45%	0.45	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.3	-177.5	-65.8	-179.6	0	0	0	114.3	L70 K95 Q102	L70-L72 HydrophobicContact CD1-CD2 3.79Å; L70-L72 HydrophobicContact CD1-CG 4.1Å; L70-L72 HydrophobicContact CG-CD2 4.31Å; L70-L72 HydrophobicContact CG-CG 4.05Å; L70-L72 PolarHBondContact O-N 3.14Å; L72-K95 WeakPolarHBondContact O-CB 3.26Å; L72-Q102 HydrophobicContact CD2-CG 4.15Å
73	Q	85.7	Confident	88.7	Confident	196 Å²	196	52.3 Å²	52.3	92%	0.916	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-13.2	176.3	-64.6	179.5	-5.9	0	0	113.7	Q71	Q71-Q73 PolarHBondContact O-N 3.05Å; Q71-Q73 VanDerWaalsContact O-N 3.11Å
74	A	86.1	Confident	88.2	Confident	16 Å²	16	56.9 Å²	56.9	13%	0.132	30%	0.296	C	S	.	.			trans	-75.5	129.2	-178.4	0	0	0	0	0	111.8	Q71 A78 R94	Q71-A74 HydrophobicContact CB-CB 3.72Å; Q71-A74 WeakPolarHBondContact O-CB 3.38Å; Q71-A74 PolarHBondContact O-N 3.21Å; A74-A78 HydrophobicContact CB-CB 4.25Å; A74-R94 WeakPolarHBondContact O-CB 3.44Å; A74-R94 WeakPolarHBondContact O-CD 3.22Å
75	N	85.3	Confident	87.5	Confident	91 Å²	91	59.8 Å²	59.8	49%	0.487	32%	0.316	S	S	.	.			trans	-79	174.5	171.3	71	38.6	0	0	0	111.5	A77 A78 A79	N75-A77 VanDerWaalsContact C-N 3.31Å; N75-A77 PolarHBondContact O-N 2.99Å; N75-A77 WeakPolarHBondContact OD1-CA 3.42Å; N75-A77 WeakPolarHBondContact OD1-CB 3.27Å; N75-A77 PolarHBondContact OD1-N 2.91Å; N75-A78 PolarHBondContact O-N 3.32Å; N75-A78 PolarHBondContact OD1-N 3.17Å; N75-A79 PolarHBondContact O-N 3.2Å
76	A	83.1	Confident	87	Confident	39 Å²	39	60.1 Å²	60.1	32%	0.322	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-33.7	-178.3	0	0	0	0	0	113.8	A79 L80	A76-A79 PolarHBondContact O-N 3.49Å; A76-L80 WeakPolarHBondContact O-CG 3.4Å; A76-L80 PolarHBondContact O-N 2.9Å
77	A	83.6	Confident	86.4	Confident	66 Å²	66	56.6 Å²	56.6	55%	0.545	31%	0.309	S	S	.	.	H	α-helix	trans	-72.2	-39.5	178.3	0	0	0	0	0	112	N75 A79 L80 H81	N75-A77 VanDerWaalsContact C-N 3.31Å; N75-A77 PolarHBondContact O-N 2.99Å; N75-A77 WeakPolarHBondContact OD1-CA 3.42Å; N75-A77 WeakPolarHBondContact OD1-CB 3.27Å; N75-A77 PolarHBondContact OD1-N 2.91Å; A77-A79 VanDerWaalsContact C-N 3.34Å; A77-L80 PolarHBondContact O-N 3.24Å; A77-H81 WeakPolarHBondContact O-CB 3.38Å; A77-H81 PolarHBondContact O-N 2.81Å
78	A	85.1	Confident	86	Confident	39 Å²	39	56.1 Å²	56.1	32%	0.322	31%	0.306	S	S	.	.	H	α-helix	trans	-62	-41.9	172.1	0	0	0	0	0	111.4	A74 N75 H81 V82	A74-A78 HydrophobicContact CB-CB 4.25Å; N75-A78 PolarHBondContact O-N 3.32Å; N75-A78 PolarHBondContact OD1-N 3.17Å; A78-H81 PolarHBondContact O-N 3.31Å; A78-V82 WeakPolarHBondContact O-CG2 3.26Å; A78-V82 PolarHBondContact O-N 3.46Å
79	A	85.8	Confident	85.6	Confident	2 Å²	2	56.1 Å²	56.1	2%	0.017	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-42.8	175.1	0	0	0	0	0	112.7	N75 A76 A77 L83 L92 C105	N75-A79 PolarHBondContact O-N 3.2Å; A76-A79 PolarHBondContact O-N 3.49Å; A77-A79 VanDerWaalsContact C-N 3.34Å; A79-L83 WeakPolarHBondContact O-CB 3.49Å; A79-L83 WeakPolarHBondContact O-CG 3.31Å; A79-L83 PolarHBondContact O-N 2.85Å; A79-L92 HydrophobicContact CB-CD1 3.9Å; A79-L92 HydrophobicContact CB-CD2 4.33Å; A79-C105 HydrophobicContact CB-CB 4.4Å
80	L	84.1	Confident	85.5	Confident	62 Å²	62	56.1 Å²	56.1	33%	0.325	31%	0.307	S	S	.	.	H	α-helix	trans	-61	-44.7	172.7	-79.8	161.1	0	0	0	111.9	A76 A77 R84 F116 V117	A76-L80 WeakPolarHBondContact O-CG 3.4Å; A76-L80 PolarHBondContact O-N 2.9Å; A77-L80 PolarHBondContact O-N 3.24Å; L80-R84 WeakPolarHBondContact O-CB 3.5Å; L80-R84 PolarHBondContact O-N 3.32Å; L80-F116 HydrophobicContact CB-CZ 4.31Å; L80-F116 HydrophobicContact CD2-CE1 4.15Å; L80-F116 HydrophobicContact CD2-CE2 4Å; L80-F116 HydrophobicContact CD2-CZ 3.71Å; L80-F116 WeakPolarHBondContact O-CE2 3.18Å; L80-V117 HydrophobicContact CD2-CB 3.77Å; L80-V117 HydrophobicContact CD2-CG2 3.87Å
81	H	84	Confident	85.5	Confident	143 Å²	143	55.1 Å²	55.1	66%	0.662	30%	0.301	S	S	*	.	H	α-helix	trans	-63	-49	-180	-172.9	-83.9	0	0	0	112	A77 A78 R84	A77-H81 WeakPolarHBondContact O-CB 3.38Å; A77-H81 PolarHBondContact O-N 2.81Å; A78-H81 PolarHBondContact O-N 3.31Å; H81-R84 PolarHBondContact O-N 3.21Å
82	V	87.9	Confident	85.6	Confident	21 Å²	21	54.1 Å²	54.1	13%	0.127	30%	0.296	C	S	.	.	H	α-helix	trans	-59.9	-49.5	177.2	167	0	0	0	0	111.3	A78 R84 T85 L92 I182 W185	A78-V82 WeakPolarHBondContact O-CG2 3.26Å; A78-V82 PolarHBondContact O-N 3.46Å; V82-R84 VanDerWaalsContact C-N 3.29Å; V82-R84 PolarHBondContact O-N 2.88Å; V82-T85 PolarHBondContact O-OG1 3.37Å; V82-L92 HydrophobicContact CB-CD2 4.17Å; V82-L92 HydrophobicContact CG1-CD2 3.84Å; V82-I182 HydrophobicContact CG2-CD1 4.49Å; V82-W185 HydrophobicContact CG1-CB 3.93Å; V82-W185 HydrophobicContact CG1-CD2 3.43Å; V82-W185 VanDerWaalsContact CG1-CD2 3.43Å; V82-W185 HydrophobicContact CG1-CE3 3.69Å; V82-W185 HydrophobicContact CG1-CG 3.55Å; V82-W185 HydrophobicContact CG1-CZ3 4.35Å; V82-W185 HydrophobicContact CG2-CB 4.41Å
83	L	87.2	Confident	85.8	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-75.9	-13.4	-175.2	-66.6	175.2	0	0	0	113.8	A79 T85 E86 T90 L92 C105 R107 V117	A79-L83 WeakPolarHBondContact O-CB 3.49Å; A79-L83 WeakPolarHBondContact O-CG 3.31Å; A79-L83 PolarHBondContact O-N 2.85Å; L83-T85 VanDerWaalsContact C-N 3.34Å; L83-T85 PolarHBondContact O-N 2.86Å; L83-E86 PolarHBondContact O-N 2.99Å; L83-T90 HydrophobicContact CD2-CG2 4.28Å; L83-L92 HydrophobicContact CD1-CD2 4.31Å; L83-L92 HydrophobicContact CD1-CG 4.31Å; L83-L92 HydrophobicContact CD2-CD2 4.3Å; L83-L92 HydrophobicContact CG-CD2 4.03Å; L83-L92 HydrophobicContact CG-CG 4.5Å; L83-C105 HydrophobicContact CD1-CB 3.83Å; L83-R107 HydrophobicContact CB-CB 4.31Å; L83-R107 WeakPolarHBondContact O-CD 3.35Å; L83-R107 WeakPolarHBondContact O-CG 3.49Å; L83-R107 PolarHBondContact O-NE 3.24Å; L83-V117 HydrophobicContact CB-CG2 3.73Å; L83-V117 HydrophobicContact CD1-CG1 3.9Å; L83-V117 HydrophobicContact CD1-CG2 4.01Å
84	R	80.8	Confident	86.2	Confident	170 Å²	170	41.2 Å²	41.2	64%	0.642	23%	0.233	S	C	*	.	H	α-helix	trans	-61.1	-41.6	177.6	-172.1	178.8	-178.1	-175.4	1.9	112.3	L80 H81 V82 R107 F116	L80-R84 WeakPolarHBondContact O-CB 3.5Å; L80-R84 PolarHBondContact O-N 3.32Å; H81-R84 PolarHBondContact O-N 3.21Å; V82-R84 VanDerWaalsContact C-N 3.29Å; V82-R84 PolarHBondContact O-N 2.88Å; R84-R107 PolarHBondContact O-NH2 2.82Å; R84-F116 HydrophobicContact CB-CE2 3.7Å; R84-F116 HydrophobicContact CB-CZ 4.1Å; R84-F116 HydrophobicContact CG-CE2 4.05Å; R84-F116 HydrophobicContact CG-CZ 4.19Å
85	T	77.6	Confident	86.4	Confident	98 Å²	98	44.9 Å²	44.9	60%	0.601	25%	0.246	S	C	*	.	S	Bend	trans	-85.1	-8.9	-177.9	45.1	0	0	0	0	114.2	V82 L83	V82-T85 PolarHBondContact O-OG1 3.37Å; L83-T85 VanDerWaalsContact C-N 3.34Å; L83-T85 PolarHBondContact O-N 2.86Å
86	E	84.3	Confident	86.4	Confident	8 Å²	8	40.6 Å²	40.6	4%	0.037	22%	0.223	C	C	.	.	S	Bend	trans	-90.9	159.6	-177.7	-67.2	-56.3	132.2	0	0	112.8	L83 T90 W185 N190 Q194	L83-E86 PolarHBondContact O-N 2.99Å; E86-T90 HydrophobicContact CB-CG2 3.81Å; E86-T90 HydrophobicContact CG-CG2 3.92Å; E86-W185 HydrophobicContact CG-CE3 3.9Å; E86-W185 HydrophobicContact CG-CZ3 3.72Å; E86-N190 PolarHBondContact OE1-ND2 3.44Å; E86-Q194 PolarHBondContact OE1-NE2 3.43Å; E86-Q194 PolarHBondContact OE2-NE2 2.95Å
87	P	80.5	Confident	86.1	Confident	41 Å²	41	44.3 Å²	44.3	27%	0.266	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-73.6	156.8	175.3	30.2	-33.9	0	0	0	112.7	G89 T90	P87-G89 PolarHBondContact O-N 3.12Å; P87-T90 WeakPolarHBondContact O-CB 3.26Å; P87-T90 PolarHBondContact O-N 3.39Å; P87-T90 VanDerWaalsContact O-N 3.15Å; P87-T90 PolarHBondContact O-OG1 3Å
88	P	83.6	Confident	85.6	Confident	54 Å²	54	46.1 Å²	46.1	35%	0.351	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	137.3	175.3	-26.3	35.8	0	0	0	113.7	R107 P109 L157	P88-R107 WeakPolarHBondContact CA-O 3.25Å; P88-P109 HydrophobicContact CB-CG 4.3Å; P88-L157 HydrophobicContact CB-CD1 3.68Å
89	G	84.2	Confident	85.1	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.4	-18.2	-172.9	0	0	0	0	0	114.2	P87 R107 L159 Q160	P87-G89 PolarHBondContact O-N 3.12Å; G89-R107 PolarHBondContact N-O 3.05Å; G89-L159 CarbonylContact O-C 3.54Å; G89-L159 WeakPolarHBondContact O-CA 3.33Å; G89-Q160 PolarHBondContact O-N 3.35Å
90	T	91.4	Very high	84.7	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.012	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-67.4	143.9	172	-63.8	0	0	0	0	111.3	L83 E86 P87 M106 R107 Q160 P162 W185	L83-T90 HydrophobicContact CD2-CG2 4.28Å; E86-T90 HydrophobicContact CB-CG2 3.81Å; E86-T90 HydrophobicContact CG-CG2 3.92Å; P87-T90 WeakPolarHBondContact O-CB 3.26Å; P87-T90 PolarHBondContact O-N 3.39Å; P87-T90 VanDerWaalsContact O-N 3.15Å; P87-T90 PolarHBondContact O-OG1 3Å; T90-M106 WeakPolarHBondContact O-CA 3.38Å; T90-R107 PolarHBondContact O-N 3Å; T90-Q160 WeakPolarHBondContact CA-O 3.5Å; T90-P162 HydrophobicContact CG2-CG 4.23Å; T90-W185 HydrophobicContact CG2-CH2 3.82Å; T90-W185 HydrophobicContact CG2-CZ3 3.65Å
91	F	93.9	Very high	84.8	Confident	1 Å²	1	55.1 Å²	55.1	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	163.7	-165.3	73.9	-84.1	0	0	0	113.5	L62 W69 L104 C105 M106 I145 L159 Q160 L161	L62-F91 HydrophobicContact CD2-CZ 4.11Å; W69-F91 HydrophobicContact CB-CE2 4.16Å; W69-F91 HydrophobicContact CD2-CE2 4.42Å; W69-F91 HydrophobicContact CE3-CE2 4.37Å; W69-F91 HydrophobicContact CG-CE2 4.35Å; F91-L104 HydrophobicContact CB-CD1 4.21Å; F91-L104 HydrophobicContact CD2-CD1 3.74Å; F91-L104 HydrophobicContact CG-CD1 4.29Å; F91-C105 CarbonylContact C-O 3.6Å; F91-C105 WeakPolarHBondContact CA-O 3.29Å; F91-C105 WeakPolarHBondContact CB-O 3.46Å; F91-M106 HydrophobicContact CB-CB 4.45Å; F91-I145 HydrophobicContact CE1-CG2 4.33Å; F91-I145 HydrophobicContact CE2-CD1 4.15Å; F91-I145 HydrophobicContact CE2-CG1 4.45Å; F91-I145 HydrophobicContact CE2-CG2 3.8Å; F91-I145 HydrophobicContact CZ-CG2 3.49Å; F91-I145 VanDerWaalsContact CZ-CG2 3.49Å; F91-L159 HydrophobicContact CB-CD2 3.58Å; F91-L159 HydrophobicContact CD1-CB 3.77Å; F91-L159 HydrophobicContact CD1-CD2 3.83Å; F91-L159 HydrophobicContact CD1-CG 4.28Å; F91-L159 HydrophobicContact CD2-CD2 4.29Å; F91-L159 HydrophobicContact CE1-CB 3.97Å; F91-L159 HydrophobicContact CG-CB 4.42Å; F91-L159 HydrophobicContact CG-CD2 3.63Å; F91-L159 HydrophobicContact CG-CG 4.45Å; F91-Q160 WeakPolarHBondContact CD1-O 3.49Å; F91-L161 HydrophobicContact CE1-CD2 4.25Å; F91-L161 HydrophobicContact CZ-CD2 4.19Å
92	L	93.8	Very high	85.2	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	156.6	163.3	62.8	89.5	0	0	0	109.9	W69 A79 V82 L83 R94 C105 W185	W69-L92 CarbonylContact O-C 3.58Å; W69-L92 WeakPolarHBondContact O-CA 3.23Å; A79-L92 HydrophobicContact CB-CD1 3.9Å; A79-L92 HydrophobicContact CB-CD2 4.33Å; V82-L92 HydrophobicContact CB-CD2 4.17Å; V82-L92 HydrophobicContact CG1-CD2 3.84Å; L83-L92 HydrophobicContact CD1-CD2 4.31Å; L83-L92 HydrophobicContact CD1-CG 4.31Å; L83-L92 HydrophobicContact CD2-CD2 4.3Å; L83-L92 HydrophobicContact CG-CD2 4.03Å; L83-L92 HydrophobicContact CG-CG 4.5Å; L92-R94 HydrophobicContact CD1-CB 4.19Å; L92-R94 HydrophobicContact CD1-CG 4.49Å; L92-C105 HydrophobicContact CD1-CB 4.17Å; L92-C105 HydrophobicContact CG-CB 4.33Å; L92-C105 PolarHBondContact N-O 2.77Å; L92-C105 PolarHBondContact O-N 2.95Å; L92-W185 HydrophobicContact CB-CZ2 4.46Å
93	V	94.7	Very high	85.4	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	130.2	172.1	178.5	0	0	0	0	108.8	W69 L70 Q71 Q102 A103 L104 I122 L141 I145	W69-V93 HydrophobicContact CE3-CG2 4.37Å; W69-V93 HydrophobicContact CZ3-CG2 4.42Å; W69-V93 PolarHBondContact O-N 3.44Å; L70-V93 CarbonylContact C-O 3.5Å; L70-V93 HydrophobicContact CD1-CB 3.74Å; L70-V93 HydrophobicContact CD1-CG1 3.66Å; Q71-V93 CarbonylContact C-O 3.54Å; Q71-V93 PolarHBondContact N-O 3.21Å; V93-Q102 HydrophobicContact CG1-CB 4.04Å; V93-A103 WeakPolarHBondContact CA-O 3.27Å; V93-L104 HydrophobicContact CG2-CB 4.45Å; V93-L104 HydrophobicContact CG2-CD1 3.71Å; V93-I122 HydrophobicContact CG1-CD1 3.58Å; V93-I122 HydrophobicContact CG2-CD1 4.18Å; V93-L141 HydrophobicContact CG1-CD2 4.32Å; V93-I145 HydrophobicContact CG2-CD1 4.07Å
94	R	93.1	Very high	85.7	Confident	11 Å²	11	48.9 Å²	48.9	4%	0.042	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	171.3	176.8	62.8	170.1	178	89.1	2.7	111.5	Q71 A74 L92 Q102 A103 C105	Q71-R94 WeakPolarHBondContact O-CA 3.26Å; Q71-R94 WeakPolarHBondContact O-CB 3.39Å; A74-R94 WeakPolarHBondContact O-CB 3.44Å; A74-R94 WeakPolarHBondContact O-CD 3.22Å; L92-R94 HydrophobicContact CD1-CB 4.19Å; L92-R94 HydrophobicContact CD1-CG 4.49Å; R94-Q102 CarbonylContact O-C 3.52Å; R94-Q102 WeakPolarHBondContact O-CA 3.22Å; R94-A103 HydrophobicContact CG-CB 4.39Å; R94-A103 PolarHBondContact N-O 2.98Å; R94-A103 PolarHBondContact O-N 2.93Å; R94-C105 PolarHBondContact NE-SG 3.05Å
95	K	90.2	Very high	86.2	Confident	93 Å²	93	40.8 Å²	40.8	40%	0.404	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	146.3	165.9	-162.5	173.4	178.6	-172.7	0	110.8	L72 Q100	L72-K95 WeakPolarHBondContact O-CB 3.26Å; K95-Q100 WeakPolarHBondContact CE-O 3.48Å
96	S	85.6	Confident	86.9	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.007	18%	0.184	C	C	.	.			trans	-85.9	119.9	169.3	-175	0	0	0	0	110.3	T98 R99 Q100 C101	S96-T98 VanDerWaalsContact C-N 3.29Å; S96-T98 PolarHBondContact OG-N 3.29Å; S96-T98 PolarHBondContact OG-OG1 2.94Å; S96-R99 PolarHBondContact OG-N 3.34Å; S96-R99 VanDerWaalsContact OG-N 3.12Å; S96-Q100 WeakPolarHBondContact O-CA 3.36Å; S96-Q100 PolarHBondContact O-N 3.49Å; S96-Q100 VanDerWaalsContact O-N 3.1Å; S96-C101 WeakPolarHBondContact CB-O 3.28Å; S96-C101 PolarHBondContact N-O 2.9Å
97	N	77.3	Confident	87.1	Confident	118 Å²	118	36.6 Å²	36.6	63%	0.631	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-19.9	172.5	58	-39.2	0	0	0	113.1
98	T	73.3	Confident	87.1	Confident	104 Å²	104	35.2 Å²	35.2	64%	0.638	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-28.1	-178.4	54.8	0	0	0	0	113.9	S96	S96-T98 VanDerWaalsContact C-N 3.29Å; S96-T98 PolarHBondContact OG-N 3.29Å; S96-T98 PolarHBondContact OG-OG1 2.94Å
99	R	73.3	Confident	86.7	Confident	128 Å²	128	35.2 Å²	35.2	48%	0.483	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.8	1.1	-176.3	-70.1	-171.9	171.1	-171.1	-4.5	114.8	S96 C101 E132	S96-R99 PolarHBondContact OG-N 3.34Å; S96-R99 VanDerWaalsContact OG-N 3.12Å; R99-C101 VanDerWaalsContact CB-SG 3.6Å; R99-C101 PolarHBondContact O-N 2.93Å; R99-E132 IonicContact CZ-OE1 3.72Å; R99-E132 IonicContact CZ-OE2 3.95Å; R99-E132 IonicContact NH1-OE1 3.54Å; R99-E132 PolarHBondContact NH1-OE1 3.18Å; R99-E132 IonicContact NH1-OE2 3.78Å; R99-E132 PolarHBondContact NH1-OE2 2.99Å; R99-E132 IonicContact NH2-OE1 2.67Å
100	Q	77.8	Confident	85.5	Confident	131 Å²	131	42.6 Å²	42.6	61%	0.612	21%	0.21	S	C	*	.	S	Bend	trans	58.2	-15	-176.9	-65.7	-68.4	-15.9	0	0	117.2	K95 S96	K95-Q100 WeakPolarHBondContact CE-O 3.48Å; S96-Q100 WeakPolarHBondContact O-CA 3.36Å; S96-Q100 PolarHBondContact O-N 3.49Å; S96-Q100 VanDerWaalsContact O-N 3.1Å
101	C	85.6	Confident	83.2	Confident	32 Å²	32	46.5 Å²	46.5	22%	0.216	24%	0.243	C	C	.	.	S	Bend	trans	-72.8	174.8	171.2	61.6	0	0	0	0	113.2	S96 R99	S96-C101 WeakPolarHBondContact CB-O 3.28Å; S96-C101 PolarHBondContact N-O 2.9Å; R99-C101 VanDerWaalsContact CB-SG 3.6Å; R99-C101 PolarHBondContact O-N 2.93Å
102	Q	93.1	Very high	81	Confident	32 Å²	32	48.3 Å²	48.3	15%	0.15	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	157.5	169.9	-60.4	-174.3	67.7	0	0	110.9	L72 V93 R94 I122 E124	L72-Q102 HydrophobicContact CD2-CG 4.15Å; V93-Q102 HydrophobicContact CG1-CB 4.04Å; R94-Q102 CarbonylContact O-C 3.52Å; R94-Q102 WeakPolarHBondContact O-CA 3.22Å; Q102-I122 HydrophobicContact CB-CB 4.05Å; Q102-I122 HydrophobicContact CB-CD1 3.72Å; Q102-I122 HydrophobicContact CB-CG1 4.47Å; Q102-I122 PolarHBondContact O-N 3.46Å; Q102-E124 PolarHBondContact NE2-OE1 2.96Å
103	A	91.9	Very high	78.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	121.1	179.4	0	0	0	0	0	111.6	V93 R94 H120 Y121	V93-A103 WeakPolarHBondContact CA-O 3.27Å; R94-A103 HydrophobicContact CG-CB 4.39Å; R94-A103 PolarHBondContact N-O 2.98Å; R94-A103 PolarHBondContact O-N 2.93Å; A103-H120 CarbonylContact C-O 3.57Å; A103-H120 WeakPolarHBondContact CA-O 3.26Å; A103-Y121 HydrophobicContact CB-CD1 4Å; A103-Y121 HydrophobicContact CB-CE1 4.3Å
104	L	93.9	Very high	76.7	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	110.9	174.4	178	64.2	0	0	0	109.7	F91 V93 S119 H120 I122 L131 L155 L159	F91-L104 HydrophobicContact CB-CD1 4.21Å; F91-L104 HydrophobicContact CD2-CD1 3.74Å; F91-L104 HydrophobicContact CG-CD1 4.29Å; V93-L104 HydrophobicContact CG2-CB 4.45Å; V93-L104 HydrophobicContact CG2-CD1 3.71Å; L104-S119 WeakPolarHBondContact O-CA 3.41Å; L104-H120 PolarHBondContact N-O 3.31Å; L104-H120 PolarHBondContact O-N 3.4Å; L104-I122 HydrophobicContact CB-CD1 4.22Å; L104-I122 HydrophobicContact CB-CG1 4.42Å; L104-L131 HydrophobicContact CB-CD2 4.41Å; L104-L131 HydrophobicContact CD2-CD1 3.87Å; L104-L131 HydrophobicContact CD2-CD2 4.15Å; L104-L155 HydrophobicContact CD2-CD1 4.2Å; L104-L159 HydrophobicContact CD1-CD1 4.42Å; L104-L159 HydrophobicContact CD1-CD2 4.06Å; L104-L159 HydrophobicContact CD2-CD1 4.2Å; L104-L159 HydrophobicContact CD2-CD2 4.14Å; L104-L159 HydrophobicContact CG-CD2 4.4Å
105	C	91.7	Very high	75.1	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.007	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	129	178.1	-58.4	0	0	0	0	109.6	A79 L83 F91 L92 R94 V117 S118	A79-C105 HydrophobicContact CB-CB 4.4Å; L83-C105 HydrophobicContact CD1-CB 3.83Å; F91-C105 CarbonylContact C-O 3.6Å; F91-C105 WeakPolarHBondContact CA-O 3.29Å; F91-C105 WeakPolarHBondContact CB-O 3.46Å; L92-C105 HydrophobicContact CD1-CB 4.17Å; L92-C105 HydrophobicContact CG-CB 4.33Å; L92-C105 PolarHBondContact N-O 2.77Å; L92-C105 PolarHBondContact O-N 2.95Å; R94-C105 PolarHBondContact NE-SG 3.05Å; C105-V117 HydrophobicContact CB-CG1 4.12Å; C105-S118 CarbonylContact C-O 3.58Å; C105-S118 VanDerWaalsContact CA-O 3.29Å; C105-S118 WeakPolarHBondContact CA-O 3.26Å
106	M	91.7	Very high	74.6	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	134.8	-178.7	177.8	-155.7	-77.7	0	0	111.7	T90 F91 L108 V117 S118 L155 L157 L159	T90-M106 WeakPolarHBondContact O-CA 3.38Å; F91-M106 HydrophobicContact CB-CB 4.45Å; M106-L108 PolarHBondContact O-N 3.29Å; M106-L108 HydrophobicContact SD-CD2 4.4Å; M106-V117 CarbonylContact O-C 3.52Å; M106-V117 VanDerWaalsContact O-CA 3.3Å; M106-V117 WeakPolarHBondContact O-CA 3.42Å; M106-S118 PolarHBondContact N-O 2.98Å; M106-S118 PolarHBondContact O-N 3.28Å; M106-S118 PolarHBondContact O-OG 2.94Å; M106-L155 HydrophobicContact CE-CB 4.1Å; M106-L155 HydrophobicContact CE-CD1 3.69Å; M106-L155 HydrophobicContact CE-CG 4.36Å; M106-L157 WeakPolarHBondContact CE-O 3.2Å; M106-L157 HydrophobicContact SD-CB 3.96Å; M106-L159 HydrophobicContact CE-CD2 3.41Å; M106-L159 VanDerWaalsContact CE-CD2 3.41Å; M106-L159 HydrophobicContact CE-CG 4.15Å
107	R	88.2	Confident	74.4	Confident	17 Å²	17	61 Å²	61	6%	0.064	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	119.3	169.9	-179	55	154.8	111.2	-8.5	111.1	L83 R84 P88 G89 T90 E110 F116	L83-R107 HydrophobicContact CB-CB 4.31Å; L83-R107 WeakPolarHBondContact O-CD 3.35Å; L83-R107 WeakPolarHBondContact O-CG 3.49Å; L83-R107 PolarHBondContact O-NE 3.24Å; R84-R107 PolarHBondContact O-NH2 2.82Å; P88-R107 WeakPolarHBondContact CA-O 3.25Å; G89-R107 PolarHBondContact N-O 3.05Å; T90-R107 PolarHBondContact O-N 3Å; R107-E110 IonicContact CZ-OE2 3.75Å; R107-E110 VanDerWaalsContact CZ-OE2 3.22Å; R107-E110 IonicContact NH1-OE2 2.81Å; R107-E110 PolarHBondContact NH1-OE2 3.14Å; R107-E110 IonicContact NH2-OE1 2.67Å; R107-E110 IonicContact NH2-OE2 3.05Å; R107-E110 PolarHBondContact NH2-OE2 2.89Å; R107-F116 VanDerWaalsContact CD-O 3.32Å; R107-F116 WeakPolarHBondContact CD-O 3.4Å
108	L	80.7	Confident	74.8	Confident	12 Å²	12	56.2 Å²	56.2	6%	0.063	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-88.4	166.2	170.5	-60.8	-174	0	0	0	111.1	M106 S112 F116 L156	M106-L108 PolarHBondContact O-N 3.29Å; M106-L108 HydrophobicContact SD-CD2 4.4Å; L108-S112 WeakPolarHBondContact CB-OG 3.29Å; L108-F116 PolarHBondContact N-O 3.19Å; L108-L156 HydrophobicContact CD1-CD1 4.15Å; L108-L156 HydrophobicContact CD2-CB 4.34Å; L108-L156 HydrophobicContact CD2-CD1 3.93Å
109	P	76.1	Confident	75.6	Confident	55 Å²	55	53.8 Å²	53.8	36%	0.357	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-65.5	154.5	169	-17.5	32.8	0	0	0	112.3	P88 A111 S112 L157	P88-P109 HydrophobicContact CB-CG 4.3Å; P109-A111 PolarHBondContact O-N 3.38Å; P109-S112 PolarHBondContact O-N 3.02Å; P109-S112 PolarHBondContact O-OG 3.46Å; P109-L157 HydrophobicContact CG-CD1 4.23Å
110	E	57.6	Low	76.4	Confident	154 Å²	154	49.5 Å²	49.5	72%	0.72	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.4	179.8	-131.9	78.7	165.7	0	0	114.8	R107	R107-E110 IonicContact CZ-OE2 3.75Å; R107-E110 VanDerWaalsContact CZ-OE2 3.22Å; R107-E110 IonicContact NH1-OE2 2.81Å; R107-E110 PolarHBondContact NH1-OE2 3.14Å; R107-E110 IonicContact NH2-OE1 2.67Å; R107-E110 IonicContact NH2-OE2 3.05Å; R107-E110 PolarHBondContact NH2-OE2 2.89Å
111	A	44.4	Very low	77	Confident	84 Å²	84	45.9 Å²	45.9	69%	0.694	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	4.8	-173.1	0	0	0	0	0	114.8	P109	P109-A111 PolarHBondContact O-N 3.38Å
112	S	48.3	Very low	77.4	Confident	39 Å²	39	44.4 Å²	44.4	27%	0.273	27%	0.266	S	S	.	.	S	Bend	trans	-92.2	145.9	174	53.5	0	0	0	0	112.6	L108 P109	L108-S112 WeakPolarHBondContact CB-OG 3.29Å; P109-S112 PolarHBondContact O-N 3.02Å; P109-S112 PolarHBondContact O-OG 3.46Å
113	S	42.9	Very low	77.3	Confident	108 Å²	108	46.4 Å²	46.4	76%	0.755	28%	0.277	S	S	*	.	S	Bend	trans	-40.4	153.8	176.6	-139.2	0	0	0	0	114.5	S115	S113-S115 PolarHBondContact O-N 2.84Å
114	P	53.4	Low	77.2	Confident	137 Å²	137	52.4 Å²	52.4	89%	0.89	31%	0.305	S	S	*	.	S	Bend		-62.3	6.2	-120.1	25.5	-38.3	0	0	0	119
115	S	61.4	Low	76.8	Confident	51 Å²	51	54.8 Å²	54.8	36%	0.357	32%	0.322	S	S	.	.			trans	-111	126.8	171.8	-178.2	0	0	0	0	111.1	S113 V117	S113-S115 PolarHBondContact O-N 2.84Å; S115-V117 PolarHBondContact O-N 2.98Å; S115-V117 PolarHBondContact OG-N 3.09Å; S115-V117 PolarHBondContact OG-O 3.05Å
116	F	78.8	Confident	76.2	Confident	65 Å²	65	61.9 Å²	61.9	29%	0.285	37%	0.368	S	S	.	.	S	Bend	trans	-75	0.6	171.5	63.9	-89.9	0	0	0	113.3	L80 R84 R107 L108	L80-F116 HydrophobicContact CB-CZ 4.31Å; L80-F116 HydrophobicContact CD2-CE1 4.15Å; L80-F116 HydrophobicContact CD2-CE2 4Å; L80-F116 HydrophobicContact CD2-CZ 3.71Å; L80-F116 WeakPolarHBondContact O-CE2 3.18Å; R84-F116 HydrophobicContact CB-CE2 3.7Å; R84-F116 HydrophobicContact CB-CZ 4.1Å; R84-F116 HydrophobicContact CG-CE2 4.05Å; R84-F116 HydrophobicContact CG-CZ 4.19Å; R107-F116 VanDerWaalsContact CD-O 3.32Å; R107-F116 WeakPolarHBondContact CD-O 3.4Å; L108-F116 PolarHBondContact N-O 3.19Å
117	V	82.3	Confident	75.5	Confident	11 Å²	11	64.8 Å²	64.8	7%	0.067	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	130.7	172.6	172.6	0	0	0	0	110.5	L80 L83 C105 M106 S115	L80-V117 HydrophobicContact CD2-CB 3.77Å; L80-V117 HydrophobicContact CD2-CG2 3.87Å; L83-V117 HydrophobicContact CB-CG2 3.73Å; L83-V117 HydrophobicContact CD1-CG1 3.9Å; L83-V117 HydrophobicContact CD1-CG2 4.01Å; C105-V117 HydrophobicContact CB-CG1 4.12Å; M106-V117 CarbonylContact O-C 3.52Å; M106-V117 VanDerWaalsContact O-CA 3.3Å; M106-V117 WeakPolarHBondContact O-CA 3.42Å; S115-V117 PolarHBondContact O-N 2.98Å; S115-V117 PolarHBondContact OG-N 3.09Å; S115-V117 PolarHBondContact OG-O 3.05Å
118	S	85.6	Confident	75.6	Confident	19 Å²	19	64.4 Å²	64.4	13%	0.133	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	146.9	165.8	55.3	0	0	0	0	110.5	C105 M106 H120	C105-S118 CarbonylContact C-O 3.58Å; C105-S118 VanDerWaalsContact CA-O 3.29Å; C105-S118 WeakPolarHBondContact CA-O 3.26Å; M106-S118 PolarHBondContact N-O 2.98Å; M106-S118 PolarHBondContact O-N 3.28Å; M106-S118 PolarHBondContact O-OG 2.94Å; S118-H120 PolarHBondContact OG-CE1 3.39Å
119	S	88.9	Confident	76.2	Confident	53 Å²	53	64.8 Å²	64.8	37%	0.371	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	119.6	171.9	-72.7	0	0	0	0	109.1	L104	L104-S119 WeakPolarHBondContact O-CA 3.41Å
120	H	89.9	Confident	76.9	Confident	38 Å²	38	62.9 Å²	62.9	18%	0.176	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	127.8	175.7	-53.5	85.3	0	0	0	108.2	A103 L104 S118 L131 L155	A103-H120 CarbonylContact C-O 3.57Å; A103-H120 WeakPolarHBondContact CA-O 3.26Å; L104-H120 PolarHBondContact N-O 3.31Å; L104-H120 PolarHBondContact O-N 3.4Å; S118-H120 PolarHBondContact OG-CE1 3.39Å; H120-L131 HydrophobicContact CB-CD1 4.33Å; H120-L155 WeakPolarHBondContact CE1-CD2 3.31Å; H120-L155 WeakPolarHBondContact ND1-CD2 3.21Å
121	Y	91.6	Very high	78.5	Confident	54 Å²	54	55.6 Å²	55.6	21%	0.212	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	142.9	177.8	-59.7	-71.8	0	0	0	110.3	A103 L131 E132	A103-Y121 HydrophobicContact CB-CD1 4Å; A103-Y121 HydrophobicContact CB-CE1 4.3Å; Y121-L131 WeakPolarHBondContact O-CA 3.48Å; Y121-E132 WeakPolarHBondContact CB-OE2 3.47Å; Y121-E132 VanDerWaalsContact CD2-OE2 3.27Å; Y121-E132 WeakPolarHBondContact CD2-OE2 3.39Å; Y121-E132 PolarHBondContact O-N 2.84Å
122	I	93.2	Very high	80.6	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	125	175.4	-65.1	152.8	0	0	0	106.9	V93 Q102 L104 V129 S130 L131 L141	V93-I122 HydrophobicContact CG1-CD1 3.58Å; V93-I122 HydrophobicContact CG2-CD1 4.18Å; Q102-I122 HydrophobicContact CB-CB 4.05Å; Q102-I122 HydrophobicContact CB-CD1 3.72Å; Q102-I122 HydrophobicContact CB-CG1 4.47Å; Q102-I122 PolarHBondContact O-N 3.46Å; L104-I122 HydrophobicContact CB-CD1 4.22Å; L104-I122 HydrophobicContact CB-CG1 4.42Å; I122-V129 HydrophobicContact CG2-CB 4.28Å; I122-V129 HydrophobicContact CG2-CG1 3.8Å; I122-S130 CarbonylContact C-O 3.58Å; I122-S130 WeakPolarHBondContact CA-O 3.38Å; I122-L131 HydrophobicContact CB-CD2 4.46Å; I122-L131 HydrophobicContact CG1-CD2 3.57Å; I122-L141 HydrophobicContact CD1-CD1 3.8Å; I122-L141 HydrophobicContact CG1-CD1 4.49Å
123	L	91.1	Very high	82.1	Confident	75 Å²	75	56.9 Å²	56.9	39%	0.393	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	125.6	177.5	-57	-179.2	0	0	0	108.4	V129 S130 E132	L123-V129 CarbonylContact O-C 3.53Å; L123-V129 WeakPolarHBondContact O-CA 3.45Å; L123-S130 PolarHBondContact N-O 3.36Å; L123-S130 PolarHBondContact O-N 3.16Å; L123-E132 HydrophobicContact CD1-CB 4.14Å; L123-E132 HydrophobicContact CD1-CG 4.39Å; L123-E132 HydrophobicContact CD2-CB 4.44Å; L123-E132 HydrophobicContact CG-CB 4.19Å
124	E	89.4	Confident	84.2	Confident	126 Å²	126	52.6 Å²	52.6	59%	0.589	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	128.6	176.6	-69.4	172.7	-149.4	0	0	108.9	Q102 V129	Q102-E124 PolarHBondContact NE2-OE1 2.96Å; E124-V129 HydrophobicContact CG-CB 4.23Å; E124-V129 HydrophobicContact CG-CG2 4.21Å
125	S	85	Confident	85.6	Confident	51 Å²	51	55.5 Å²	55.5	36%	0.357	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	164	-175.5	79.2	0	0	0	0	111.1	G127 G128 M137	S125-G127 PolarHBondContact O-N 3.29Å; S125-G127 VanDerWaalsContact O-N 3.08Å; S125-G127 PolarHBondContact OG-N 2.71Å; S125-G128 WeakPolarHBondContact CA-O 3.42Å; S125-G128 WeakPolarHBondContact CB-O 3.28Å; S125-G128 PolarHBondContact N-O 3.24Å; S125-G128 PolarHBondContact O-N 3.31Å; S125-G128 VanDerWaalsContact O-O 3.08Å; S125-G128 PolarHBondContact OG-O 3.13Å; S125-M137 WeakPolarHBondContact OG-CE 3.41Å
126	P	79.4	Confident	86.8	Confident	150 Å²	150	56 Å²	56	97%	0.974	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.2	178.3	-25.1	35.4	0	0	0	114.9
127	G	78.2	Confident	87.3	Confident	60 Å²	60	57.9 Å²	57.9	62%	0.619	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-7.6	176.9	0	0	0	0	0	115	S125	S125-G127 PolarHBondContact O-N 3.29Å; S125-G127 VanDerWaalsContact O-N 3.08Å; S125-G127 PolarHBondContact OG-N 2.71Å
128	G	89.3	Confident	87.8	Confident	10 Å²	10	58.8 Å²	58.8	10%	0.103	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	136.4	-169.8	-173.2	0	0	0	0	0	112.9	S125 F138	S125-G128 WeakPolarHBondContact CA-O 3.42Å; S125-G128 WeakPolarHBondContact CB-O 3.28Å; S125-G128 PolarHBondContact N-O 3.24Å; S125-G128 PolarHBondContact O-N 3.31Å; S125-G128 VanDerWaalsContact O-O 3.08Å; S125-G128 PolarHBondContact OG-O 3.13Å; G128-F138 CarbonylContact C-O 3.54Å; G128-F138 VanDerWaalsContact CA-O 3.31Å; G128-F138 WeakPolarHBondContact CA-O 3.48Å
129	V	92.9	Very high	88	Confident	19 Å²	19	63.1 Å²	63.1	12%	0.115	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	141.6	-177.5	111.6	0	0	0	0	111.2	I122 L123 E124 F138 L144	I122-V129 HydrophobicContact CG2-CB 4.28Å; I122-V129 HydrophobicContact CG2-CG1 3.8Å; L123-V129 CarbonylContact O-C 3.53Å; L123-V129 WeakPolarHBondContact O-CA 3.45Å; E124-V129 HydrophobicContact CG-CB 4.23Å; E124-V129 HydrophobicContact CG-CG2 4.21Å; V129-F138 PolarHBondContact N-O 2.9Å; V129-F138 PolarHBondContact O-N 3.06Å; V129-L144 HydrophobicContact CG1-CB 4.43Å; V129-L144 HydrophobicContact CG1-CD1 3.51Å
130	S	92.1	Very high	88.2	Confident	16 Å²	16	63 Å²	63	11%	0.112	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	177.1	177.6	65.1	0	0	0	0	111	I122 L123 L136	I122-S130 CarbonylContact C-O 3.58Å; I122-S130 WeakPolarHBondContact CA-O 3.38Å; L123-S130 PolarHBondContact N-O 3.36Å; L123-S130 PolarHBondContact O-N 3.16Å; S130-L136 WeakPolarHBondContact CB-O 3.5Å
131	L	91.1	Very high	88.3	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	146.2	165.7	-61.2	-173.5	0	0	0	110.3	L104 H120 Y121 I122 G133 S134 L144 Y148 I154 L155	L104-L131 HydrophobicContact CB-CD2 4.41Å; L104-L131 HydrophobicContact CD2-CD1 3.87Å; L104-L131 HydrophobicContact CD2-CD2 4.15Å; H120-L131 HydrophobicContact CB-CD1 4.33Å; Y121-L131 WeakPolarHBondContact O-CA 3.48Å; I122-L131 HydrophobicContact CB-CD2 4.46Å; I122-L131 HydrophobicContact CG1-CD2 3.57Å; L131-G133 PolarHBondContact O-N 2.91Å; L131-G133 VanDerWaalsContact O-N 3.14Å; L131-S134 WeakPolarHBondContact O-CB 3.48Å; L131-S134 PolarHBondContact O-N 3.11Å; L131-L144 HydrophobicContact CD2-CD1 4.1Å; L131-L144 HydrophobicContact CD2-CD2 4.1Å; L131-L144 HydrophobicContact CG-CD1 4.27Å; L131-L144 HydrophobicContact CG-CD2 4.31Å; L131-Y148 HydrophobicContact CD1-CD1 4.48Å; L131-Y148 HydrophobicContact CD1-CD2 4.36Å; L131-Y148 HydrophobicContact CD1-CE1 3.87Å; L131-Y148 HydrophobicContact CD1-CE2 3.8Å; L131-Y148 HydrophobicContact CG-CE2 3.96Å; L131-I154 HydrophobicContact CB-CD1 3.68Å; L131-I154 HydrophobicContact CD1-CD1 4.18Å; L131-I154 HydrophobicContact CD1-CG1 4.38Å; L131-L155 HydrophobicContact CD1-CD1 4.4Å; L131-L155 HydrophobicContact CD1-CD2 3.92Å; L131-L155 HydrophobicContact CD1-CG 4.33Å
132	E	87	Confident	88.4	Confident	80 Å²	80	59.5 Å²	59.5	37%	0.374	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	115.4	175.1	-172.9	174.8	151.5	0	0	110.5	R99 Y121 L123 I154	R99-E132 IonicContact CZ-OE1 3.72Å; R99-E132 IonicContact CZ-OE2 3.95Å; R99-E132 IonicContact NH1-OE1 3.54Å; R99-E132 PolarHBondContact NH1-OE1 3.18Å; R99-E132 IonicContact NH1-OE2 3.78Å; R99-E132 PolarHBondContact NH1-OE2 2.99Å; R99-E132 IonicContact NH2-OE1 2.67Å; Y121-E132 WeakPolarHBondContact CB-OE2 3.47Å; Y121-E132 VanDerWaalsContact CD2-OE2 3.27Å; Y121-E132 WeakPolarHBondContact CD2-OE2 3.39Å; Y121-E132 PolarHBondContact O-N 2.84Å; L123-E132 HydrophobicContact CD1-CB 4.14Å; L123-E132 HydrophobicContact CD1-CG 4.39Å; L123-E132 HydrophobicContact CD2-CB 4.44Å; L123-E132 HydrophobicContact CG-CB 4.19Å; E132-I154 WeakPolarHBondContact O-CD1 3.5Å
133	G	80.4	Confident	88.3	Confident	70 Å²	70	62.7 Å²	62.7	72%	0.722	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.7	-4.8	-175	0	0	0	0	0	115.6	L131 I154	L131-G133 PolarHBondContact O-N 2.91Å; L131-G133 VanDerWaalsContact O-N 3.14Å; G133-I154 WeakPolarHBondContact O-CG2 3.41Å
134	S	86.9	Confident	88.4	Confident	18 Å²	18	59.1 Å²	59.1	13%	0.126	35%	0.352	C	S	.	.			trans	-95.8	139.6	176.7	-175.9	0	0	0	0	112.2	L131 L136 Y148 D153	L131-S134 WeakPolarHBondContact O-CB 3.48Å; L131-S134 PolarHBondContact O-N 3.11Å; S134-L136 WeakPolarHBondContact OG-CB 3.39Å; S134-L136 PolarHBondContact OG-N 2.69Å; S134-L136 VanDerWaalsContact OG-N 3.09Å; S134-Y148 VanDerWaalsContact CB-OH 3.26Å; S134-Y148 WeakPolarHBondContact CB-OH 3.22Å; S134-Y148 PolarHBondContact OG-OH 2.92Å; S134-D153 VanDerWaalsContact CB-OD2 3.3Å; S134-D153 WeakPolarHBondContact CB-OD2 3.44Å; S134-D153 PolarHBondContact OG-OD2 2.96Å
135	E	84.1	Confident	88.6	Confident	198 Å²	198	53.1 Å²	53.1	93%	0.925	32%	0.324	S	S	*	.	S	Bend	trans	-79.1	-6.7	169.2	-63.3	-177.6	179	0	0	112.6
136	L	85.2	Confident	88.9	Confident	62 Å²	62	51.4 Å²	51.4	33%	0.325	31%	0.311	S	S	.	.			trans	-90.5	116.4	-176.2	-54.8	-179.8	0	0	0	111.8	S130 S134 F138 D153	S130-L136 WeakPolarHBondContact CB-O 3.5Å; S134-L136 WeakPolarHBondContact OG-CB 3.39Å; S134-L136 PolarHBondContact OG-N 2.69Å; S134-L136 VanDerWaalsContact OG-N 3.09Å; L136-F138 HydrophobicContact CB-CE2 3.58Å; L136-F138 HydrophobicContact CB-CZ 3.67Å; L136-F138 HydrophobicContact CD1-CZ 4.15Å; L136-F138 WeakPolarHBondContact O-CE2 3.34Å; L136-D153 HydrophobicContact CD1-CB 3.84Å
137	M	89.1	Confident	89.3	Confident	104 Å²	104	45.4 Å²	45.4	51%	0.512	28%	0.275	S	S	.	.			trans	-105.3	138	173.9	-173.4	175.7	-71.4	0	0	111	S125	S125-M137 WeakPolarHBondContact OG-CE 3.41Å
138	F	92.3	Very high	89.7	Confident	30 Å²	30	42.5 Å²	42.5	13%	0.132	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-126.5	146.4	-175.6	-59.2	-84.3	0	0	0	111.5	G128 V129 L136 D140 Q143 L144 A147 Y148	G128-F138 CarbonylContact C-O 3.54Å; G128-F138 VanDerWaalsContact CA-O 3.31Å; G128-F138 WeakPolarHBondContact CA-O 3.48Å; V129-F138 PolarHBondContact N-O 2.9Å; V129-F138 PolarHBondContact O-N 3.06Å; L136-F138 HydrophobicContact CB-CE2 3.58Å; L136-F138 HydrophobicContact CB-CZ 3.67Å; L136-F138 HydrophobicContact CD1-CZ 4.15Å; L136-F138 WeakPolarHBondContact O-CE2 3.34Å; F138-D140 VanDerWaalsContact C-N 3.29Å; F138-D140 PolarHBondContact O-N 3.43Å; F138-Q143 HydrophobicContact CB-CB 4.4Å; F138-L144 HydrophobicContact CB-CB 3.98Å; F138-L144 HydrophobicContact CD2-CB 3.75Å; F138-L144 HydrophobicContact CD2-CD1 4Å; F138-L144 HydrophobicContact CD2-CG 3.72Å; F138-L144 HydrophobicContact CE2-CB 4.47Å; F138-L144 HydrophobicContact CE2-CG 4.12Å; F138-L144 HydrophobicContact CG-CB 3.91Å; F138-L144 HydrophobicContact CG-CG 4.4Å; F138-A147 HydrophobicContact CD1-CB 4.11Å; F138-A147 HydrophobicContact CE1-CB 3.26Å; F138-A147 HydrophobicContact CZ-CB 3.58Å; F138-Y148 HydrophobicContact CE2-CD2 4.32Å; F138-Y148 AromaticContact CE2-CE2 3.76Å; F138-Y148 HydrophobicContact CE2-CE2 3.76Å; F138-Y148 HydrophobicContact CZ-CE2 4.29Å
139	P	91.3	Very high	89.7	Confident	110 Å²	110	43.1 Å²	43.1	71%	0.714	25%	0.248	S	C	*	.	S	Bend	trans	-63.2	-31.1	-178.7	-24.6	34.5	0	0	0	114.4
140	D	91.6	Very high	89.1	Confident	50 Å²	50	49.4 Å²	49.4	27%	0.267	28%	0.275	S	S	.	.	S	Bend	trans	-149.2	160.7	179.9	76.7	59.4	0	0	0	111.7	R59 F138 V142 Q143 L144	R59-D140 IonicContact NH2-OD2 3.51Å; R59-D140 PolarHBondContact NH2-OD2 2.7Å; F138-D140 VanDerWaalsContact C-N 3.29Å; F138-D140 PolarHBondContact O-N 3.43Å; D140-V142 VanDerWaalsContact C-N 3.26Å; D140-V142 PolarHBondContact O-N 3.2Å; D140-V142 VanDerWaalsContact OD1-CA 3.23Å; D140-V142 WeakPolarHBondContact OD1-CA 3.46Å; D140-V142 WeakPolarHBondContact OD1-CB 3.38Å; D140-V142 PolarHBondContact OD1-N 2.67Å; D140-Q143 PolarHBondContact O-N 3.13Å; D140-Q143 VanDerWaalsContact O-N 3.13Å; D140-Q143 PolarHBondContact OD1-N 3.03Å; D140-Q143 WeakPolarHBondContact OD2-CG 3.38Å; D140-L144 PolarHBondContact O-N 3.13Å
141	L	92.3	Very high	88.4	Confident	14 Å²	14	51.7 Å²	51.7	7%	0.073	29%	0.289	C	S	.	.	H	α-helix	trans	-61.2	-29.5	-179	178.5	61.8	0	0	0	113.4	W69 L70 V93 I122 I145	W69-L141 HydrophobicContact CZ3-CD2 4.14Å; W69-L141 HydrophobicContact CZ3-CG 4.4Å; L70-L141 HydrophobicContact CD1-CD2 3.99Å; V93-L141 HydrophobicContact CG1-CD2 4.32Å; I122-L141 HydrophobicContact CD1-CD1 3.8Å; I122-L141 HydrophobicContact CG1-CD1 4.49Å; L141-I145 HydrophobicContact CD1-CD1 4.02Å; L141-I145 HydrophobicContact CD1-CG1 4.34Å; L141-I145 HydrophobicContact CG-CD1 3.96Å; L141-I145 WeakPolarHBondContact O-CD1 3.48Å; L141-I145 VanDerWaalsContact O-CG1 3.28Å; L141-I145 WeakPolarHBondContact O-CG1 3.48Å; L141-I145 PolarHBondContact O-N 2.67Å
142	V	93.6	Very high	87.6	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.024	31%	0.314	C	S	.	.	H	α-helix	trans	-73.5	-36.8	176.6	-179.1	0	0	0	0	110.3	R59 L62 L63 W69 D140 I145 C146	R59-V142 HydrophobicContact CG-CG1 4.06Å; L62-V142 HydrophobicContact CB-CG1 3.78Å; L62-V142 HydrophobicContact CD1-CG1 4.36Å; L63-V142 HydrophobicContact CD2-CG1 4.49Å; L63-V142 HydrophobicContact CD2-CG2 4.07Å; L63-V142 HydrophobicContact CG-CG1 4.3Å; W69-V142 HydrophobicContact CH2-CG2 4.09Å; W69-V142 HydrophobicContact CZ2-CG2 4.14Å; D140-V142 VanDerWaalsContact C-N 3.26Å; D140-V142 PolarHBondContact O-N 3.2Å; D140-V142 VanDerWaalsContact OD1-CA 3.23Å; D140-V142 WeakPolarHBondContact OD1-CA 3.46Å; D140-V142 WeakPolarHBondContact OD1-CB 3.38Å; D140-V142 PolarHBondContact OD1-N 2.67Å; V142-I145 PolarHBondContact O-N 2.96Å; V142-C146 VanDerWaalsContact O-CB 3.29Å; V142-C146 WeakPolarHBondContact O-CB 3.32Å; V142-C146 PolarHBondContact O-N 3.12Å; V142-C146 PolarHBondContact O-SG 2.86Å
143	Q	91.7	Very high	87.5	Confident	68 Å²	68	58.4 Å²	58.4	32%	0.318	32%	0.316	S	S	.	.	H	α-helix	trans	-67.2	-40	172.9	-61.7	-70.2	28	0	0	111.7	F138 D140 C146 A147	F138-Q143 HydrophobicContact CB-CB 4.4Å; D140-Q143 PolarHBondContact O-N 3.13Å; D140-Q143 VanDerWaalsContact O-N 3.13Å; D140-Q143 PolarHBondContact OD1-N 3.03Å; D140-Q143 WeakPolarHBondContact OD2-CG 3.38Å; Q143-C146 PolarHBondContact O-N 3.34Å; Q143-A147 WeakPolarHBondContact O-CB 3.41Å; Q143-A147 PolarHBondContact O-N 3Å
144	L	93.9	Very high	87.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-55	-55.5	170.6	-174.4	155.8	0	0	0	110.1	V129 L131 F138 D140 C146 A147 Y148	V129-L144 HydrophobicContact CG1-CB 4.43Å; V129-L144 HydrophobicContact CG1-CD1 3.51Å; L131-L144 HydrophobicContact CD2-CD1 4.1Å; L131-L144 HydrophobicContact CD2-CD2 4.1Å; L131-L144 HydrophobicContact CG-CD1 4.27Å; L131-L144 HydrophobicContact CG-CD2 4.31Å; F138-L144 HydrophobicContact CB-CB 3.98Å; F138-L144 HydrophobicContact CD2-CB 3.75Å; F138-L144 HydrophobicContact CD2-CD1 4Å; F138-L144 HydrophobicContact CD2-CG 3.72Å; F138-L144 HydrophobicContact CE2-CB 4.47Å; F138-L144 HydrophobicContact CE2-CG 4.12Å; F138-L144 HydrophobicContact CG-CB 3.91Å; F138-L144 HydrophobicContact CG-CG 4.4Å; D140-L144 PolarHBondContact O-N 3.13Å; L144-C146 VanDerWaalsContact C-N 3.35Å; L144-C146 PolarHBondContact O-N 3.49Å; L144-A147 WeakPolarHBondContact O-CB 3.34Å; L144-A147 PolarHBondContact O-N 2.84Å; L144-A147 VanDerWaalsContact O-N 3.11Å; L144-Y148 HydrophobicContact CD2-CD2 3.59Å; L144-Y148 HydrophobicContact CD2-CE2 3.92Å; L144-Y148 HydrophobicContact CG-CD2 3.85Å; L144-Y148 HydrophobicContact CG-CE2 3.88Å; L144-Y148 WeakPolarHBondContact O-CD2 3.4Å; L144-Y148 PolarHBondContact O-N 3.33Å
145	I	93.1	Very high	87.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64	-39	-179	-66.9	163.9	0	0	0	111.5	L62 W69 F91 V93 L141 V142 A147 Y148 C149 L159	L62-I145 HydrophobicContact CD1-CB 4.46Å; L62-I145 HydrophobicContact CD1-CG2 3.86Å; L62-I145 HydrophobicContact CD2-CG2 3.54Å; L62-I145 HydrophobicContact CG-CG2 4.38Å; W69-I145 HydrophobicContact CD2-CD1 4.49Å; W69-I145 HydrophobicContact CE3-CD1 3.7Å; W69-I145 HydrophobicContact CH2-CD1 3.69Å; W69-I145 HydrophobicContact CZ2-CD1 4.46Å; W69-I145 HydrophobicContact CZ3-CD1 3.24Å; F91-I145 HydrophobicContact CE1-CG2 4.33Å; F91-I145 HydrophobicContact CE2-CD1 4.15Å; F91-I145 HydrophobicContact CE2-CG1 4.45Å; F91-I145 HydrophobicContact CE2-CG2 3.8Å; F91-I145 HydrophobicContact CZ-CG2 3.49Å; F91-I145 VanDerWaalsContact CZ-CG2 3.49Å; V93-I145 HydrophobicContact CG2-CD1 4.07Å; L141-I145 HydrophobicContact CD1-CD1 4.02Å; L141-I145 HydrophobicContact CD1-CG1 4.34Å; L141-I145 HydrophobicContact CG-CD1 3.96Å; L141-I145 WeakPolarHBondContact O-CD1 3.48Å; L141-I145 VanDerWaalsContact O-CG1 3.28Å; L141-I145 WeakPolarHBondContact O-CG1 3.48Å; L141-I145 PolarHBondContact O-N 2.67Å; V142-I145 PolarHBondContact O-N 2.96Å; I145-A147 VanDerWaalsContact C-N 3.31Å; I145-A147 PolarHBondContact O-N 2.99Å; I145-Y148 PolarHBondContact O-N 3.13Å; I145-C149 WeakPolarHBondContact O-CB 3.29Å; I145-C149 PolarHBondContact O-N 3.38Å; I145-C149 PolarHBondContact O-SG 3.27Å; I145-L159 HydrophobicContact CB-CD1 4.36Å; I145-L159 HydrophobicContact CG1-CD1 4.35Å; I145-L159 HydrophobicContact CG2-CD1 4.02Å
146	C	91.4	Very high	86.7	Confident	15 Å²	15	53.1 Å²	53.1	10%	0.101	28%	0.275	C	S	.	.	H	α-helix	trans	-57.1	-42.5	172.4	-78.7	0	0	0	0	112.3	L62 V142 Q143 L144 H150	L62-C146 VanDerWaalsContact CD1-SG 3.5Å; V142-C146 VanDerWaalsContact O-CB 3.29Å; V142-C146 WeakPolarHBondContact O-CB 3.32Å; V142-C146 PolarHBondContact O-N 3.12Å; V142-C146 PolarHBondContact O-SG 2.86Å; Q143-C146 PolarHBondContact O-N 3.34Å; L144-C146 VanDerWaalsContact C-N 3.35Å; L144-C146 PolarHBondContact O-N 3.49Å; C146-H150 PolarHBondContact O-ND1 2.88Å
147	A	87.9	Confident	86.3	Confident	24 Å²	24	52 Å²	52	20%	0.198	27%	0.269	C	S	.	.	H	α-helix	trans	-67.5	-52.5	178.4	0	0	0	0	0	111	F138 Q143 L144 I145 C149 H150 T151	F138-A147 HydrophobicContact CD1-CB 4.11Å; F138-A147 HydrophobicContact CE1-CB 3.26Å; F138-A147 HydrophobicContact CZ-CB 3.58Å; Q143-A147 WeakPolarHBondContact O-CB 3.41Å; Q143-A147 PolarHBondContact O-N 3Å; L144-A147 WeakPolarHBondContact O-CB 3.34Å; L144-A147 PolarHBondContact O-N 2.84Å; L144-A147 VanDerWaalsContact O-N 3.11Å; I145-A147 VanDerWaalsContact C-N 3.31Å; I145-A147 PolarHBondContact O-N 2.99Å; A147-C149 PolarHBondContact O-N 2.99Å; A147-C149 VanDerWaalsContact O-N 3.16Å; A147-H150 WeakPolarHBondContact O-CA 3.4Å; A147-H150 PolarHBondContact O-N 3.44Å; A147-T151 PolarHBondContact O-N 3.25Å; A147-T151 PolarHBondContact O-OG1 3.19Å; A147-T151 VanDerWaalsContact O-OG1 3.08Å
148	Y	87.3	Confident	86.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-68.5	-8.9	179.6	-78.1	-81.6	0	0	0	114.6	L131 S134 F138 L144 I145 H150 T151 R152 D153 I154 L155 P158 L159	L131-Y148 HydrophobicContact CD1-CD1 4.48Å; L131-Y148 HydrophobicContact CD1-CD2 4.36Å; L131-Y148 HydrophobicContact CD1-CE1 3.87Å; L131-Y148 HydrophobicContact CD1-CE2 3.8Å; L131-Y148 HydrophobicContact CG-CE2 3.96Å; S134-Y148 VanDerWaalsContact CB-OH 3.26Å; S134-Y148 WeakPolarHBondContact CB-OH 3.22Å; S134-Y148 PolarHBondContact OG-OH 2.92Å; F138-Y148 HydrophobicContact CE2-CD2 4.32Å; F138-Y148 AromaticContact CE2-CE2 3.76Å; F138-Y148 HydrophobicContact CE2-CE2 3.76Å; F138-Y148 HydrophobicContact CZ-CE2 4.29Å; L144-Y148 HydrophobicContact CD2-CD2 3.59Å; L144-Y148 HydrophobicContact CD2-CE2 3.92Å; L144-Y148 HydrophobicContact CG-CD2 3.85Å; L144-Y148 HydrophobicContact CG-CE2 3.88Å; L144-Y148 WeakPolarHBondContact O-CD2 3.4Å; L144-Y148 PolarHBondContact O-N 3.33Å; I145-Y148 PolarHBondContact O-N 3.13Å; Y148-H150 VanDerWaalsContact C-N 3.3Å; Y148-T151 CarbonylContact C-O 3.6Å; Y148-T151 VanDerWaalsContact O-O 3.08Å; Y148-R152 WeakPolarHBondContact CD1-O 3.47Å; Y148-R152 WeakPolarHBondContact CE1-O 3.27Å; Y148-D153 HydrophobicContact CE1-CB 3.76Å; Y148-D153 PolarHBondContact OH-OD2 2.83Å; Y148-D153 VanDerWaalsContact OH-OD2 3.07Å; Y148-I154 HydrophobicContact CE1-CG1 4.43Å; Y148-L155 HydrophobicContact CD1-CD1 3.29Å; Y148-L155 HydrophobicContact CD1-CG 3.65Å; Y148-L155 HydrophobicContact CE1-CD1 3.87Å; Y148-L155 HydrophobicContact CE1-CG 3.74Å; Y148-L155 HydrophobicContact CG-CD1 3.88Å; Y148-P158 CarbonylContact O-C 3.47Å; Y148-P158 WeakPolarHBondContact O-CA 3.22Å; Y148-L159 VanDerWaalsContact CB-CD1 3.47Å; Y148-L159 PolarHBondContact O-N 3.23Å
149	C	88.2	Confident	86	Confident	23 Å²	23	47.2 Å²	47.2	16%	0.155	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-18.7	163.4	-76.3	0	0	0	0	113.3	L58 I145 A147 L159	L58-C149 HydrophobicContact CD2-CB 3.75Å; I145-C149 WeakPolarHBondContact O-CB 3.29Å; I145-C149 PolarHBondContact O-N 3.38Å; I145-C149 PolarHBondContact O-SG 3.27Å; A147-C149 PolarHBondContact O-N 2.99Å; A147-C149 VanDerWaalsContact O-N 3.16Å; C149-L159 WeakPolarHBondContact CA-O 3.44Å
150	H	81.3	Confident	86	Confident	150 Å²	150	46.5 Å²	46.5	69%	0.694	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.9	-39	-177.7	-61.7	95.9	0	0	0	112.7	L58 C146 A147 Y148	L58-H150 VanDerWaalsContact CD2-CE1 3.46Å; L58-H150 WeakPolarHBondContact CD2-CE1 3.29Å; C146-H150 PolarHBondContact O-ND1 2.88Å; A147-H150 WeakPolarHBondContact O-CA 3.4Å; A147-H150 PolarHBondContact O-N 3.44Å; Y148-H150 VanDerWaalsContact C-N 3.3Å
151	T	75.6	Confident	85.9	Confident	64 Å²	64	45 Å²	45	39%	0.393	23%	0.227	S	C	.	.			trans	-97	168.1	174.5	60.2	0	0	0	0	111	A147 Y148	A147-T151 PolarHBondContact O-N 3.25Å; A147-T151 PolarHBondContact O-OG1 3.19Å; A147-T151 VanDerWaalsContact O-OG1 3.08Å; Y148-T151 CarbonylContact C-O 3.6Å; Y148-T151 VanDerWaalsContact O-O 3.08Å
152	R	75.9	Confident	85.8	Confident	145 Å²	145	44.4 Å²	44.4	55%	0.547	23%	0.225	S	C	.	.			trans	-106.9	-50	171.7	-69.7	-169.4	-163.9	-166.2	5.9	111.1	Y148 I154 L155 L156	Y148-R152 WeakPolarHBondContact CD1-O 3.47Å; Y148-R152 WeakPolarHBondContact CE1-O 3.27Å; R152-I154 PolarHBondContact O-N 3.48Å; R152-L155 WeakPolarHBondContact CB-O 3.37Å; R152-L155 WeakPolarHBondContact O-CB 3.39Å; R152-L155 PolarHBondContact O-N 2.91Å; R152-L156 PolarHBondContact NH1-O 3.46Å
153	D	84	Confident	85.3	Confident	78 Å²	78	49.9 Å²	49.9	42%	0.417	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	-120.3	-174.6	-174.6	66.6	0	0	0	109.8	S134 L136 Y148 L155	S134-D153 VanDerWaalsContact CB-OD2 3.3Å; S134-D153 WeakPolarHBondContact CB-OD2 3.44Å; S134-D153 PolarHBondContact OG-OD2 2.96Å; L136-D153 HydrophobicContact CD1-CB 3.84Å; Y148-D153 HydrophobicContact CE1-CB 3.76Å; Y148-D153 PolarHBondContact OH-OD2 2.83Å; Y148-D153 VanDerWaalsContact OH-OD2 3.07Å; D153-L155 VanDerWaalsContact C-N 3.3Å; D153-L155 PolarHBondContact O-N 3.35Å
154	I	81.7	Confident	85	Confident	59 Å²	59	47.3 Å²	47.3	30%	0.303	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-12.6	176.2	64.1	167.2	0	0	0	115.3	L131 E132 G133 Y148 R152	L131-I154 HydrophobicContact CB-CD1 3.68Å; L131-I154 HydrophobicContact CD1-CD1 4.18Å; L131-I154 HydrophobicContact CD1-CG1 4.38Å; E132-I154 WeakPolarHBondContact O-CD1 3.5Å; G133-I154 WeakPolarHBondContact O-CG2 3.41Å; Y148-I154 HydrophobicContact CE1-CG1 4.43Å; R152-I154 PolarHBondContact O-N 3.48Å
155	L	80.8	Confident	84.8	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.026	24%	0.235	C	C	.	.	S	Bend	trans	-85.4	137.8	-175.1	-54.5	-177.2	0	0	0	112.5	L104 M106 H120 L131 Y148 R152 D153 L157 L159	L104-L155 HydrophobicContact CD2-CD1 4.2Å; M106-L155 HydrophobicContact CE-CB 4.1Å; M106-L155 HydrophobicContact CE-CD1 3.69Å; M106-L155 HydrophobicContact CE-CG 4.36Å; H120-L155 WeakPolarHBondContact CE1-CD2 3.31Å; H120-L155 WeakPolarHBondContact ND1-CD2 3.21Å; L131-L155 HydrophobicContact CD1-CD1 4.4Å; L131-L155 HydrophobicContact CD1-CD2 3.92Å; L131-L155 HydrophobicContact CD1-CG 4.33Å; Y148-L155 HydrophobicContact CD1-CD1 3.29Å; Y148-L155 HydrophobicContact CD1-CG 3.65Å; Y148-L155 HydrophobicContact CE1-CD1 3.87Å; Y148-L155 HydrophobicContact CE1-CG 3.74Å; Y148-L155 HydrophobicContact CG-CD1 3.88Å; R152-L155 WeakPolarHBondContact CB-O 3.37Å; R152-L155 WeakPolarHBondContact O-CB 3.39Å; R152-L155 PolarHBondContact O-N 2.91Å; D153-L155 VanDerWaalsContact C-N 3.3Å; D153-L155 PolarHBondContact O-N 3.35Å; L155-L157 WeakPolarHBondContact CB-O 3.43Å; L155-L157 PolarHBondContact O-N 2.88Å; L155-L159 HydrophobicContact CD1-CD2 4.21Å; L155-L159 HydrophobicContact CD1-CG 4.15Å
156	L	71.7	Confident	84.5	Confident	111 Å²	111	52.5 Å²	52.5	58%	0.581	26%	0.259	S	S	*	.	S	Bend	trans	-62.2	-29.2	178.1	-64.5	176.7	0	0	0	113.5	L108 R152	L108-L156 HydrophobicContact CD1-CD1 4.15Å; L108-L156 HydrophobicContact CD2-CB 4.34Å; L108-L156 HydrophobicContact CD2-CD1 3.93Å; R152-L156 PolarHBondContact NH1-O 3.46Å
157	L	77.8	Confident	84.1	Confident	38 Å²	38	56.9 Å²	56.9	20%	0.199	27%	0.274	C	S	.	.	S	Bend	trans	-134.1	154.3	179	-64.3	175.6	0	0	0	109.8	P88 M106 P109 L155	P88-L157 HydrophobicContact CB-CD1 3.68Å; M106-L157 WeakPolarHBondContact CE-O 3.2Å; M106-L157 HydrophobicContact SD-CB 3.96Å; P109-L157 HydrophobicContact CG-CD1 4.23Å; L155-L157 WeakPolarHBondContact CB-O 3.43Å; L155-L157 PolarHBondContact O-N 2.88Å
158	P	86.9	Confident	83.9	Confident	29 Å²	29	56 Å²	56	19%	0.188	27%	0.266	C	S	.	.			trans	-70.2	147.8	164.7	32.4	-33.6	0	0	0	109.9	Y148	Y148-P158 CarbonylContact O-C 3.47Å; Y148-P158 WeakPolarHBondContact O-CA 3.22Å
159	L	88.9	Confident	83.5	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.021	29%	0.293	C	S	.	.			trans	-63.1	140.6	175.8	-63.4	172.5	0	0	0	111.1	G89 F91 L104 M106 I145 Y148 C149 L155	G89-L159 CarbonylContact O-C 3.54Å; G89-L159 WeakPolarHBondContact O-CA 3.33Å; F91-L159 HydrophobicContact CB-CD2 3.58Å; F91-L159 HydrophobicContact CD1-CB 3.77Å; F91-L159 HydrophobicContact CD1-CD2 3.83Å; F91-L159 HydrophobicContact CD1-CG 4.28Å; F91-L159 HydrophobicContact CD2-CD2 4.29Å; F91-L159 HydrophobicContact CE1-CB 3.97Å; F91-L159 HydrophobicContact CG-CB 4.42Å; F91-L159 HydrophobicContact CG-CD2 3.63Å; F91-L159 HydrophobicContact CG-CG 4.45Å; L104-L159 HydrophobicContact CD1-CD1 4.42Å; L104-L159 HydrophobicContact CD1-CD2 4.06Å; L104-L159 HydrophobicContact CD2-CD1 4.2Å; L104-L159 HydrophobicContact CD2-CD2 4.14Å; L104-L159 HydrophobicContact CG-CD2 4.4Å; M106-L159 HydrophobicContact CE-CD2 3.41Å; M106-L159 VanDerWaalsContact CE-CD2 3.41Å; M106-L159 HydrophobicContact CE-CG 4.15Å; I145-L159 HydrophobicContact CB-CD1 4.36Å; I145-L159 HydrophobicContact CG1-CD1 4.35Å; I145-L159 HydrophobicContact CG2-CD1 4.02Å; Y148-L159 VanDerWaalsContact CB-CD1 3.47Å; Y148-L159 PolarHBondContact O-N 3.23Å; C149-L159 WeakPolarHBondContact CA-O 3.44Å; L155-L159 HydrophobicContact CD1-CD2 4.21Å; L155-L159 HydrophobicContact CD1-CG 4.15Å
160	Q	90.6	Very high	83.4	Confident	96 Å²	96	61.3 Å²	61.3	45%	0.449	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-127.2	129	177	-61.2	-167.1	17.3	0	0	111.5	G89 T90 F91	G89-Q160 PolarHBondContact O-N 3.35Å; T90-Q160 WeakPolarHBondContact CA-O 3.5Å; F91-Q160 WeakPolarHBondContact CD1-O 3.49Å
161	L	89.3	Confident	83.7	Confident	17 Å²	17	58.7 Å²	58.7	9%	0.089	29%	0.293	C	S	.	.			trans	-69.4	142.7	169.9	-76	173.5	0	0	0	111	L58 R61 L62 F91 I165	L58-L161 HydrophobicContact CD1-CD1 3.49Å; L58-L161 VanDerWaalsContact CD1-CD1 3.49Å; L58-L161 HydrophobicContact CD1-CG 4.4Å; R61-L161 HydrophobicContact CB-CD1 4.22Å; L62-L161 HydrophobicContact CD2-CD2 3.76Å; L62-L161 HydrophobicContact CD2-CG 4.5Å; L62-L161 HydrophobicContact CG-CD1 4.41Å; L62-L161 HydrophobicContact CG-CD2 4.42Å; F91-L161 HydrophobicContact CE1-CD2 4.25Å; F91-L161 HydrophobicContact CZ-CD2 4.19Å; L161-I165 HydrophobicContact CB-CG2 4.45Å; L161-I165 HydrophobicContact CD1-CG2 4.04Å; L161-I165 HydrophobicContact CD2-CG2 4.19Å; L161-I165 HydrophobicContact CG-CG2 4.48Å
162	P	89.3	Confident	84.3	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.013	31%	0.308	C	S	.	.			trans	-49.3	141.8	169.5	-29.9	36.1	0	0	0	112.8	T90 A164 I165 H166 F184 W185	T90-P162 HydrophobicContact CG2-CG 4.23Å; P162-A164 PolarHBondContact O-N 3.33Å; P162-A164 VanDerWaalsContact O-N 3.09Å; P162-I165 HydrophobicContact CB-CD1 4.27Å; P162-I165 HydrophobicContact CG-CD1 4.14Å; P162-I165 PolarHBondContact O-N 2.99Å; P162-H166 PolarHBondContact O-N 2.86Å; P162-F184 HydrophobicContact CB-CE1 3.53Å; P162-F184 HydrophobicContact CB-CZ 3.64Å; P162-F184 HydrophobicContact CG-CE1 3.84Å; P162-F184 HydrophobicContact CG-CZ 4.4Å; P162-W185 HydrophobicContact CB-CZ3 4.5Å; P162-W185 HydrophobicContact CG-CE3 4.49Å; P162-W185 HydrophobicContact CG-CH2 3.48Å; P162-W185 VanDerWaalsContact CG-CH2 3.48Å; P162-W185 HydrophobicContact CG-CZ2 4.34Å; P162-W185 HydrophobicContact CG-CZ3 3.55Å
163	R	83.4	Confident	84.9	Confident	120 Å²	120	60.2 Å²	60.2	45%	0.453	30%	0.299	S	S	.	.	H	α-helix	trans	-58.8	-31.3	-168.7	-72.1	-173.8	-177.5	169.7	3.3	114.2	R167 A193 Q194	R163-R167 WeakPolarHBondContact O-CB 3.34Å; R163-R167 WeakPolarHBondContact O-CG 3.27Å; R163-R167 PolarHBondContact O-N 3.1Å; R163-A193 HydrophobicContact CB-CB 4.1Å; R163-A193 WeakPolarHBondContact CD-O 3.16Å; R163-Q194 PolarHBondContact NH1-O 3.07Å
164	A	86.4	Confident	85.2	Confident	13 Å²	13	56.5 Å²	56.5	11%	0.107	28%	0.279	C	S	.	.	H	α-helix	trans	-65	-46.4	174.9	0	0	0	0	0	111.8	P162 H166 R167 A168 I177 F184 A193	P162-A164 PolarHBondContact O-N 3.33Å; P162-A164 VanDerWaalsContact O-N 3.09Å; A164-H166 VanDerWaalsContact C-N 3.32Å; A164-H166 PolarHBondContact O-N 3.45Å; A164-R167 PolarHBondContact O-N 3.45Å; A164-A168 PolarHBondContact O-N 3.21Å; A164-I177 HydrophobicContact CB-CD1 4.19Å; A164-F184 HydrophobicContact CB-CE2 3.81Å; A164-F184 HydrophobicContact CB-CZ 3.97Å; A164-A193 HydrophobicContact CB-CB 3.88Å
165	I	89	Confident	85.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65.2	-37.2	178.3	-60.3	173.1	0	0	0	111	R61 T65 V68 L161 P162 L174 I177 F184	R61-I165 HydrophobicContact CB-CG2 4.35Å; R61-I165 PolarHBondContact NH1-O 3.49Å; T65-I165 HydrophobicContact CG2-CD1 4.21Å; T65-I165 HydrophobicContact CG2-CG1 4.07Å; T65-I165 HydrophobicContact CG2-CG2 3.84Å; V68-I165 HydrophobicContact CB-CD1 4.34Å; V68-I165 HydrophobicContact CG1-CD1 3.98Å; L161-I165 HydrophobicContact CB-CG2 4.45Å; L161-I165 HydrophobicContact CD1-CG2 4.04Å; L161-I165 HydrophobicContact CD2-CG2 4.19Å; L161-I165 HydrophobicContact CG-CG2 4.48Å; P162-I165 HydrophobicContact CB-CD1 4.27Å; P162-I165 HydrophobicContact CG-CD1 4.14Å; P162-I165 PolarHBondContact O-N 2.99Å; I165-L174 HydrophobicContact CG2-CD2 4.02Å; I165-I177 HydrophobicContact CD1-CG2 4.2Å; I165-I177 HydrophobicContact CG1-CG2 3.75Å; I165-F184 HydrophobicContact CD1-CE1 4.39Å; I165-F184 HydrophobicContact CD1-CZ 4.32Å; I165-F184 HydrophobicContact CG1-CE2 4.39Å; I165-F184 HydrophobicContact CG1-CZ 4.26Å
166	H	86.3	Confident	86	Confident	110 Å²	110	59.7 Å²	59.7	51%	0.509	30%	0.302	S	S	.	.	H	α-helix	trans	-71.4	-38.7	175.8	-175.1	78.8	0	0	0	112.8	R61 P162 A164	R61-H166 PolarHBondContact NH1-O 3.13Å; P162-H166 PolarHBondContact O-N 2.86Å; A164-H166 VanDerWaalsContact C-N 3.32Å; A164-H166 PolarHBondContact O-N 3.45Å
167	R	83.2	Confident	86.9	Confident	107 Å²	107	54.9 Å²	54.9	40%	0.404	28%	0.277	S	S	.	.	H	α-helix	trans	-82	-20.8	-177.2	-77.4	175.4	155	173.8	-13.5	114.8	R163 A164 A169 A193 P197 G199	R163-R167 WeakPolarHBondContact O-CB 3.34Å; R163-R167 WeakPolarHBondContact O-CG 3.27Å; R163-R167 PolarHBondContact O-N 3.1Å; A164-R167 PolarHBondContact O-N 3.45Å; R167-A169 PolarHBondContact O-N 3.11Å; R167-A193 PolarHBondContact NH1-O 2.74Å; R167-P197 PolarHBondContact NH2-O 3.19Å; R167-P197 VanDerWaalsContact NH2-O 3.1Å; R167-G199 PolarHBondContact NH2-O 3.13Å
168	A	85.3	Confident	87.6	Confident	4 Å²	4	54.1 Å²	54.1	3%	0.033	28%	0.275	C	S	.	.			trans	-52.4	125.3	-178.8	0	0	0	0	0	111.8	R61 A164 E173 L174 I177	R61-A168 VanDerWaalsContact CZ-O 3.26Å; R61-A168 PolarHBondContact NH1-O 2.93Å; R61-A168 PolarHBondContact NH2-O 3.1Å; A164-A168 PolarHBondContact O-N 3.21Å; A168-E173 VanDerWaalsContact CA-OE2 3.24Å; A168-E173 WeakPolarHBondContact CA-OE2 3.32Å; A168-E173 HydrophobicContact CB-CB 3.83Å; A168-L174 HydrophobicContact CB-CD2 3.74Å; A168-L174 HydrophobicContact CB-CG 3.84Å; A168-I177 HydrophobicContact CB-CD1 4.36Å
169	A	78.8	Confident	87.8	Confident	69 Å²	69	60.6 Å²	60.6	57%	0.57	30%	0.302	S	S	*	.			trans	-86.1	-36.2	-175.1	0	0	0	0	0	112.1	R167 E173	R167-A169 PolarHBondContact O-N 3.11Å; A169-E173 PolarHBondContact N-OE2 2.81Å
170	T	84.9	Confident	87.8	Confident	67 Å²	67	63.3 Å²	63.3	41%	0.411	32%	0.317	S	S	.	.	S	Bend	trans	-112.6	162.5	-175.2	70.1	0	0	0	0	113.9	K172 E173 L174	T170-K172 VanDerWaalsContact C-N 3.3Å; T170-K172 PolarHBondContact O-N 3.35Å; T170-E173 VanDerWaalsContact CB-OE1 3.25Å; T170-E173 WeakPolarHBondContact CB-OE1 3.12Å; T170-E173 VanDerWaalsContact CG2-OE1 3.29Å; T170-E173 WeakPolarHBondContact CG2-OE1 3.4Å; T170-E173 PolarHBondContact N-OE1 3.29Å; T170-E173 PolarHBondContact O-N 3.31Å; T170-E173 WeakPolarHBondContact OG1-CG 3.19Å; T170-E173 PolarHBondContact OG1-N 3.5Å; T170-E173 PolarHBondContact OG1-OE1 2.99Å; T170-L174 PolarHBondContact O-N 3.2Å
171	H	88.5	Confident	87.7	Confident	94 Å²	94	59.3 Å²	59.3	44%	0.435	30%	0.302	S	S	.	.	H	α-helix	trans	-57.7	-42.2	171.1	-165.3	-83.6	0	0	0	111.8	L64 E173 L174 E175	L64-H171 WeakPolarHBondContact CD2-NE2 3.4Å; H171-E173 VanDerWaalsContact C-N 3.34Å; H171-E173 PolarHBondContact O-N 2.99Å; H171-L174 WeakPolarHBondContact O-CA 3.48Å; H171-L174 WeakPolarHBondContact O-CB 3.49Å; H171-L174 PolarHBondContact O-N 3.4Å; H171-E175 IonicContact CE1-OE1 2.7Å; H171-E175 PolarHBondContact CE1-OE1 2.96Å; H171-E175 IonicContact CE1-OE2 3.22Å; H171-E175 IonicContact CG-OE2 3.3Å; H171-E175 IonicContact ND1-OE1 3.87Å; H171-E175 PolarHBondContact ND1-OE1 2.74Å; H171-E175 IonicContact ND1-OE2 3.21Å; H171-E175 PolarHBondContact ND1-OE2 3.25Å; H171-E175 WeakPolarHBondContact O-CG 3.24Å; H171-E175 PolarHBondContact O-N 2.88Å
172	K	87.5	Confident	87.5	Confident	166 Å²	166	61.8 Å²	61.8	72%	0.722	31%	0.314	S	S	*	.	H	α-helix	trans	-63.2	-35.1	-179	-65.7	-171.4	175.2	-171.4	0	113.5	T170 E175 A176	T170-K172 VanDerWaalsContact C-N 3.3Å; T170-K172 PolarHBondContact O-N 3.35Å; K172-E175 VanDerWaalsContact CA-OE2 3.31Å; K172-E175 WeakPolarHBondContact CA-OE2 3.47Å; K172-E175 PolarHBondContact N-OE2 2.94Å; K172-A176 WeakPolarHBondContact O-CB 3.5Å; K172-A176 PolarHBondContact O-N 3.37Å
173	E	87.6	Confident	87.5	Confident	75 Å²	75	67.1 Å²	67.1	35%	0.35	34%	0.339	S	S	.	.	H	α-helix	trans	-66	-38.4	172.6	-71.8	154.6	-108.9	0	0	111.8	A168 A169 T170 H171 I177	A168-E173 VanDerWaalsContact CA-OE2 3.24Å; A168-E173 WeakPolarHBondContact CA-OE2 3.32Å; A168-E173 HydrophobicContact CB-CB 3.83Å; A169-E173 PolarHBondContact N-OE2 2.81Å; T170-E173 VanDerWaalsContact CB-OE1 3.25Å; T170-E173 WeakPolarHBondContact CB-OE1 3.12Å; T170-E173 VanDerWaalsContact CG2-OE1 3.29Å; T170-E173 WeakPolarHBondContact CG2-OE1 3.4Å; T170-E173 PolarHBondContact N-OE1 3.29Å; T170-E173 PolarHBondContact O-N 3.31Å; T170-E173 WeakPolarHBondContact OG1-CG 3.19Å; T170-E173 PolarHBondContact OG1-N 3.5Å; T170-E173 PolarHBondContact OG1-OE1 2.99Å; H171-E173 VanDerWaalsContact C-N 3.34Å; H171-E173 PolarHBondContact O-N 2.99Å; E173-I177 WeakPolarHBondContact O-CB 3.47Å; E173-I177 WeakPolarHBondContact O-CD1 3.38Å; E173-I177 VanDerWaalsContact O-CG1 3.25Å; E173-I177 WeakPolarHBondContact O-CG1 3.46Å; E173-I177 PolarHBondContact O-N 2.81Å
174	L	90.6	Very high	87.9	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-72.2	-35.6	177.8	-67.3	163.7	0	0	0	111.9	V56 R61 L64 T65 I165 A168 T170 H171 I177 S178	V56-L174 HydrophobicContact CB-CD1 4.22Å; V56-L174 HydrophobicContact CG1-CD1 3.7Å; V56-L174 HydrophobicContact CG2-CD1 4.38Å; R61-L174 HydrophobicContact CB-CD2 4.47Å; R61-L174 HydrophobicContact CG-CD1 3.81Å; R61-L174 HydrophobicContact CG-CD2 4.12Å; L64-L174 HydrophobicContact CB-CB 4.12Å; L64-L174 HydrophobicContact CD1-CB 4.02Å; L64-L174 HydrophobicContact CD1-CD1 3.98Å; T65-L174 HydrophobicContact CG2-CB 4.3Å; T65-L174 HydrophobicContact CG2-CD2 3.79Å; I165-L174 HydrophobicContact CG2-CD2 4.02Å; A168-L174 HydrophobicContact CB-CD2 3.74Å; A168-L174 HydrophobicContact CB-CG 3.84Å; T170-L174 PolarHBondContact O-N 3.2Å; H171-L174 WeakPolarHBondContact O-CA 3.48Å; H171-L174 WeakPolarHBondContact O-CB 3.49Å; H171-L174 PolarHBondContact O-N 3.4Å; L174-I177 PolarHBondContact O-N 2.83Å; L174-S178 VanDerWaalsContact O-CB 3.3Å; L174-S178 WeakPolarHBondContact O-CB 3.4Å; L174-S178 PolarHBondContact O-N 2.87Å
175	E	90.8	Very high	88	Confident	74 Å²	74	61.5 Å²	61.5	35%	0.346	32%	0.315	S	S	.	.	H	α-helix	trans	-63.5	-48.4	170.4	-71	166.4	128.2	0	0	111.1	H171 K172 I177 S178 H179	H171-E175 IonicContact CE1-OE1 2.7Å; H171-E175 PolarHBondContact CE1-OE1 2.96Å; H171-E175 IonicContact CE1-OE2 3.22Å; H171-E175 IonicContact CG-OE2 3.3Å; H171-E175 IonicContact ND1-OE1 3.87Å; H171-E175 PolarHBondContact ND1-OE1 2.74Å; H171-E175 IonicContact ND1-OE2 3.21Å; H171-E175 PolarHBondContact ND1-OE2 3.25Å; H171-E175 WeakPolarHBondContact O-CG 3.24Å; H171-E175 PolarHBondContact O-N 2.88Å; K172-E175 VanDerWaalsContact CA-OE2 3.31Å; K172-E175 WeakPolarHBondContact CA-OE2 3.47Å; K172-E175 PolarHBondContact N-OE2 2.94Å; E175-I177 VanDerWaalsContact C-N 3.29Å; E175-I177 PolarHBondContact O-N 3.41Å; E175-S178 WeakPolarHBondContact O-CA 3.45Å; E175-S178 VanDerWaalsContact O-CB 3.27Å; E175-S178 WeakPolarHBondContact O-CB 3.5Å; E175-S178 PolarHBondContact O-N 2.95Å; E175-H179 PolarHBondContact O-CD2 3.03Å; E175-H179 PolarHBondContact O-N 2.69Å
176	A	89.4	Confident	87.8	Confident	57 Å²	57	64.8 Å²	64.8	47%	0.471	34%	0.338	S	S	.	.	H	α-helix	trans	-59.5	-37.5	175.7	0	0	0	0	0	112.8	K172	K172-A176 WeakPolarHBondContact O-CB 3.5Å; K172-A176 PolarHBondContact O-N 3.37Å
177	I	90.6	Very high	87.8	Confident	10 Å²	10	60.4 Å²	60.4	5%	0.051	32%	0.32	C	S	.	.	H	α-helix	trans	-69.1	-38.8	172	-70.9	163.4	0	0	0	111.4	T65 V68 A164 I165 A168 E173 L174 E175 H179 L180 F184	T65-I177 HydrophobicContact CG2-CG2 4.1Å; V68-I177 HydrophobicContact CG2-CG2 4.12Å; V68-I177 WeakPolarHBondContact CG2-O 3.22Å; A164-I177 HydrophobicContact CB-CD1 4.19Å; I165-I177 HydrophobicContact CD1-CG2 4.2Å; I165-I177 HydrophobicContact CG1-CG2 3.75Å; A168-I177 HydrophobicContact CB-CD1 4.36Å; E173-I177 WeakPolarHBondContact O-CB 3.47Å; E173-I177 WeakPolarHBondContact O-CD1 3.38Å; E173-I177 VanDerWaalsContact O-CG1 3.25Å; E173-I177 WeakPolarHBondContact O-CG1 3.46Å; E173-I177 PolarHBondContact O-N 2.81Å; L174-I177 PolarHBondContact O-N 2.83Å; E175-I177 VanDerWaalsContact C-N 3.29Å; E175-I177 PolarHBondContact O-N 3.41Å; I177-H179 VanDerWaalsContact C-N 3.35Å; I177-H179 PolarHBondContact O-N 3.22Å; I177-L180 WeakPolarHBondContact O-CB 3.42Å; I177-L180 PolarHBondContact O-N 3.02Å; I177-F184 HydrophobicContact CG2-CD2 3.56Å; I177-F184 HydrophobicContact CG2-CE2 3.8Å; I177-F184 HydrophobicContact CG2-CG 4.36Å
178	S	91.3	Very high	87.5	Confident	22 Å²	22	58.3 Å²	58.3	15%	0.154	32%	0.322	C	S	.	.	H	α-helix	trans	-60.6	-42.1	178.6	-164.2	0	0	0	0	112.5	L64 P67 L174 E175 L180 G181	L64-S178 WeakPolarHBondContact O-CB 3.35Å; L64-S178 PolarHBondContact O-OG 3.46Å; P67-S178 VanDerWaalsContact CD-OG 3.3Å; P67-S178 WeakPolarHBondContact CD-OG 3.42Å; P67-S178 WeakPolarHBondContact CG-OG 3.46Å; L174-S178 VanDerWaalsContact O-CB 3.3Å; L174-S178 WeakPolarHBondContact O-CB 3.4Å; L174-S178 PolarHBondContact O-N 2.87Å; E175-S178 WeakPolarHBondContact O-CA 3.45Å; E175-S178 VanDerWaalsContact O-CB 3.27Å; E175-S178 WeakPolarHBondContact O-CB 3.5Å; E175-S178 PolarHBondContact O-N 2.95Å; S178-L180 PolarHBondContact O-N 3.47Å; S178-L180 VanDerWaalsContact O-N 3.15Å; S178-G181 PolarHBondContact O-N 3.05Å
179	H	91.4	Very high	87.3	Confident	165 Å²	165	62.5 Å²	62.5	76%	0.764	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.7	176.7	-70	-59.7	0	0	0	114.5	E175 I177	E175-H179 PolarHBondContact O-CD2 3.03Å; E175-H179 PolarHBondContact O-N 2.69Å; I177-H179 VanDerWaalsContact C-N 3.35Å; I177-H179 PolarHBondContact O-N 3.22Å
180	L	89.1	Confident	87.5	Confident	61 Å²	61	59.2 Å²	59.2	32%	0.319	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-21.6	174.3	-61.8	173.8	0	0	0	112.9	I177 S178 I182 E183 F184 L189	I177-L180 WeakPolarHBondContact O-CB 3.42Å; I177-L180 PolarHBondContact O-N 3.02Å; S178-L180 PolarHBondContact O-N 3.47Å; S178-L180 VanDerWaalsContact O-N 3.15Å; L180-I182 PolarHBondContact O-N 2.79Å; L180-E183 WeakPolarHBondContact O-CA 3.41Å; L180-E183 WeakPolarHBondContact O-CB 3.34Å; L180-E183 PolarHBondContact O-N 3.06Å; L180-F184 HydrophobicContact CB-CB 4.01Å; L180-F184 HydrophobicContact CD1-CD2 4.48Å; L180-F184 PolarHBondContact O-N 3.42Å; L180-L189 HydrophobicContact CD1-CD1 4.04Å
181	G	88.9	Confident	87	Confident	13 Å²	13	59 Å²	59	13%	0.134	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	-120.4	178.1	0	0	0	0	0	113.4	P67 V68 S178 F184	P67-G181 CarbonylContact O-C 3.47Å; P67-G181 WeakPolarHBondContact O-CA 3.4Å; V68-G181 WeakPolarHBondContact CA-O 3.33Å; S178-G181 PolarHBondContact O-N 3.05Å; G181-F184 VanDerWaalsContact O-CB 3.31Å; G181-F184 WeakPolarHBondContact O-CB 3.48Å; G181-F184 PolarHBondContact O-N 3.4Å
182	I	86.1	Confident	85.8	Confident	69 Å²	69	61.2 Å²	61.2	35%	0.354	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-32	174.9	-171.5	69	0	0	0	112.9	Q71 V82 L180 F184 W185	Q71-I182 HydrophobicContact CG-CD1 3.78Å; V82-I182 HydrophobicContact CG2-CD1 4.49Å; L180-I182 PolarHBondContact O-N 2.79Å; I182-F184 PolarHBondContact O-N 3.06Å; I182-F184 VanDerWaalsContact O-N 3.14Å; I182-W185 VanDerWaalsContact O-CD1 3.26Å; I182-W185 PolarHBondContact O-N 2.82Å; I182-W185 VanDerWaalsContact O-N 3.15Å
183	E	88.7	Confident	84.5	Confident	113 Å²	113	54 Å²	54	53%	0.528	29%	0.292	S	S	.	.	H	α-helix	trans	-72.8	-3.3	177.6	-60.9	-51.2	136.9	0	0	113.1	L180 W185 S186 S187	L180-E183 WeakPolarHBondContact O-CA 3.41Å; L180-E183 WeakPolarHBondContact O-CB 3.34Å; L180-E183 PolarHBondContact O-N 3.06Å; E183-W185 PolarHBondContact O-N 3.17Å; E183-S186 WeakPolarHBondContact CA-OG 3.45Å; E183-S186 PolarHBondContact O-OG 3.3Å; E183-S186 PolarHBondContact OE2-OG 2.76Å; E183-S187 VanDerWaalsContact O-CB 3.28Å; E183-S187 WeakPolarHBondContact O-CB 3.28Å; E183-S187 PolarHBondContact O-N 3.15Å
184	F	92.5	Very high	83	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-56.6	-42.5	164.2	169.6	-95.2	0	0	0	111.4	V68 P162 A164 I165 I177 L180 G181 I182 S186 S187 N190	V68-F184 HydrophobicContact CB-CB 4.46Å; V68-F184 HydrophobicContact CG1-CB 3.67Å; V68-F184 HydrophobicContact CG1-CD1 3.29Å; V68-F184 HydrophobicContact CG1-CE1 4.11Å; V68-F184 HydrophobicContact CG1-CG 3.54Å; V68-F184 HydrophobicContact CG2-CB 4Å; V68-F184 HydrophobicContact CG2-CG 4.29Å; P162-F184 HydrophobicContact CB-CE1 3.53Å; P162-F184 HydrophobicContact CB-CZ 3.64Å; P162-F184 HydrophobicContact CG-CE1 3.84Å; P162-F184 HydrophobicContact CG-CZ 4.4Å; A164-F184 HydrophobicContact CB-CE2 3.81Å; A164-F184 HydrophobicContact CB-CZ 3.97Å; I165-F184 HydrophobicContact CD1-CE1 4.39Å; I165-F184 HydrophobicContact CD1-CZ 4.32Å; I165-F184 HydrophobicContact CG1-CE2 4.39Å; I165-F184 HydrophobicContact CG1-CZ 4.26Å; I177-F184 HydrophobicContact CG2-CD2 3.56Å; I177-F184 HydrophobicContact CG2-CE2 3.8Å; I177-F184 HydrophobicContact CG2-CG 4.36Å; L180-F184 HydrophobicContact CB-CB 4.01Å; L180-F184 HydrophobicContact CD1-CD2 4.48Å; L180-F184 PolarHBondContact O-N 3.42Å; G181-F184 VanDerWaalsContact O-CB 3.31Å; G181-F184 WeakPolarHBondContact O-CB 3.48Å; G181-F184 PolarHBondContact O-N 3.4Å; I182-F184 PolarHBondContact O-N 3.06Å; I182-F184 VanDerWaalsContact O-N 3.14Å; F184-S186 PolarHBondContact O-N 2.72Å; F184-S187 VanDerWaalsContact O-CB 3.28Å; F184-S187 WeakPolarHBondContact O-CB 3.21Å; F184-S187 PolarHBondContact O-N 3.38Å; F184-S187 VanDerWaalsContact O-N 3.1Å; F184-S187 PolarHBondContact O-OG 3.07Å; F184-N190 HydrophobicContact CE1-CB 3.93Å; F184-N190 HydrophobicContact CE2-CB 4.09Å; F184-N190 HydrophobicContact CZ-CB 3.7Å; F184-N190 VanDerWaalsContact O-CB 3.29Å; F184-N190 WeakPolarHBondContact O-CB 3.24Å
185	W	88	Confident	80.9	Confident	16 Å²	16	61.4 Å²	61.4	6%	0.061	32%	0.318	C	S	.	.	H	α-helix	trans	-68.9	-38.1	-171.3	-61.9	100.5	0	0	0	111.8	V68 V82 E86 T90 L92 P162 I182 E183 N190	V68-W185 HydrophobicContact CG1-CZ2 4.21Å; V68-W185 PolarHBondContact O-NE1 3.1Å; V82-W185 HydrophobicContact CG1-CB 3.93Å; V82-W185 HydrophobicContact CG1-CD2 3.43Å; V82-W185 VanDerWaalsContact CG1-CD2 3.43Å; V82-W185 HydrophobicContact CG1-CE3 3.69Å; V82-W185 HydrophobicContact CG1-CG 3.55Å; V82-W185 HydrophobicContact CG1-CZ3 4.35Å; V82-W185 HydrophobicContact CG2-CB 4.41Å; E86-W185 HydrophobicContact CG-CE3 3.9Å; E86-W185 HydrophobicContact CG-CZ3 3.72Å; T90-W185 HydrophobicContact CG2-CH2 3.82Å; T90-W185 HydrophobicContact CG2-CZ3 3.65Å; L92-W185 HydrophobicContact CB-CZ2 4.46Å; P162-W185 HydrophobicContact CB-CZ3 4.5Å; P162-W185 HydrophobicContact CG-CE3 4.49Å; P162-W185 HydrophobicContact CG-CH2 3.48Å; P162-W185 VanDerWaalsContact CG-CH2 3.48Å; P162-W185 HydrophobicContact CG-CZ2 4.34Å; P162-W185 HydrophobicContact CG-CZ3 3.55Å; I182-W185 VanDerWaalsContact O-CD1 3.26Å; I182-W185 PolarHBondContact O-N 2.82Å; I182-W185 VanDerWaalsContact O-N 3.15Å; E183-W185 PolarHBondContact O-N 3.17Å; W185-N190 PolarHBondContact O-ND2 3.01Å
186	S	84.9	Confident	78.4	Confident	69 Å²	69	59.3 Å²	59.3	48%	0.483	32%	0.316	S	S	.	.	H	α-helix	trans	-76.1	-18.9	171.3	53.7	0	0	0	0	113.4	E183 F184	E183-S186 WeakPolarHBondContact CA-OG 3.45Å; E183-S186 PolarHBondContact O-OG 3.3Å; E183-S186 PolarHBondContact OE2-OG 2.76Å; F184-S186 PolarHBondContact O-N 2.72Å
187	S	86.3	Confident	75.8	Confident	18 Å²	18	62.3 Å²	62.3	13%	0.126	33%	0.331	C	S	.	.	S	Bend	trans	-62.3	148.5	-171.1	77.2	0	0	0	0	114.7	E183 F184 L189 N190 I191	E183-S187 VanDerWaalsContact O-CB 3.28Å; E183-S187 WeakPolarHBondContact O-CB 3.28Å; E183-S187 PolarHBondContact O-N 3.15Å; F184-S187 VanDerWaalsContact O-CB 3.28Å; F184-S187 WeakPolarHBondContact O-CB 3.21Å; F184-S187 PolarHBondContact O-N 3.38Å; F184-S187 VanDerWaalsContact O-N 3.1Å; F184-S187 PolarHBondContact O-OG 3.07Å; S187-L189 PolarHBondContact O-N 2.96Å; S187-L189 VanDerWaalsContact O-N 3.15Å; S187-L189 PolarHBondContact OG-N 3.32Å; S187-N190 PolarHBondContact O-N 2.89Å; S187-N190 PolarHBondContact OG-N 3Å; S187-I191 WeakPolarHBondContact O-CG1 3.23Å; S187-I191 PolarHBondContact O-N 2.99Å
188	S	76.7	Confident	73.1	Confident	63 Å²	63	66.3 Å²	66.3	44%	0.441	37%	0.366	S	S	.	.	H	α-helix	trans	-63.7	-18.5	170.7	87.2	0	0	0	0	113.3	K192	S188-K192 WeakPolarHBondContact O-CB 3.43Å; S188-K192 VanDerWaalsContact O-CD 3.32Å; S188-K192 WeakPolarHBondContact O-CD 3.38Å; S188-K192 WeakPolarHBondContact O-CG 3.24Å; S188-K192 PolarHBondContact O-N 2.94Å; S188-K192 PolarHBondContact OG-NZ 3.15Å
189	L	80.7	Confident	70.3	Confident	91 Å²	91	68 Å²	68	48%	0.476	39%	0.386	S	S	.	.	H	α-helix	trans	-69.2	-46.8	175	-64.7	-179.1	0	0	0	111.2	L180 S187 A193	L180-L189 HydrophobicContact CD1-CD1 4.04Å; S187-L189 PolarHBondContact O-N 2.96Å; S187-L189 VanDerWaalsContact O-N 3.15Å; S187-L189 PolarHBondContact OG-N 3.32Å; L189-A193 WeakPolarHBondContact O-CB 3.41Å; L189-A193 PolarHBondContact O-N 2.69Å
190	N	82.4	Confident	67.5	Low	1 Å²	1	62.6 Å²	62.6	1%	0.005	38%	0.375	C	S	.	.	H	α-helix	trans	-62.3	-51.9	175.4	-173.3	36.8	0	0	0	110.7	E86 F184 W185 S187 K192 A193 Q194	E86-N190 PolarHBondContact OE1-ND2 3.44Å; F184-N190 HydrophobicContact CE1-CB 3.93Å; F184-N190 HydrophobicContact CE2-CB 4.09Å; F184-N190 HydrophobicContact CZ-CB 3.7Å; F184-N190 VanDerWaalsContact O-CB 3.29Å; F184-N190 WeakPolarHBondContact O-CB 3.24Å; W185-N190 PolarHBondContact O-ND2 3.01Å; S187-N190 PolarHBondContact O-N 2.89Å; S187-N190 PolarHBondContact OG-N 3Å; N190-K192 PolarHBondContact O-N 3.07Å; N190-A193 PolarHBondContact O-N 3.39Å; N190-A193 VanDerWaalsContact O-N 3.13Å; N190-Q194 WeakPolarHBondContact O-CG 3.2Å; N190-Q194 PolarHBondContact O-N 3.42Å
191	I	75.5	Confident	64.5	Low	63 Å²	63	65.1 Å²	65.1	32%	0.323	40%	0.395	S	S	.	.	H	α-helix	trans	-61.4	-39.6	-178.4	-60.6	166.8	0	0	0	112	S187 R195	S187-I191 WeakPolarHBondContact O-CG1 3.23Å; S187-I191 PolarHBondContact O-N 2.99Å; I191-R195 WeakPolarHBondContact O-CG 3.34Å; I191-R195 PolarHBondContact O-N 3.29Å
192	K	63.6	Low	61.5	Low	139 Å²	139	71 Å²	71	60%	0.604	43%	0.428	S	S	*	.	H	α-helix	trans	-72.8	-37.2	175	-71.1	166.7	-177	162.6	0	112	S188 N190 Q194 R195 G196	S188-K192 WeakPolarHBondContact O-CB 3.43Å; S188-K192 VanDerWaalsContact O-CD 3.32Å; S188-K192 WeakPolarHBondContact O-CD 3.38Å; S188-K192 WeakPolarHBondContact O-CG 3.24Å; S188-K192 PolarHBondContact O-N 2.94Å; S188-K192 PolarHBondContact OG-NZ 3.15Å; N190-K192 PolarHBondContact O-N 3.07Å; K192-Q194 VanDerWaalsContact C-N 3.26Å; K192-Q194 PolarHBondContact O-N 2.77Å; K192-R195 PolarHBondContact O-N 3.13Å; K192-R195 VanDerWaalsContact O-N 3.12Å; K192-G196 PolarHBondContact O-N 3.06Å
193	A	59.4	Low	58.6	Low	16 Å²	16	74.7 Å²	74.7	13%	0.132	45%	0.448	C	S	.	.	H	α-helix	trans	-66.2	-27.4	176.2	0	0	0	0	0	113	R163 A164 R167 L189 N190	R163-A193 HydrophobicContact CB-CB 4.1Å; R163-A193 WeakPolarHBondContact CD-O 3.16Å; A164-A193 HydrophobicContact CB-CB 3.88Å; R167-A193 PolarHBondContact NH1-O 2.74Å; L189-A193 WeakPolarHBondContact O-CB 3.41Å; L189-A193 PolarHBondContact O-N 2.69Å; N190-A193 PolarHBondContact O-N 3.39Å; N190-A193 VanDerWaalsContact O-N 3.13Å
194	Q	55.6	Low	55.4	Low	45 Å²	45	74.5 Å²	74.5	21%	0.21	46%	0.456	C	S	.	.	H	α-helix	trans	-69.9	-40.1	168.8	-69.9	170.4	-3.9	0	0	112.6	E86 R163 N190 K192	E86-Q194 PolarHBondContact OE1-NE2 3.43Å; E86-Q194 PolarHBondContact OE2-NE2 2.95Å; R163-Q194 PolarHBondContact NH1-O 3.07Å; N190-Q194 WeakPolarHBondContact O-CG 3.2Å; N190-Q194 PolarHBondContact O-N 3.42Å; K192-Q194 VanDerWaalsContact C-N 3.26Å; K192-Q194 PolarHBondContact O-N 2.77Å
195	R	46.3	Very low	52.2	Low	185 Å²	185	83.6 Å²	83.6	70%	0.698	50%	0.499	S	S	*	.	H	α-helix	trans	-91	-19.3	-174.2	-66.5	178.1	-175.1	-178	2.2	116	I191 K192	I191-R195 WeakPolarHBondContact O-CG 3.34Å; I191-R195 PolarHBondContact O-N 3.29Å; K192-R195 PolarHBondContact O-N 3.13Å; K192-R195 VanDerWaalsContact O-N 3.12Å
196	G	38.4	Very low	49.4	Very low	29 Å²	29	90.7 Å²	90.7	30%	0.299	54%	0.537	S	S	.	.	S	Bend	trans	-65.5	154	-175.9	0	0	0	0	0	114	K192	K192-G196 PolarHBondContact O-N 3.06Å
197	P	34.7	Very low	46.8	Very low	120 Å²	120	92.2 Å²	92.2	78%	0.779	54%	0.535	S	S	*	.			trans	-56.7	153.5	-172.5	22.2	-33.3	0	0	0	113.6	R167 G199	R167-P197 PolarHBondContact NH2-O 3.19Å; R167-P197 VanDerWaalsContact NH2-O 3.1Å; P197-G199 PolarHBondContact O-N 3.49Å
198	A	34.2	Very low	44.3	Very low	95 Å²	95	92.2 Å²	92.2	79%	0.785	54%	0.536	S	S	*	.			trans	-79.6	45.7	-166.7	0	0	0	0	0	114.5	G200	A198-G200 PolarHBondContact O-N 2.85Å
199	G	33.7	Very low	42.4	Very low	57 Å²	57	97.7 Å²	97.7	59%	0.588	55%	0.547	S	S	*	.			trans	-65.1	96.9	158.8	0	0	0	0	0	109.5	R167 P197	R167-G199 PolarHBondContact NH2-O 3.13Å; P197-G199 PolarHBondContact O-N 3.49Å
200	G	31.1	Very low	40.3	Very low	51 Å²	51	93.4 Å²	93.4	53%	0.526	52%	0.524	S	S	.	.			trans	-98.9	160.4	165.7	0	0	0	0	0	110.6	A198 V202	A198-G200 PolarHBondContact O-N 2.85Å; G200-V202 PolarHBondContact O-N 2.82Å
201	P	26.8	Very low	38.1	Very low	114 Å²	114	94.8 Å²	94.8	74%	0.74	53%	0.533	S	S	*	.			trans	-59.8	136.4	170.2	27.1	-33.9	0	0	0	109.7	L203	P201-L203 PolarHBondContact O-N 3.34Å
202	V	26.9	Very low	36.1	Very low	137 Å²	137	95.2 Å²	95.2	83%	0.83	53%	0.534	S	S	*	.			trans	-69.5	101	-178.4	179.1	0	0	0	0	109.3	G200	G200-V202 PolarHBondContact O-N 2.82Å
203	L	23.6	Very low	34.8	Very low	147 Å²	147	92 Å²	92	77%	0.77	52%	0.521	S	S	*	.			trans	-60.4	138.2	156.4	-72.1	169.6	0	0	0	107.9	P201 Q205	P201-L203 PolarHBondContact O-N 3.34Å; L203-Q205 PolarHBondContact O-N 2.87Å; L203-Q205 VanDerWaalsContact O-N 3.17Å
204	P	22.8	Very low	33.6	Very low	109 Å²	109	95.4 Å²	95.4	71%	0.708	54%	0.537	S	S	*	.			trans	-57.8	125	176.1	24.5	-33.4	0	0	0	109.1	L206	P204-L206 PolarHBondContact O-N 3.47Å
205	Q	25.6	Very low	32.5	Very low	191 Å²	191	96.9 Å²	96.9	89%	0.893	55%	0.546	S	S	*	.			trans	-64.8	101.1	178.9	-82.6	-174	-34.9	0	0	109.7	L203 K207	L203-Q205 PolarHBondContact O-N 2.87Å; L203-Q205 VanDerWaalsContact O-N 3.17Å; Q205-K207 PolarHBondContact O-N 3.49Å
206	L	27.7	Very low	32	Very low	164 Å²	164	96 Å²	96	86%	0.859	55%	0.55	S	S	*	*			trans	-72.5	81.9	164.9	-69.8	172.7	0	0	0	108.1	P204 A208	P204-L206 PolarHBondContact O-N 3.47Å; L206-A208 PolarHBondContact O-N 3.49Å; L206-A208 VanDerWaalsContact O-N 3.12Å
207	K	30.4	Very low	31.5	Very low	101 Å²	101	96.7 Å²	96.7	44%	0.439	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-49	120.4	176	-165.5	-178	-165.3	-167.7	0	109	Q205 R209 D533 E538	Q205-K207 PolarHBondContact O-N 3.49Å; K207-R209 PolarHBondContact O-N 2.93Å; K207-D533 VanDerWaalsContact CE-O 3.23Å; K207-D533 WeakPolarHBondContact CE-O 3.36Å; K207-D533 PolarHBondContact NZ-O 3.34Å; K207-E538 WeakPolarHBondContact CE-OE1 3.42Å; K207-E538 IonicContact NZ-OE1 2.71Å; K207-E538 PolarHBondContact NZ-OE1 3.2Å
208	A	35	Very low	31.3	Very low	18 Å²	18	98.3 Å²	98.3	15%	0.149	56%	0.564	C	S	.	*	P	Polyproline II helix	trans	-64.8	134.7	177	0	0	0	0	0	109.4	L206 G535 A536 D537	L206-A208 PolarHBondContact O-N 3.49Å; L206-A208 VanDerWaalsContact O-N 3.12Å; A208-G535 WeakPolarHBondContact O-CA 3.33Å; A208-A536 HydrophobicContact CB-CB 3.44Å; A208-A536 VanDerWaalsContact CB-CB 3.44Å; A208-D537 WeakPolarHBondContact CB-OD2 3.45Å; A208-D537 PolarHBondContact N-OD2 3.15Å
209	R	36.2	Very low	31.2	Very low	179 Å²	179	95.5 Å²	95.5	68%	0.675	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-81.6	156.8	-175.7	-74	179	176.5	-102.8	1.4	112.7	K207 E213	K207-R209 PolarHBondContact O-N 2.93Å; R209-E213 WeakPolarHBondContact CD-OE2 3.41Å; R209-E213 VanDerWaalsContact CG-OE2 3.26Å; R209-E213 WeakPolarHBondContact CG-OE2 3.46Å; R209-E213 IonicContact CZ-OE2 3.69Å; R209-E213 IonicContact NE-OE2 2.69Å; R209-E213 IonicContact NH1-OE2 3.92Å; R209-E213 PolarHBondContact NH1-OE2 3.43Å
210	S	37.2	Very low	31.1	Very low	0 Å²	0	95 Å²	95	0%	0	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-69.4	151.9	178.7	70.7	0	0	0	0	112.3	Q212 E213 R527 A534	S210-Q212 PolarHBondContact O-N 2.91Å; S210-Q212 VanDerWaalsContact O-N 3.16Å; S210-E213 WeakPolarHBondContact CB-OE1 3.43Å; S210-E213 PolarHBondContact N-OE1 2.96Å; S210-E213 PolarHBondContact O-N 3.42Å; S210-E213 VanDerWaalsContact O-N 3.16Å; S210-E213 WeakPolarHBondContact OG-CG 3.44Å; S210-E213 PolarHBondContact OG-OE1 2.96Å; S210-R527 PolarHBondContact OG-NH2 3.12Å; S210-R527 VanDerWaalsContact OG-NH2 3.1Å; S210-A534 WeakPolarHBondContact CA-O 3.32Å; S210-A534 VanDerWaalsContact CB-O 3.24Å; S210-A534 WeakPolarHBondContact CB-O 3.14Å
211	P	35.2	Very low	31	Very low	30 Å²	30	92.9 Å²	92.9	20%	0.195	51%	0.513	C	S	.	.	G	3₁₀ helix	trans	-60.6	-23.6	178.5	-25.6	34.6	0	0	0	114.9	L214 Y523 Y578	P211-L214 PolarHBondContact O-N 3.41Å; P211-Y523 VanDerWaalsContact CD-CE1 3.46Å; P211-Y523 VanDerWaalsContact CD-CZ 3.45Å; P211-Y523 HydrophobicContact CG-CD1 4.32Å; P211-Y523 HydrophobicContact CG-CD2 3.77Å; P211-Y523 HydrophobicContact CG-CE1 4.06Å; P211-Y523 HydrophobicContact CG-CE2 3.44Å; P211-Y523 VanDerWaalsContact CG-CE2 3.44Å; P211-Y523 HydrophobicContact CG-CG 4.21Å; P211-Y578 WeakPolarHBondContact CG-OH 3.45Å
212	Q	34.1	Very low	31.1	Very low	72 Å²	72	91.5 Å²	91.5	34%	0.336	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-78.3	-23	179.7	-68.2	86	-33.3	0	0	112.7	S210 L214	S210-Q212 PolarHBondContact O-N 2.91Å; S210-Q212 VanDerWaalsContact O-N 3.16Å; Q212-L214 PolarHBondContact O-N 3.13Å
213	E	34.9	Very low	31.3	Very low	72 Å²	72	87.7 Å²	87.7	34%	0.336	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-72.3	-7.9	171.5	-70.8	165.6	-98	0	0	113.2	R209 S210 D215	R209-E213 WeakPolarHBondContact CD-OE2 3.41Å; R209-E213 VanDerWaalsContact CG-OE2 3.26Å; R209-E213 WeakPolarHBondContact CG-OE2 3.46Å; R209-E213 IonicContact CZ-OE2 3.69Å; R209-E213 IonicContact NE-OE2 2.69Å; R209-E213 IonicContact NH1-OE2 3.92Å; R209-E213 PolarHBondContact NH1-OE2 3.43Å; S210-E213 WeakPolarHBondContact CB-OE1 3.43Å; S210-E213 PolarHBondContact N-OE1 2.96Å; S210-E213 PolarHBondContact O-N 3.42Å; S210-E213 VanDerWaalsContact O-N 3.16Å; S210-E213 WeakPolarHBondContact OG-CG 3.44Å; S210-E213 PolarHBondContact OG-OE1 2.96Å; E213-D215 PolarHBondContact O-N 3.44Å
214	L	34.4	Very low	31.7	Very low	88 Å²	88	89.1 Å²	89.1	46%	0.461	48%	0.478	S	S	.	.	S	Bend	trans	-70.7	96.4	165.6	-83.2	75.8	0	0	0	109.4	P211 Q212 Q216	P211-L214 PolarHBondContact O-N 3.41Å; Q212-L214 PolarHBondContact O-N 3.13Å; L214-Q216 VanDerWaalsContact O-CG 3.28Å; L214-Q216 WeakPolarHBondContact O-CG 3.44Å; L214-Q216 PolarHBondContact O-N 2.7Å
215	D	33.3	Very low	32.2	Very low	75 Å²	75	86.7 Å²	86.7	40%	0.401	46%	0.457	S	S	.	.			trans	-24.8	102.5	169.2	-90.9	-49.6	0	0	0	113.5	E213 G217 A221 R664	E213-D215 PolarHBondContact O-N 3.44Å; D215-G217 PolarHBondContact O-N 3.08Å; D215-G217 VanDerWaalsContact O-N 3.13Å; D215-A221 HydrophobicContact CB-CB 4.15Å; D215-R664 IonicContact OD1-CZ 3.73Å; D215-R664 IonicContact OD1-NH2 2.8Å; D215-R664 PolarHBondContact OD1-NH2 3.42Å; D215-R664 IonicContact OD2-CZ 2.7Å; D215-R664 IonicContact OD2-NH2 3.92Å; D215-R664 PolarHBondContact OD2-NH2 3.46Å
216	Q	35.5	Very low	32.6	Very low	168 Å²	168	79.1 Å²	79.1	79%	0.785	42%	0.422	S	S	*	.			trans	-84.7	30.8	175.7	-57	-160.6	21.7	0	0	112.2	L214	L214-Q216 VanDerWaalsContact O-CG 3.28Å; L214-Q216 WeakPolarHBondContact O-CG 3.44Å; L214-Q216 PolarHBondContact O-N 2.7Å
217	G	28.3	Very low	32.7	Very low	42 Å²	42	74.9 Å²	74.9	43%	0.433	41%	0.405	S	S	.	.	S	Bend	trans	-115	-174.6	-178.7	0	0	0	0	0	114.2	D215 G219	D215-G217 PolarHBondContact O-N 3.08Å; D215-G217 VanDerWaalsContact O-N 3.13Å; G217-G219 VanDerWaalsContact C-N 3.27Å; G217-G219 PolarHBondContact O-N 2.84Å
218	T	31.3	Very low	32.8	Very low	154 Å²	154	70.9 Å²	70.9	95%	0.945	39%	0.388	S	S	*	.	S	Bend	trans	-76.3	-12.1	-177.7	-32.9	0	0	0	0	113.2	A220	T218-A220 PolarHBondContact O-N 2.88Å
219	G	31.6	Very low	33	Very low	37 Å²	37	70.6 Å²	70.6	38%	0.381	38%	0.383	S	S	.	.	S	Bend	trans	-69.6	124.3	167.8	0	0	0	0	0	111	G217 A221	G217-G219 VanDerWaalsContact C-N 3.27Å; G217-G219 PolarHBondContact O-N 2.84Å; G219-A221 PolarHBondContact O-N 3.33Å
220	A	31.8	Very low	32.8	Very low	45 Å²	45	64.1 Å²	64.1	37%	0.372	36%	0.364	S	S	.	.			trans	-71.4	91.5	-171.7	0	0	0	0	0	112.3	T218 K662	T218-A220 PolarHBondContact O-N 2.88Å; A220-K662 WeakPolarHBondContact O-CD 3.3Å; A220-K662 WeakPolarHBondContact O-CE 3.44Å; A220-K662 PolarHBondContact O-NZ 3.09Å
221	A	28.6	Very low	32.6	Very low	8 Å²	8	64.7 Å²	64.7	7%	0.066	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-46.7	161.3	-175.2	0	0	0	0	0	116.5	D215 G219 K662	D215-A221 HydrophobicContact CB-CB 4.15Å; G219-A221 PolarHBondContact O-N 3.33Å; A221-K662 PolarHBondContact O-NZ 3.04Å
222	L	28.5	Very low	32.8	Very low	85 Å²	85	67 Å²	67	45%	0.445	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-57.1	131.2	160.2	-102.6	169.1	0	0	0	109.6	K642	L222-K642 HydrophobicContact CD1-CD 4.23Å; L222-K642 HydrophobicContact CD1-CG 4.07Å; L222-K642 HydrophobicContact CD2-CB 3.81Å; L222-K642 HydrophobicContact CD2-CD 4.31Å; L222-K642 HydrophobicContact CD2-CG 3.78Å; L222-K642 HydrophobicContact CG-CB 4.44Å; L222-K642 HydrophobicContact CG-CD 3.98Å; L222-K642 HydrophobicContact CG-CG 3.94Å
223	C	31.1	Very low	32.9	Very low	57 Å²	57	65.9 Å²	65.9	39%	0.385	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-98.1	125.6	162.8	-61.4	0	0	0	0	107.1	F225	C223-F225 HydrophobicContact CB-CD2 4.47Å; C223-F225 HydrophobicContact CB-CE2 4.45Å; C223-F225 PolarHBondContact O-N 3.26Å; C223-F225 VanDerWaalsContact O-N 3.08Å
224	F	31.8	Very low	32.8	Very low	177 Å²	177	64 Å²	64	78%	0.776	38%	0.377	S	S	*	.			trans	-63.1	108.5	153.2	-102.8	-88.7	0	0	0	106.6	N226	F224-N226 PolarHBondContact O-N 3.46Å; F224-N226 VanDerWaalsContact O-N 3.12Å
225	F	32.8	Very low	32.9	Very low	58 Å²	58	65.5 Å²	65.5	25%	0.254	39%	0.392	S	S	.	.			trans	-70.4	105.4	166.3	-96.6	-83.4	0	0	0	107.3	C223 P227 L627 T643	C223-F225 HydrophobicContact CB-CD2 4.47Å; C223-F225 HydrophobicContact CB-CE2 4.45Å; C223-F225 PolarHBondContact O-N 3.26Å; C223-F225 VanDerWaalsContact O-N 3.08Å; F225-P227 WeakPolarHBondContact O-CD 3.37Å; F225-L627 HydrophobicContact CD1-CD1 3.7Å; F225-L627 HydrophobicContact CD2-CD1 4.49Å; F225-L627 HydrophobicContact CE1-CD1 3.5Å; F225-L627 HydrophobicContact CE1-CD2 3.79Å; F225-L627 HydrophobicContact CE1-CG 4.33Å; F225-L627 HydrophobicContact CE2-CD1 4.32Å; F225-L627 HydrophobicContact CE2-CD2 3.75Å; F225-L627 HydrophobicContact CG-CD1 4.21Å; F225-L627 HydrophobicContact CZ-CD1 3.84Å; F225-L627 HydrophobicContact CZ-CD2 3.28Å; F225-L627 HydrophobicContact CZ-CG 4.23Å; F225-T643 HydrophobicContact CD2-CG2 3.93Å; F225-T643 HydrophobicContact CE2-CG2 4.35Å
226	N	34.1	Very low	32.9	Very low	31 Å²	31	65.8 Å²	65.8	17%	0.166	40%	0.397	C	S	.	.			trans	-68	113.2	166.8	-166.4	-0.3	0	0	0	106.4	F224 L228 F229 T580	F224-N226 PolarHBondContact O-N 3.46Å; F224-N226 VanDerWaalsContact O-N 3.12Å; N226-L228 PolarHBondContact O-N 2.89Å; N226-L228 VanDerWaalsContact O-N 3.11Å; N226-L228 VanDerWaalsContact OD1-CG 3.28Å; N226-L228 WeakPolarHBondContact OD1-CG 3.47Å; N226-F229 HydrophobicContact CB-CD2 4.21Å; N226-F229 PolarHBondContact O-N 3.29Å; N226-T580 PolarHBondContact ND2-OG1 3.03Å
227	P	31.2	Very low	33.1	Very low	76 Å²	76	61.3 Å²	61.3	49%	0.494	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.9	-173.5	24	-34	0	0	0	112.1	F225 F229	F225-P227 WeakPolarHBondContact O-CD 3.37Å; P227-F229 PolarHBondContact O-N 3.46Å; P227-F229 VanDerWaalsContact O-N 3.08Å
228	L	32	Very low	33.5	Very low	16 Å²	16	64.4 Å²	64.4	8%	0.084	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-24	169.6	-56.9	-168.3	0	0	0	115.2	N226 T580 L610 W613 E614	N226-L228 PolarHBondContact O-N 2.89Å; N226-L228 VanDerWaalsContact O-N 3.11Å; N226-L228 VanDerWaalsContact OD1-CG 3.28Å; N226-L228 WeakPolarHBondContact OD1-CG 3.47Å; L228-T580 HydrophobicContact CD1-CG2 3.71Å; L228-T580 VanDerWaalsContact CD1-OG1 3.24Å; L228-T580 WeakPolarHBondContact CD1-OG1 3.41Å; L228-L610 HydrophobicContact CD1-CD2 3.74Å; L228-L610 HydrophobicContact CD2-CB 4.3Å; L228-L610 HydrophobicContact CD2-CD2 3.98Å; L228-L610 HydrophobicContact CG-CD2 4.12Å; L228-W613 HydrophobicContact CB-CE3 4.23Å; L228-W613 HydrophobicContact CB-CH2 4.17Å; L228-W613 HydrophobicContact CB-CZ3 3.64Å; L228-W613 HydrophobicContact CD1-CD2 4.23Å; L228-W613 HydrophobicContact CD1-CE3 3.83Å; L228-W613 HydrophobicContact CD1-CH2 4.29Å; L228-W613 HydrophobicContact CD1-CZ3 3.91Å; L228-W613 HydrophobicContact CD2-CE3 3.65Å; L228-W613 HydrophobicContact CD2-CZ3 3.93Å; L228-W613 HydrophobicContact CG-CE3 4.11Å; L228-W613 HydrophobicContact CG-CZ3 4.04Å; L228-E614 HydrophobicContact CD2-CG 3.32Å
229	F	38.8	Very low	33.9	Very low	13 Å²	13	60 Å²	60	6%	0.057	34%	0.342	C	S	.	.			trans	-136.6	84.6	-171	-59	-65.1	0	0	0	112.8	N226 P227 G231 L571 T572 W613	N226-F229 HydrophobicContact CB-CD2 4.21Å; N226-F229 PolarHBondContact O-N 3.29Å; P227-F229 PolarHBondContact O-N 3.46Å; P227-F229 VanDerWaalsContact O-N 3.08Å; F229-G231 PolarHBondContact O-N 3.47Å; F229-L571 HydrophobicContact CD1-CB 3.46Å; F229-L571 VanDerWaalsContact CD1-CB 3.46Å; F229-L571 HydrophobicContact CD1-CD1 4.16Å; F229-L571 HydrophobicContact CD1-CG 4.43Å; F229-L571 HydrophobicContact CD2-CB 4Å; F229-L571 WeakPolarHBondContact CD2-O 3.36Å; F229-L571 HydrophobicContact CE1-CB 3.23Å; F229-L571 HydrophobicContact CE1-CD1 3.28Å; F229-L571 HydrophobicContact CE1-CG 3.8Å; F229-L571 HydrophobicContact CE2-CB 3.82Å; F229-L571 HydrophobicContact CG-CB 3.84Å; F229-L571 HydrophobicContact CZ-CB 3.43Å; F229-L571 VanDerWaalsContact CZ-CB 3.43Å; F229-L571 HydrophobicContact CZ-CD1 3.7Å; F229-L571 HydrophobicContact CZ-CD2 4.18Å; F229-L571 HydrophobicContact CZ-CG 3.96Å; F229-T572 HydrophobicContact CB-CG2 3.9Å; F229-W613 HydrophobicContact CD1-CH2 4.37Å; F229-W613 AromaticContact CE1-CH2 3.36Å; F229-W613 HydrophobicContact CE1-CH2 3.36Å; F229-W613 HydrophobicContact CE1-CZ2 4.04Å; F229-W613 HydrophobicContact CE1-CZ3 4.32Å; F229-W613 HydrophobicContact CE2-CH2 4.05Å; F229-W613 HydrophobicContact CE2-CZ2 4.41Å; F229-W613 AromaticContact CZ-CH2 3.16Å; F229-W613 HydrophobicContact CZ-CH2 3.16Å; F229-W613 AromaticContact CZ-CZ2 3.5Å; F229-W613 HydrophobicContact CZ-CZ2 3.5Å; F229-W613 VanDerWaalsContact CZ-CZ2 3.5Å; F229-W613 HydrophobicContact CZ-CZ3 4.18Å
230	P	32.4	Very low	34.3	Very low	43 Å²	43	61.3 Å²	61.3	28%	0.279	34%	0.337	S	S	.	.			trans	-64.1	93.3	171.3	-22.5	35.6	0	0	0	111.9	C623 F624	P230-C623 HydrophobicContact CB-CB 3.64Å; P230-F624 HydrophobicContact CG-CE2 4.42Å; P230-F624 HydrophobicContact CG-CZ 4.32Å
231	G	33.5	Very low	34.5	Very low	12 Å²	12	62.1 Å²	62.1	12%	0.124	33%	0.332	C	S	.	.			trans	-102.2	95.5	-172	0	0	0	0	0	115.1	F229 L233	F229-G231 PolarHBondContact O-N 3.47Å; G231-L233 PolarHBondContact O-N 2.69Å
232	D	39	Very low	35	Very low	77 Å²	77	67.3 Å²	67.3	41%	0.412	35%	0.354	S	S	.	.			trans	-70.8	105.8	161.9	170.7	53	0	0	0	110.7	K237	D232-K237 PolarHBondContact O-NZ 3.14Å; D232-K237 IonicContact OD2-NZ 3.96Å
233	L	35.3	Very low	35.4	Very low	49 Å²	49	72.2 Å²	72.2	26%	0.257	37%	0.366	S	S	.	.			trans	-138.6	94.4	178.1	-57.3	-175.2	0	0	0	112.2	G231 K237 T572	G231-L233 PolarHBondContact O-N 2.69Å; L233-K237 HydrophobicContact CB-CB 4.26Å; L233-K237 HydrophobicContact CD1-CB 4.42Å; L233-K237 HydrophobicContact CD2-CB 3.53Å; L233-K237 HydrophobicContact CD2-CD 3.56Å; L233-K237 HydrophobicContact CD2-CG 4.09Å; L233-K237 HydrophobicContact CG-CB 4.28Å; L233-T572 WeakPolarHBondContact CD1-OG1 3.35Å
234	G	34.1	Very low	35.6	Very low	34 Å²	34	71.9 Å²	71.9	35%	0.351	37%	0.365	S	S	.	.			trans	-53.3	162.5	153.7	0	0	0	0	0	112.6	T236 K237	G234-T236 PolarHBondContact O-N 3.09Å; G234-K237 PolarHBondContact O-N 3.11Å; G234-K237 VanDerWaalsContact O-N 3.16Å
235	P	35.3	Very low	35.8	Very low	118 Å²	118	69 Å²	69	77%	0.766	35%	0.352	S	S	*	.	H	α-helix	trans	-58.1	-23.2	-163.5	21.4	-34	0	0	0	114.9	K237	P235-K237 PolarHBondContact O-N 3.04Å
236	T	35	Very low	35.6	Very low	81 Å²	81	75.4 Å²	75.4	50%	0.497	38%	0.38	S	S	.	.	H	α-helix	trans	-66.9	-29.3	-178.5	56.1	0	0	0	0	114.3	G234 K426	G234-T236 PolarHBondContact O-N 3.09Å; T236-K426 WeakPolarHBondContact O-CE 3.41Å; T236-K426 PolarHBondContact O-NZ 2.9Å
237	K	38.9	Very low	35.3	Very low	75 Å²	75	80 Å²	80	33%	0.326	41%	0.408	S	S	.	.	H	α-helix	trans	-86.3	-29.2	-174.8	-62.4	-171.6	-109.8	158.1	0	113	D232 L233 G234 P235 E239 K240	D232-K237 PolarHBondContact O-NZ 3.14Å; D232-K237 IonicContact OD2-NZ 3.96Å; L233-K237 HydrophobicContact CB-CB 4.26Å; L233-K237 HydrophobicContact CD1-CB 4.42Å; L233-K237 HydrophobicContact CD2-CB 3.53Å; L233-K237 HydrophobicContact CD2-CD 3.56Å; L233-K237 HydrophobicContact CD2-CG 4.09Å; L233-K237 HydrophobicContact CG-CB 4.28Å; G234-K237 PolarHBondContact O-N 3.11Å; G234-K237 VanDerWaalsContact O-N 3.16Å; P235-K237 PolarHBondContact O-N 3.04Å; K237-E239 PolarHBondContact O-N 3.22Å; K237-K240 WeakPolarHBondContact O-CB 3.22Å; K237-K240 WeakPolarHBondContact O-CG 3.46Å; K237-K240 PolarHBondContact O-N 2.8Å; K237-K240 VanDerWaalsContact O-N 3.12Å
238	R	37.3	Very low	35	Very low	107 Å²	107	87.3 Å²	87.3	40%	0.404	43%	0.426	S	S	.	.	H	α-helix	trans	-61.9	-24.5	176.6	-171.2	174.7	178.8	-172.2	-1.5	113.7	K240	R238-K240 VanDerWaalsContact C-N 3.28Å; R238-K240 PolarHBondContact O-N 2.96Å
239	E	38.7	Very low	34.7	Very low	61 Å²	61	92.3 Å²	92.3	29%	0.285	46%	0.457	S	S	.	.	H	α-helix	trans	-69.4	-20	176.1	-62.8	-168.3	123.9	0	0	114.5	K237 F241 K242 R243 K426	K237-E239 PolarHBondContact O-N 3.22Å; E239-F241 PolarHBondContact O-N 2.81Å; E239-K242 PolarHBondContact O-N 2.61Å; E239-R243 PolarHBondContact O-N 3.18Å; E239-R243 VanDerWaalsContact O-N 3.13Å; E239-R243 IonicContact OE1-CZ 2.74Å; E239-R243 IonicContact OE1-NH1 3.57Å; E239-R243 PolarHBondContact OE1-NH1 2.81Å; E239-R243 IonicContact OE1-NH2 3.78Å; E239-R243 PolarHBondContact OE1-NH2 2.79Å; E239-R243 IonicContact OE2-CZ 3.52Å; E239-R243 IonicContact OE2-NH1 3.66Å; E239-R243 PolarHBondContact OE2-NH1 2.93Å; E239-K426 IonicContact OE2-NZ 2.7Å; E239-K426 PolarHBondContact OE2-NZ 3.25Å
240	K	39.7	Very low	34.2	Very low	64 Å²	64	97.3 Å²	97.3	28%	0.278	49%	0.494	S	S	.	.	H	α-helix	trans	-58.2	-33.3	-174.5	-70.6	-175.5	177.2	-171.1	0	112.3	K237 R238 E429	K237-K240 WeakPolarHBondContact O-CB 3.22Å; K237-K240 WeakPolarHBondContact O-CG 3.46Å; K237-K240 PolarHBondContact O-N 2.8Å; K237-K240 VanDerWaalsContact O-N 3.12Å; R238-K240 VanDerWaalsContact C-N 3.28Å; R238-K240 PolarHBondContact O-N 2.96Å; K240-E429 WeakPolarHBondContact CE-OE1 3.41Å; K240-E429 IonicContact NZ-OE1 2.82Å; K240-E429 PolarHBondContact NZ-OE1 2.81Å; K240-E429 IonicContact NZ-OE2 3.17Å; K240-E429 PolarHBondContact NZ-OE2 3.32Å
241	F	37.2	Very low	34	Very low	63 Å²	63	101.5 Å²	101.5	28%	0.276	52%	0.519	S	S	.	.	H	α-helix	trans	-78.3	-57.2	172.7	-143.4	-120.3	0	0	0	111.3	E239 R243 S244 F245 L516 E574	E239-F241 PolarHBondContact O-N 2.81Å; F241-R243 PolarHBondContact O-N 3.36Å; F241-S244 PolarHBondContact O-N 2.94Å; F241-S244 PolarHBondContact O-OG 2.8Å; F241-F245 AromaticContact CD1-CE2 3.59Å; F241-F245 HydrophobicContact CD1-CE2 3.59Å; F241-F245 HydrophobicContact CD1-CZ 4.11Å; F241-F245 AromaticContact CE1-CE2 3.68Å; F241-F245 HydrophobicContact CE1-CE2 3.68Å; F241-F245 AromaticContact CE1-CZ 3.7Å; F241-F245 HydrophobicContact CE1-CZ 3.7Å; F241-F245 HydrophobicContact CG-CE2 4.16Å; F241-F245 HydrophobicContact CZ-CE2 4.33Å; F241-F245 HydrophobicContact CZ-CZ 4.21Å; F241-F245 WeakPolarHBondContact O-CD2 3.34Å; F241-L516 HydrophobicContact CE1-CD2 3.57Å; F241-L516 HydrophobicContact CZ-CD2 3.52Å; F241-E574 HydrophobicContact CE1-CB 4.25Å; F241-E574 WeakPolarHBondContact CE1-OE2 3.34Å
242	K	38.9	Very low	33.6	Very low	117 Å²	117	110.1 Å²	110.1	51%	0.509	56%	0.556	S	S	.	*	H	α-helix	trans	-50.1	-47.9	-173.2	-75.4	-159.7	172.6	-163.5	0	113.7	E239 S244 F245	E239-K242 PolarHBondContact O-N 2.61Å; K242-S244 VanDerWaalsContact C-N 3.26Å; K242-S244 PolarHBondContact O-N 3.42Å; K242-F245 PolarHBondContact O-N 2.98Å
243	R	37	Very low	33	Very low	187 Å²	187	113.4 Å²	113.4	71%	0.706	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-1.1	-177.8	-70.8	-152.2	-173.2	83.1	13.2	115.3	E239 F241	E239-R243 PolarHBondContact O-N 3.18Å; E239-R243 VanDerWaalsContact O-N 3.13Å; E239-R243 IonicContact OE1-CZ 2.74Å; E239-R243 IonicContact OE1-NH1 3.57Å; E239-R243 PolarHBondContact OE1-NH1 2.81Å; E239-R243 IonicContact OE1-NH2 3.78Å; E239-R243 PolarHBondContact OE1-NH2 2.79Å; E239-R243 IonicContact OE2-CZ 3.52Å; E239-R243 IonicContact OE2-NH1 3.66Å; E239-R243 PolarHBondContact OE2-NH1 2.93Å; F241-R243 PolarHBondContact O-N 3.36Å
244	S	35.3	Very low	32.5	Very low	51 Å²	51	116.3 Å²	116.3	36%	0.357	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.8	-1.1	171.4	77.6	0	0	0	0	113.7	F241 K242 K513	F241-S244 PolarHBondContact O-N 2.94Å; F241-S244 PolarHBondContact O-OG 2.8Å; K242-S244 VanDerWaalsContact C-N 3.26Å; K242-S244 PolarHBondContact O-N 3.42Å; S244-K513 PolarHBondContact OG-NZ 3.42Å
245	F	35.1	Very low	32.2	Very low	115 Å²	115	120.3 Å²	120.3	50%	0.504	63%	0.626	S	S	.	*			trans	-96.9	119.6	168	-64.6	-93.4	0	0	0	109.9	F241 K242 L516	F241-F245 AromaticContact CD1-CE2 3.59Å; F241-F245 HydrophobicContact CD1-CE2 3.59Å; F241-F245 HydrophobicContact CD1-CZ 4.11Å; F241-F245 AromaticContact CE1-CE2 3.68Å; F241-F245 HydrophobicContact CE1-CE2 3.68Å; F241-F245 AromaticContact CE1-CZ 3.7Å; F241-F245 HydrophobicContact CE1-CZ 3.7Å; F241-F245 HydrophobicContact CG-CE2 4.16Å; F241-F245 HydrophobicContact CZ-CE2 4.33Å; F241-F245 HydrophobicContact CZ-CZ 4.21Å; F241-F245 WeakPolarHBondContact O-CD2 3.34Å; K242-F245 PolarHBondContact O-N 2.98Å; F245-L516 HydrophobicContact CZ-CD2 4.47Å
246	K	28.8	Very low	32.1	Very low	194 Å²	194	120.2 Å²	120.2	84%	0.843	63%	0.625	S	S	*	*			trans	-135.9	45.4	167	-155.7	-178.3	-178.8	-177.8	0	111.8
247	V	28.7	Very low	31.6	Very low	127 Å²	127	124.3 Å²	124.3	77%	0.77	64%	0.643	S	S	*	*			trans	-85.3	113.5	157.7	-179	0	0	0	0	106.1	V249	V247-V249 HydrophobicContact CG1-CG2 4.32Å; V247-V249 PolarHBondContact O-N 3.46Å
248	R	24.9	Very low	31	Very low	229 Å²	229	126.4 Å²	126.4	86%	0.864	67%	0.667	S	S	*	*			trans	-71.5	116.5	171.1	-84.1	179.2	166.2	163.3	-8	108.6
249	V	25.2	Very low	30.5	Very low	121 Å²	121	126.9 Å²	126.9	73%	0.733	68%	0.684	S	S	*	*			trans	-121.2	129.3	154.2	-175.5	0	0	0	0	105.2	V247 T251	V247-V249 HydrophobicContact CG1-CG2 4.32Å; V247-V249 PolarHBondContact O-N 3.46Å; V249-T251 PolarHBondContact O-N 2.92Å
250	S	28.5	Very low	30	Very low	118 Å²	118	130.2 Å²	130.2	83%	0.825	71%	0.711	S	S	*	*			trans	-84.4	104.6	-160.8	-56.7	0	0	0	0	113
251	T	27	Very low	29.7	Very low	132 Å²	132	131.5 Å²	131.5	81%	0.81	73%	0.733	S	S	*	*			trans	-143.4	60.3	168.3	59.2	0	0	0	0	111.9	V249	V249-T251 PolarHBondContact O-N 2.92Å
252	E	25.7	Very low	29.5	Very low	193 Å²	193	135 Å²	135	90%	0.902	76%	0.76	S	S	*	*			trans	-136.6	100.9	168.8	-80.6	-169.5	128.3	0	0	111
253	T	26.3	Very low	29.5	Very low	146 Å²	146	135 Å²	135	90%	0.896	77%	0.772	S	S	*	*			trans	-162.1	131.9	150.8	43.8	0	0	0	0	108.7
254	S	26	Very low	29.1	Very low	109 Å²	109	131.9 Å²	131.9	76%	0.762	78%	0.776	S	S	*	*			trans	-144.6	97.3	170.3	61.6	0	0	0	0	112
255	S	26.4	Very low	28.8	Very low	119 Å²	119	135.3 Å²	135.3	83%	0.832	80%	0.797	S	S	*	*			trans	66.5	164.3	158.6	-51.2	0	0	0	0	118.3
256	P	34	Very low	29.2	Very low	116 Å²	116	135.2 Å²	135.2	75%	0.753	81%	0.808	S	S	*	*			cis	-116.5	-155.3	-13.6	40.2	-25.6	0	0	0	112
257	L	24.2	Very low	29.3	Very low	167 Å²	167	131.9 Å²	131.9	87%	0.874	80%	0.804	S	S	*	*			trans	94.8	117.8	174.1	-55.7	176.2	0	0	0	116.4
258	S	26.2	Very low	29.3	Very low	119 Å²	119	132 Å²	132	83%	0.832	81%	0.806	S	S	*	*			trans	-107.3	140.1	175.6	-48.2	0	0	0	0	111.1
259	P	26.9	Very low	30.2	Very low	117 Å²	117	127 Å²	127	76%	0.76	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-81.9	160.6	154.5	34	-30.9	0	0	0	110.9
260	P	28.7	Very low	30.4	Very low	131 Å²	131	128.9 Å²	128.9	85%	0.851	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-81.6	167.5	-171.4	33.5	-37.1	0	0	0	114.4
261	A	32.8	Very low	30.9	Very low	90 Å²	90	129 Å²	129	74%	0.744	81%	0.805	S	S	*	*	S	Bend	trans	-87.1	164.9	171.2	0	0	0	0	0	112.6
262	V	32.1	Very low	31	Very low	136 Å²	136	125.9 Å²	125.9	82%	0.824	80%	0.799	S	S	*	*			trans	78.3	123.8	177.2	-169.9	0	0	0	0	115.7
263	P	40.3	Very low	30.9	Very low	118 Å²	118	121.7 Å²	121.7	77%	0.766	80%	0.797	S	S	*	*			trans	-102.2	147.4	173.9	37.7	-32	0	0	0	113.9
264	P	29.2	Very low	31.1	Very low	122 Å²	122	120.9 Å²	120.9	79%	0.792	79%	0.792	S	S	*	*			trans	-123.1	-174.9	161.2	44	-32.2	0	0	0	111.3
265	P	28.4	Very low	31.8	Very low	122 Å²	122	121.7 Å²	121.7	79%	0.792	79%	0.794	S	S	*	*				-111.1	174.5	-97.4	26.7	-5.9	0	0	0	114.3
266	P	42.3	Very low	31.7	Very low	113 Å²	113	121 Å²	121	73%	0.734	79%	0.789	S	S	*	*			trans	-101.6	173.8	-169.3	39.7	-36.7	0	0	0	116.2
267	V	32.4	Very low	31.4	Very low	125 Å²	125	123.9 Å²	123.9	76%	0.758	79%	0.793	S	S	*	*			trans	64.8	155.1	170.4	-102.3	0	0	0	0	116.5
268	P	29	Very low	31.6	Very low	128 Å²	128	122.7 Å²	122.7	83%	0.831	79%	0.792	S	S	*	*			cis	-112.2	162.1	32.4	17.9	4.4	0	0	0	117.3
269	V	42.7	Very low	31.7	Very low	124 Å²	124	123.2 Å²	123.2	75%	0.752	78%	0.782	S	S	*	*			trans	-132	134.7	165.8	171.9	0	0	0	0	107.9
270	L	30	Very low	31.5	Very low	161 Å²	161	127.3 Å²	127.3	84%	0.843	78%	0.782	S	S	*	*			trans	-177.9	171.8	159.5	-129.2	79	0	0	0	109.3
271	P	39.4	Very low	31.7	Very low	122 Å²	122	128.6 Å²	128.6	79%	0.792	78%	0.781	S	S	*	*				-102.8	179.9	-60.3	31.9	-16.1	0	0	0	110.7
272	G	27.6	Very low	32.1	Very low	66 Å²	66	129.9 Å²	129.9	68%	0.68	78%	0.781	S	S	*	*			cis	142.9	146.7	-0.8	0	0	0	0	0	111.4
273	A	25.1	Very low	32.6	Very low	105 Å²	105	129 Å²	129	87%	0.868	78%	0.778	S	S	*	*			trans	68	153.7	174.8	0	0	0	0	0	116.1
274	V	30.1	Very low	31.9	Very low	129 Å²	129	128 Å²	128	78%	0.782	78%	0.775	S	S	*	*			cis	-138.1	144.7	-6.5	-177.9	0	0	0	0	107.8
275	P	39.2	Very low	31.6	Very low	125 Å²	125	130.6 Å²	130.6	81%	0.812	78%	0.776	S	S	*	*			trans	-94	149.2	177.5	35.9	-34.2	0	0	0	114.3
276	S	26.1	Very low	31.4	Very low	104 Å²	104	130.9 Å²	130.9	73%	0.727	77%	0.77	S	S	*	*			trans	-158.3	116.6	165.2	56.3	0	0	0	0	114.8
277	Q	27.2	Very low	30.6	Very low	178 Å²	178	132.7 Å²	132.7	83%	0.832	77%	0.773	S	S	*	*			trans	60.4	128.3	144.5	-54.9	178	33.8	0	0	118.1
278	T	29	Very low	30.2	Very low	142 Å²	142	136 Å²	136	87%	0.871	77%	0.772	S	S	*	*				-133.4	151	51.8	-55.9	0	0	0	0	113.5
279	E	26.7	Very low	30	Very low	129 Å²	129	140.3 Å²	140.3	60%	0.603	77%	0.771	S	S	*	*			trans	-78.1	-177.5	179	-52.8	179.2	67.5	0	0	112.4
280	R	23.6	Very low	29.1	Very low	204 Å²	204	140.1 Å²	140.1	77%	0.77	76%	0.762	S	S	*	*			cis	-159.2	149.8	16.2	-149.8	172.3	-103.2	172.7	0.5	112.2
281	L	31.7	Very low	28.8	Very low	158 Å²	158	138.3 Å²	138.3	83%	0.827	76%	0.764	S	S	*	*			trans	-96.8	-165.4	161.6	-66.9	162.4	0	0	0	108.4
282	P	41.5	Very low	28.2	Very low	116 Å²	116	137.9 Å²	137.9	75%	0.753	76%	0.763	S	S	*	*			cis	-112.6	-127.5	-27.5	29.4	-4.4	0	0	0	106.8
283	P	42.2	Very low	28.3	Very low	117 Å²	117	141.3 Å²	141.3	76%	0.76	77%	0.771	S	S	*	*			cis	-133.6	-174.5	-25.9	39.2	-19.4	0	0	0	116.5
284	S	25.5	Very low	28.2	Very low	99 Å²	99	139.4 Å²	139.4	69%	0.692	76%	0.761	S	S	*	*			trans	-55.6	177.6	173.8	-37	0	0	0	0	119.9
285	Q	25	Very low	28.1	Very low	175 Å²	175	144.1 Å²	144.1	82%	0.818	77%	0.767	S	S	*	*			trans	76.5	158.3	154	-68.4	179.8	36.1	0	0	118
286	L	23.7	Very low	27.4	Very low	129 Å²	129	149.2 Å²	149.2	68%	0.675	77%	0.77	S	S	*	*			cis	-167.6	162.6	-23.1	-113.4	173.4	0	0	0	110.1
287	L	24.6	Very low	27.5	Very low	150 Å²	150	150.4 Å²	150.4	79%	0.785	77%	0.772	S	S	*	*			trans	63.9	167.7	160.6	-65	166.5	0	0	0	116.9
288	R	24.6	Very low	28.2	Very low	196 Å²	196	147.3 Å²	147.3	74%	0.74	77%	0.768	S	S	*	*			cis	-169.7	171.9	-29	171.5	168.9	177.5	167.3	1.6	108.3	E290	R288-E290 IonicContact CZ-OE1 3.59Å; R288-E290 IonicContact NE-OE1 3.21Å; R288-E290 PolarHBondContact NE-OE1 2.8Å; R288-E290 IonicContact NH2-OE1 3.25Å; R288-E290 PolarHBondContact NH2-OE1 3.24Å
289	R	23.8	Very low	28.1	Very low	217 Å²	217	145.4 Å²	145.4	82%	0.819	77%	0.767	S	S	*	*			trans	107.1	102	156.1	-149.2	172.2	-151.3	168.3	4.6	113.6
290	E	24.1	Very low	28.1	Very low	120 Å²	120	143 Å²	143	56%	0.561	78%	0.777	S	S	*	*				71.9	115.6	70.6	-66.4	163	-166.3	0	0	115.1	R288	R288-E290 IonicContact CZ-OE1 3.59Å; R288-E290 IonicContact NE-OE1 3.21Å; R288-E290 PolarHBondContact NE-OE1 2.8Å; R288-E290 IonicContact NH2-OE1 3.25Å; R288-E290 PolarHBondContact NH2-OE1 3.24Å
291	S	24	Very low	28.2	Very low	124 Å²	124	137.1 Å²	137.1	87%	0.867	78%	0.779	S	S	*	*			trans	-172.6	174.7	133.6	31.1	0	0	0	0	109.5
292	S	27.1	Very low	27.8	Very low	113 Å²	113	137.2 Å²	137.2	79%	0.79	78%	0.78	S	S	*	*			trans	-150.2	-179.7	-165	-54.5	0	0	0	0	112.2
293	V	28.8	Very low	28.2	Very low	138 Å²	138	137.5 Å²	137.5	84%	0.836	78%	0.783	S	S	*	*			trans	78	136.4	177.6	-167.9	0	0	0	0	113.7	Y295	V293-Y295 HydrophobicContact CG1-CD2 4.45Å; V293-Y295 HydrophobicContact CG1-CE2 4.36Å
294	G	24.9	Very low	27.4	Very low	65 Å²	65	137.6 Å²	137.6	67%	0.67	79%	0.786	S	S	*	*			cis	167.7	-166.6	-8.1	0	0	0	0	0	114.3
295	Y	27.1	Very low	27.5	Very low	228 Å²	228	141 Å²	141	89%	0.894	80%	0.795	S	S	*	*			trans	83	150.8	172.3	-71.6	-83.2	0	0	0	121	V293	V293-Y295 HydrophobicContact CG1-CD2 4.45Å; V293-Y295 HydrophobicContact CG1-CE2 4.36Å
296	R	25.2	Very low	28.6	Very low	231 Å²	231	138 Å²	138	87%	0.872	79%	0.791	S	S	*	*			trans	-90.9	-167.9	177.5	-54.7	175.6	173.4	156.2	-5	109.2
297	V	28.3	Very low	28.8	Very low	129 Å²	129	138 Å²	138	78%	0.782	80%	0.799	S	S	*	*			cis	-157.6	-172	42	-137.7	0	0	0	0	110.4
298	P	41.5	Very low	28.9	Very low	113 Å²	113	139 Å²	139	73%	0.734	80%	0.802	S	S	*	*				-128.4	-165.7	-109	47.1	-30.5	0	0	0	116.7
299	A	25.8	Very low	29.6	Very low	103 Å²	103	135 Å²	135	85%	0.851	80%	0.801	S	S	*	*			trans	79.7	143.3	157.1	0	0	0	0	0	118.2
300	G	26.4	Very low	29.5	Very low	79 Å²	79	130.4 Å²	130.4	81%	0.814	80%	0.802	S	S	*	*			cis	167.9	174.9	-7.6	0	0	0	0	0	113
301	G	26.8	Very low	29.8	Very low	80 Å²	80	132.6 Å²	132.6	83%	0.825	82%	0.816	S	S	*	*			trans	106.3	100.7	166.6	0	0	0	0	0	116.7
302	D	23.8	Very low	29.8	Very low	159 Å²	159	136 Å²	136	85%	0.85	82%	0.819	S	S	*	*			trans	-76.3	-170.6	154.4	-62.1	-71.7	0	0	0	110.4
303	P	49.5	Very low	29.8	Very low	123 Å²	123	138.9 Å²	138.9	80%	0.799	82%	0.82	S	S	*	*				-132.1	176.2	-64.6	38.6	-24.3	0	0	0	112.7
304	S	25.3	Very low	29.7	Very low	118 Å²	118	138.8 Å²	138.8	83%	0.825	82%	0.819	S	S	*	*			trans	-155.9	148	157.1	59.9	0	0	0	0	113.3
305	L	27.8	Very low	29.6	Very low	170 Å²	170	142.3 Å²	142.3	89%	0.89	82%	0.823	S	S	*	*			trans	-95	-150.7	-179.1	-62.7	162.4	0	0	0	111.7
306	P	47.3	Very low	29.4	Very low	114 Å²	114	137.2 Å²	137.2	74%	0.74	82%	0.819	S	S	*	*				-106.6	-173.1	-128	36.6	-16.3	0	0	0	113.1
307	P	27.8	Very low	29.4	Very low	127 Å²	127	129.8 Å²	129.8	83%	0.825	82%	0.815	S	S	*	*				-149.2	171.9	95.8	39.5	-22.7	0	0	0	116.5
308	M	26.1	Very low	29.3	Very low	173 Å²	173	130 Å²	130	85%	0.852	82%	0.821	S	S	*	*			trans	-103.6	175.7	161.4	-80.4	-91.6	-75.8	0	0	108.8
309	P	40.3	Very low	28.6	Very low	112 Å²	112	130.4 Å²	130.4	73%	0.727	82%	0.824	S	S	*	*			cis	-130.4	-177	-34.1	37.1	-21.2	0	0	0	112.1
310	S	22.3	Very low	28.5	Very low	119 Å²	119	130.9 Å²	130.9	83%	0.832	82%	0.822	S	S	*	*			trans	-152.6	143	156.2	59.8	0	0	0	0	113
311	L	28.6	Very low	28.6	Very low	166 Å²	166	132.3 Å²	132.3	87%	0.869	82%	0.819	S	S	*	*			trans	-72.8	145.2	176.1	-77.8	155.7	0	0	0	112.2
312	Q	25.9	Very low	28.6	Very low	195 Å²	195	133 Å²	133	91%	0.911	81%	0.811	S	S	*	*			trans	-152.7	125.4	144.2	-135	167.3	26.7	0	0	111.1
313	E	26.6	Very low	28.7	Very low	174 Å²	174	133.6 Å²	133.6	81%	0.813	81%	0.809	S	S	*	*			trans	-92.5	134.9	169.8	-56.8	176.2	127.9	0	0	108.7
314	V	26.5	Very low	27.8	Very low	137 Å²	137	136.3 Å²	136.3	83%	0.83	81%	0.811	S	S	*	*				-171.2	133.4	127.2	-95.2	0	0	0	0	112.9
315	D	22	Very low	28	Very low	138 Å²	138	138.7 Å²	138.7	74%	0.738	81%	0.809	S	S	*	*			trans	39.5	118.3	145.7	-77.7	-60.9	0	0	0	125.4
316	C	24.3	Very low	27.9	Very low	122 Å²	122	134.1 Å²	134.1	82%	0.824	80%	0.802	S	S	*	*				49.4	95.5	118.1	-62.7	0	0	0	0	120.7
317	G	23.3	Very low	27	Very low	75 Å²	75	133.4 Å²	133.4	77%	0.773	81%	0.806	S	S	*	*			trans	-148.4	70.5	166.9	0	0	0	0	0	114.9	P319	G317-P319 WeakPolarHBondContact O-CD 3.36Å
318	S	27.3	Very low	27.3	Very low	132 Å²	132	133.8 Å²	133.8	92%	0.923	81%	0.809	S	S	*	*			trans	-98.6	121.6	177.7	-78.6	0	0	0	0	114.1
319	P	26.5	Very low	27.3	Very low	122 Å²	122	129.2 Å²	129.2	79%	0.792	81%	0.806	S	S	*	*			trans	-107.6	125.1	155.7	33.8	-27	0	0	0	112.7	G317	G317-P319 WeakPolarHBondContact O-CD 3.36Å
320	S	24.7	Very low	26.7	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	82%	0.815	S	S	*	*			trans	-47.6	131.7	175.6	163.1	0	0	0	0	116.5
321	S	27.1	Very low	27	Very low	108 Å²	108	135.7 Å²	135.7	76%	0.755	82%	0.818	S	S	*	*			trans	-135.9	118.5	152.4	-162.7	0	0	0	0	108.4
322	S	27.6	Very low	26.8	Very low	95 Å²	95	131.3 Å²	131.3	66%	0.664	81%	0.812	S	S	*	*				67.1	96.7	88.7	-146	0	0	0	0	113.8
323	E	26	Very low	26.9	Very low	172 Å²	172	127.1 Å²	127.1	80%	0.804	81%	0.805	S	S	*	*			trans	-92.2	100.3	170	-66.3	173.8	109.5	0	0	109.1
324	E	29.4	Very low	27.5	Very low	180 Å²	180	125 Å²	125	84%	0.841	81%	0.806	S	S	*	*			trans	-134.3	142.7	168.3	-172.5	160.3	-148.7	0	0	108.5
325	E	30.1	Very low	27.4	Very low	168 Å²	168	122.8 Å²	122.8	79%	0.785	80%	0.802	S	S	*	*			trans	-83.7	124	-174.3	-73.6	179.6	130.8	0	0	111
326	G	25.4	Very low	27.7	Very low	73 Å²	73	123 Å²	123	75%	0.753	81%	0.809	S	S	*	*			trans	-148.6	140.1	174.5	0	0	0	0	0	111.3
327	A	28.8	Very low	27.8	Very low	99 Å²	99	122 Å²	122	82%	0.818	80%	0.803	S	S	*	*			trans	-79.6	153.7	-179.3	0	0	0	0	0	112
328	P	33.6	Very low	28.5	Very low	136 Å²	136	124.3 Å²	124.3	88%	0.883	80%	0.804	S	S	*	*			trans	-77.9	141.1	-172.9	31.2	-35.3	0	0	0	113.2
329	G	27	Very low	28.7	Very low	76 Å²	76	126.4 Å²	126.4	78%	0.784	80%	0.799	S	S	*	*			trans	-136.3	150	174.9	0	0	0	0	0	112
330	S	27.3	Very low	28.9	Very low	133 Å²	133	129.4 Å²	129.4	93%	0.93	81%	0.808	S	S	*	*			trans	-40.7	157.9	-167.4	-159.4	0	0	0	0	119.7
331	R	28.5	Very low	29.1	Very low	235 Å²	235	127 Å²	127	89%	0.887	80%	0.801	S	S	*	*			trans	-92.7	134.8	-174.3	-177.1	-175.7	-174.8	-175.1	2.6	112
332	G	24.8	Very low	29.3	Very low	73 Å²	73	133.8 Å²	133.8	75%	0.753	81%	0.81	S	S	*	*			trans	-140	148.4	169.9	0	0	0	0	0	111
333	S	29	Very low	29.4	Very low	107 Å²	107	140.6 Å²	140.6	75%	0.748	82%	0.821	S	S	*	*			trans	-116.3	161.9	-173.4	-70.2	0	0	0	0	112.3
334	P	38.8	Very low	30	Very low	130 Å²	130	143.7 Å²	143.7	84%	0.844	83%	0.825	S	S	*	*			trans	-95.1	161.8	-155.1	37	-36.8	0	0	0	114.9
335	A	25	Very low	30.4	Very low	90 Å²	90	141.1 Å²	141.1	74%	0.744	82%	0.824	S	S	*	*			trans	-148.6	130.5	167.4	0	0	0	0	0	113
336	T	27.9	Very low	31	Very low	143 Å²	143	141.2 Å²	141.2	88%	0.877	83%	0.829	S	S	*	*			trans	52.3	130.9	153.4	33.4	0	0	0	0	123.2
337	S	26.4	Very low	31.7	Very low	101 Å²	101	145.9 Å²	145.9	71%	0.706	84%	0.836	S	S	*	*			trans	-70.4	176.1	158.6	-121.5	0	0	0	0	111.7
338	P	38.3	Very low	32.4	Very low	124 Å²	124	152.9 Å²	152.9	81%	0.805	84%	0.841	S	S	*	*			cis	-137	179.1	33.5	40.5	-20.8	0	0	0	117.9
339	H	31	Very low	33	Very low	176 Å²	176	151.8 Å²	151.8	82%	0.815	84%	0.837	S	S	*	*			trans	-65.8	144.1	177.7	-60.3	-99.4	0	0	0	114.3
340	L	30.4	Very low	33.4	Very low	185 Å²	185	154.4 Å²	154.4	97%	0.969	83%	0.83	S	S	*	*			trans	-148.7	156.9	139.7	-106.3	168.9	0	0	0	109.5
341	G	29.1	Very low	34.4	Very low	63 Å²	63	150.6 Å²	150.6	65%	0.649	80%	0.804	S	S	*	*			trans	-104.2	176.1	-158.5	0	0	0	0	0	117.6
342	R	31.9	Very low	35.5	Very low	250 Å²	250	143.6 Å²	143.6	94%	0.943	80%	0.796	S	S	*	*			trans	64.9	123	-177.6	-59.3	179	168	-157.1	-3.4	113.4
343	R	28.9	Very low	36.7	Very low	239 Å²	239	143 Å²	143	90%	0.902	78%	0.784	S	S	*	*			cis	-139.6	149.3	32.5	-62.6	174.8	175	-161.9	-3.1	111.9
344	R	37.8	Very low	37.5	Very low	237 Å²	237	143.8 Å²	143.8	89%	0.894	77%	0.774	S	S	*	*			trans	-80.2	129.4	166	-67.1	178.6	177.7	173	-0.7	109.3	L346	R344-L346 PolarHBondContact O-N 3.09Å
345	P	38.1	Very low	38	Very low	125 Å²	125	140.8 Å²	140.8	81%	0.812	76%	0.755	S	S	*	*			trans	-64.1	127.3	166.9	-21.5	34	0	0	0	110.6	L347	P345-L347 VanDerWaalsContact C-N 3.33Å; P345-L347 PolarHBondContact O-N 3.16Å
346	L	42.1	Very low	39.2	Very low	171 Å²	171	137.8 Å²	137.8	90%	0.895	73%	0.729	S	S	*	*			trans	-87	62.3	-170.4	-162.8	86.5	0	0	0	112.6	R344	R344-L346 PolarHBondContact O-N 3.09Å
347	L	40.2	Very low	40.4	Very low	171 Å²	171	136.8 Å²	136.8	90%	0.895	72%	0.717	S	S	*	*			trans	-123.5	70.2	172.5	-72.3	178.5	0	0	0	111.3	P345	P345-L347 VanDerWaalsContact C-N 3.33Å; P345-L347 PolarHBondContact O-N 3.16Å
348	R	45.3	Very low	42	Very low	245 Å²	245	138.4 Å²	138.4	93%	0.925	72%	0.718	S	S	*	*			trans	-134.2	84.3	171.1	-172.9	-167.1	-176	101.6	-3.8	110.7
349	S	44.7	Very low	43.6	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	69%	0.69	S	S	*	*			trans	-175.9	68.7	147.9	-164.2	0	0	0	0	111.7
350	M	36.7	Very low	45.8	Very low	131 Å²	131	127.2 Å²	127.2	65%	0.645	66%	0.663	S	S	*	*			trans	-89.5	126.1	146	-70.9	-167.6	76.9	0	0	106.2	F354 L358	M350-F354 HydrophobicContact CE-CB 4.19Å; M350-L358 HydrophobicContact CE-CD1 4.46Å
351	S	47.5	Very low	48.3	Very low	53 Å²	53	122.1 Å²	122.1	37%	0.371	63%	0.634	S	S	.	*			trans	-67.8	155.9	-175.9	77.8	0	0	0	0	111.1	A353 F354 C355	S351-A353 PolarHBondContact O-N 3.48Å; S351-A353 VanDerWaalsContact O-N 3.14Å; S351-A353 PolarHBondContact OG-N 3.43Å; S351-F354 PolarHBondContact O-N 3Å; S351-F354 PolarHBondContact OG-N 3.22Å; S351-C355 PolarHBondContact O-N 2.86Å
352	A	51.3	Low	51	Low	88 Å²	88	128 Å²	128	73%	0.727	64%	0.637	S	S	*	*	H	α-helix	trans	-55.2	-32.8	175.4	0	0	0	0	0	112	C355 S356	A352-C355 PolarHBondContact O-N 3.36Å; A352-S356 PolarHBondContact O-N 2.9Å; A352-S356 PolarHBondContact O-OG 3.06Å; A352-S356 VanDerWaalsContact O-OG 3.05Å
353	A	49.5	Very low	53.4	Low	60 Å²	60	119.4 Å²	119.4	50%	0.496	61%	0.607	S	S	.	*	H	α-helix	trans	-62.2	-43.6	176	0	0	0	0	0	113	S351 C355 S356 L357	S351-A353 PolarHBondContact O-N 3.48Å; S351-A353 VanDerWaalsContact O-N 3.14Å; S351-A353 PolarHBondContact OG-N 3.43Å; A353-C355 VanDerWaalsContact C-N 3.34Å; A353-S356 VanDerWaalsContact C-OG 3.29Å; A353-S356 VanDerWaalsContact CA-OG 3.27Å; A353-S356 WeakPolarHBondContact CA-OG 3.46Å; A353-S356 PolarHBondContact O-N 3.26Å; A353-S356 PolarHBondContact O-OG 3.01Å; A353-L357 PolarHBondContact O-N 3.09Å
354	F	47	Very low	56.2	Low	124 Å²	124	108.1 Å²	108.1	54%	0.544	57%	0.565	S	S	.	*	H	α-helix	trans	-65.5	-36.7	173.6	-88.2	-80.6	0	0	0	112.1	M350 S351 S356 L357 L358	M350-F354 HydrophobicContact CE-CB 4.19Å; S351-F354 PolarHBondContact O-N 3Å; S351-F354 PolarHBondContact OG-N 3.22Å; F354-S356 VanDerWaalsContact C-N 3.33Å; F354-S356 PolarHBondContact O-N 2.99Å; F354-L357 PolarHBondContact O-N 3.43Å; F354-L358 PolarHBondContact O-N 2.89Å
355	C	48.5	Very low	58.6	Low	66 Å²	66	97.7 Å²	97.7	45%	0.446	53%	0.531	S	S	.	.	H	α-helix	trans	-69.1	-27.1	175.7	-64.7	0	0	0	0	113.6	S351 A352 A353	S351-C355 PolarHBondContact O-N 2.86Å; A352-C355 PolarHBondContact O-N 3.36Å; A353-C355 VanDerWaalsContact C-N 3.34Å
356	S	50.9	Low	61	Low	27 Å²	27	100.7 Å²	100.7	19%	0.189	53%	0.526	C	S	.	.	H	α-helix	trans	-68.3	-44.1	171.1	21	0	0	0	0	112.7	A352 A353 F354 L358 A359	A352-S356 PolarHBondContact O-N 2.9Å; A352-S356 PolarHBondContact O-OG 3.06Å; A352-S356 VanDerWaalsContact O-OG 3.05Å; A353-S356 VanDerWaalsContact C-OG 3.29Å; A353-S356 VanDerWaalsContact CA-OG 3.27Å; A353-S356 WeakPolarHBondContact CA-OG 3.46Å; A353-S356 PolarHBondContact O-N 3.26Å; A353-S356 PolarHBondContact O-OG 3.01Å; F354-S356 VanDerWaalsContact C-N 3.33Å; F354-S356 PolarHBondContact O-N 2.99Å; S356-L358 VanDerWaalsContact C-N 3.25Å; S356-L358 PolarHBondContact O-N 3.18Å; S356-A359 CarbonylContact O-C 3.56Å; S356-A359 PolarHBondContact O-N 2.9Å; S356-A359 VanDerWaalsContact O-N 3.09Å
357	L	53.6	Low	63.3	Low	122 Å²	122	93.9 Å²	93.9	64%	0.639	49%	0.494	S	S	*	.	H	α-helix	trans	-58.6	-37	179.2	-71.3	168.3	0	0	0	112.4	A353 F354 A359	A353-L357 PolarHBondContact O-N 3.09Å; F354-L357 PolarHBondContact O-N 3.43Å; L357-A359 VanDerWaalsContact C-N 3.35Å
358	L	59.6	Low	65.7	Low	136 Å²	136	85.7 Å²	85.7	71%	0.712	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-8.8	-180	-64.9	173.1	0	0	0	114.3	M350 F354 S356	M350-L358 HydrophobicContact CE-CD1 4.46Å; F354-L358 PolarHBondContact O-N 2.89Å; S356-L358 VanDerWaalsContact C-N 3.25Å; S356-L358 PolarHBondContact O-N 3.18Å
359	A	71.4	Confident	67.9	Low	27 Å²	27	75.3 Å²	75.3	22%	0.223	42%	0.418	C	S	.	.			trans	-152.5	60.9	-177.9	0	0	0	0	0	113.7	S356 L357 E361 R362 Q363	S356-A359 CarbonylContact O-C 3.56Å; S356-A359 PolarHBondContact O-N 2.9Å; S356-A359 VanDerWaalsContact O-N 3.09Å; L357-A359 VanDerWaalsContact C-N 3.35Å; A359-E361 PolarHBondContact O-N 3.3Å; A359-R362 HydrophobicContact CB-CB 3.99Å; A359-R362 HydrophobicContact CB-CG 4.1Å; A359-R362 WeakPolarHBondContact O-CA 3.46Å; A359-R362 WeakPolarHBondContact O-CB 3.43Å; A359-R362 PolarHBondContact O-N 3.2Å; A359-Q363 PolarHBondContact O-N 3.28Å
360	P	77.6	Confident	70.1	Confident	37 Å²	37	72.5 Å²	72.5	24%	0.24	40%	0.401	C	S	.	.	H	α-helix	trans	-57.4	-35.1	-177.7	22.3	-33.8	0	0	0	112.8	R362 Q363 V364 L423	P360-R362 VanDerWaalsContact C-N 3.3Å; P360-R362 PolarHBondContact O-N 3.21Å; P360-Q363 PolarHBondContact O-N 3.45Å; P360-Q363 VanDerWaalsContact O-N 3.13Å; P360-V364 WeakPolarHBondContact O-CG2 3.5Å; P360-V364 PolarHBondContact O-N 3.3Å; P360-L423 HydrophobicContact CB-CD2 4.04Å; P360-L423 HydrophobicContact CB-CG 4.46Å; P360-L423 HydrophobicContact CG-CD2 4.06Å
361	E	83.5	Confident	72.8	Confident	79 Å²	79	67.9 Å²	67.9	37%	0.369	38%	0.379	S	S	.	.	H	α-helix	trans	-61.7	-35.2	174.7	-60.6	177.3	-179.1	0	0	112.9	A359 G365 L423 R427 V431	A359-E361 PolarHBondContact O-N 3.3Å; E361-G365 PolarHBondContact O-N 3.4Å; E361-G365 VanDerWaalsContact O-N 3.11Å; E361-L423 HydrophobicContact CG-CD1 4.18Å; E361-L423 HydrophobicContact CG-CD2 3.77Å; E361-R427 WeakPolarHBondContact OE1-CD 3.4Å; E361-R427 IonicContact OE1-CZ 3.03Å; E361-R427 IonicContact OE1-NE 3.75Å; E361-R427 IonicContact OE1-NH1 3.54Å; E361-R427 PolarHBondContact OE1-NH1 2.83Å; E361-V431 HydrophobicContact CB-CG2 3.9Å; E361-V431 HydrophobicContact CG-CG2 4.05Å; E361-V431 WeakPolarHBondContact O-CG1 3.3Å
362	R	84.7	Confident	75.1	Confident	187 Å²	187	65.4 Å²	65.4	71%	0.706	36%	0.362	S	S	*	.	H	α-helix	trans	-77.2	-31.2	174.5	-64.4	-177.3	176.4	177.7	-4.2	111.7	A359 P360 R366	A359-R362 HydrophobicContact CB-CB 3.99Å; A359-R362 HydrophobicContact CB-CG 4.1Å; A359-R362 WeakPolarHBondContact O-CA 3.46Å; A359-R362 WeakPolarHBondContact O-CB 3.43Å; A359-R362 PolarHBondContact O-N 3.2Å; P360-R362 VanDerWaalsContact C-N 3.3Å; P360-R362 PolarHBondContact O-N 3.21Å; R362-R366 VanDerWaalsContact O-CG 3.26Å; R362-R366 WeakPolarHBondContact O-CG 3.2Å; R362-R366 PolarHBondContact O-N 2.83Å; R362-R366 VanDerWaalsContact O-N 3.16Å
363	Q	83.4	Confident	77.1	Confident	69 Å²	69	68 Å²	68	32%	0.322	36%	0.359	S	S	.	.	H	α-helix	trans	-69.5	-48.9	175.1	-171.2	-174.7	11.3	0	0	111.3	A359 P360 G365 R366 A367 K421	A359-Q363 PolarHBondContact O-N 3.28Å; P360-Q363 PolarHBondContact O-N 3.45Å; P360-Q363 VanDerWaalsContact O-N 3.13Å; Q363-G365 PolarHBondContact O-N 3.22Å; Q363-R366 WeakPolarHBondContact O-CB 3.49Å; Q363-R366 PolarHBondContact O-N 2.88Å; Q363-R366 VanDerWaalsContact O-N 3.17Å; Q363-A367 PolarHBondContact O-N 3.14Å; Q363-K421 HydrophobicContact CG-CD 4.36Å
364	V	87.6	Confident	79.2	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.012	35%	0.353	C	S	.	.	H	α-helix	trans	-61	-44.1	176.2	170.8	0	0	0	0	110.9	P360 R366 A367 A368 L417 K421 L423 L428 V431 L432	P360-V364 WeakPolarHBondContact O-CG2 3.5Å; P360-V364 PolarHBondContact O-N 3.3Å; V364-R366 VanDerWaalsContact C-N 3.28Å; V364-R366 PolarHBondContact O-N 3.12Å; V364-A367 PolarHBondContact O-N 3.49Å; V364-A368 WeakPolarHBondContact O-CB 3.34Å; V364-A368 PolarHBondContact O-N 3.03Å; V364-L417 HydrophobicContact CG1-CD1 4.3Å; V364-K421 HydrophobicContact CG2-CB 3.55Å; V364-K421 HydrophobicContact CG2-CD 4.33Å; V364-K421 HydrophobicContact CG2-CG 4.33Å; V364-L423 HydrophobicContact CB-CD1 4.07Å; V364-L423 HydrophobicContact CG1-CD1 4.28Å; V364-L423 HydrophobicContact CG2-CD1 3.82Å; V364-L423 HydrophobicContact CG2-CG 4.38Å; V364-L428 HydrophobicContact CG1-CD1 3.6Å; V364-V431 HydrophobicContact CB-CG1 4.06Å; V364-V431 HydrophobicContact CG1-CB 4.38Å; V364-V431 HydrophobicContact CG1-CG1 3.73Å; V364-L432 HydrophobicContact CG1-CD2 4.26Å
365	G	88.2	Confident	81.4	Confident	17 Å²	17	68.8 Å²	68.8	18%	0.175	35%	0.351	C	S	.	.	H	α-helix	trans	-63.1	-29.8	175.7	0	0	0	0	0	114.2	E361 Q363 A369 S435	E361-G365 PolarHBondContact O-N 3.4Å; E361-G365 VanDerWaalsContact O-N 3.11Å; Q363-G365 PolarHBondContact O-N 3.22Å; G365-A369 VanDerWaalsContact O-CB 3.31Å; G365-A369 WeakPolarHBondContact O-CB 3.42Å; G365-A369 PolarHBondContact O-N 3.31Å; G365-S435 WeakPolarHBondContact CA-OG 3.37Å
366	R	88.1	Confident	83.4	Confident	189 Å²	189	74.2 Å²	74.2	71%	0.713	37%	0.369	S	S	*	.	H	α-helix	trans	-74.5	-42.7	171.6	-75.5	170.4	-179.7	175.5	-0.3	112.1	R362 Q363 V364 A369 A370	R362-R366 VanDerWaalsContact O-CG 3.26Å; R362-R366 WeakPolarHBondContact O-CG 3.2Å; R362-R366 PolarHBondContact O-N 2.83Å; R362-R366 VanDerWaalsContact O-N 3.16Å; Q363-R366 WeakPolarHBondContact O-CB 3.49Å; Q363-R366 PolarHBondContact O-N 2.88Å; Q363-R366 VanDerWaalsContact O-N 3.17Å; V364-R366 VanDerWaalsContact C-N 3.28Å; V364-R366 PolarHBondContact O-N 3.12Å; R366-A369 PolarHBondContact O-N 2.97Å; R366-A370 PolarHBondContact O-N 3.22Å
367	A	89.1	Confident	85.5	Confident	27 Å²	27	74.1 Å²	74.1	22%	0.223	37%	0.367	C	S	.	.	H	α-helix	trans	-63.4	-46.7	177.9	0	0	0	0	0	111.3	Q363 V364 A369 A370 L371 L417	Q363-A367 PolarHBondContact O-N 3.14Å; V364-A367 PolarHBondContact O-N 3.49Å; A367-A369 VanDerWaalsContact C-N 3.28Å; A367-A369 PolarHBondContact O-N 3.11Å; A367-A370 PolarHBondContact O-N 3.38Å; A367-A370 VanDerWaalsContact O-N 3.12Å; A367-L371 WeakPolarHBondContact O-CG 3.45Å; A367-L371 PolarHBondContact O-N 3.38Å; A367-L417 HydrophobicContact CB-CD2 3.59Å
368	A	91.3	Very high	87.4	Confident	0 Å²	0	71 Å²	71	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-59.5	-37.9	173.3	0	0	0	0	0	112.4	V364 M372 L413 L417 L432	V364-A368 WeakPolarHBondContact O-CB 3.34Å; V364-A368 PolarHBondContact O-N 3.03Å; A368-M372 HydrophobicContact CB-CE 4.25Å; A368-M372 WeakPolarHBondContact O-CB 3.42Å; A368-M372 WeakPolarHBondContact O-CE 3.46Å; A368-M372 VanDerWaalsContact O-CG 3.28Å; A368-M372 WeakPolarHBondContact O-CG 3.49Å; A368-M372 PolarHBondContact O-N 2.69Å; A368-L413 HydrophobicContact CB-CD1 4.5Å; A368-L417 HydrophobicContact CB-CD1 4.3Å; A368-L432 HydrophobicContact CB-CD2 3.7Å
369	A	92.2	Very high	89	Confident	27 Å²	27	64.5 Å²	64.5	22%	0.223	33%	0.325	C	S	.	.	H	α-helix	trans	-66.8	-34.1	175.2	0	0	0	0	0	113.4	G365 R366 A367 Q373	G365-A369 VanDerWaalsContact O-CB 3.31Å; G365-A369 WeakPolarHBondContact O-CB 3.42Å; G365-A369 PolarHBondContact O-N 3.31Å; R366-A369 PolarHBondContact O-N 2.97Å; A367-A369 VanDerWaalsContact C-N 3.28Å; A367-A369 PolarHBondContact O-N 3.11Å; A369-Q373 VanDerWaalsContact O-CG 3.29Å; A369-Q373 WeakPolarHBondContact O-CG 3.48Å; A369-Q373 PolarHBondContact O-N 3.13Å
370	A	91.6	Very high	90.1	Very high	54 Å²	54	63.2 Å²	63.2	45%	0.446	31%	0.314	S	S	.	.	H	α-helix	trans	-70.5	-47.9	174.6	0	0	0	0	0	111.8	R366 A367 M372 Q373 D374	R366-A370 PolarHBondContact O-N 3.22Å; A367-A370 PolarHBondContact O-N 3.38Å; A367-A370 VanDerWaalsContact O-N 3.12Å; A370-M372 VanDerWaalsContact C-N 3.33Å; A370-M372 PolarHBondContact O-N 3.37Å; A370-Q373 WeakPolarHBondContact O-CB 3.43Å; A370-Q373 PolarHBondContact O-N 3.43Å; A370-D374 PolarHBondContact O-N 2.86Å; A370-D374 VanDerWaalsContact O-N 3.08Å
371	L	92.8	Very high	91	Very high	35 Å²	35	64.7 Å²	64.7	18%	0.183	32%	0.318	C	S	.	.	H	α-helix	trans	-56	-46.9	174.5	-64.3	174.2	0	0	0	111	A367 Q373 D374 T377 G380 L413 E416 L417	A367-L371 WeakPolarHBondContact O-CG 3.45Å; A367-L371 PolarHBondContact O-N 3.38Å; L371-Q373 PolarHBondContact O-N 3.13Å; L371-D374 PolarHBondContact O-N 3.1Å; L371-D374 VanDerWaalsContact O-N 3.07Å; L371-T377 HydrophobicContact CD2-CG2 3.71Å; L371-T377 PolarHBondContact O-OG1 3.11Å; L371-G380 WeakPolarHBondContact O-CA 3.49Å; L371-L413 HydrophobicContact CB-CD2 3.69Å; L371-L413 HydrophobicContact CD1-CD2 3.81Å; L371-L413 HydrophobicContact CG-CD2 4.42Å; L371-E416 HydrophobicContact CD1-CB 3.99Å; L371-L417 HydrophobicContact CD1-CD2 3.62Å; L371-L417 HydrophobicContact CD1-CG 3.75Å
372	M	95.1	Very high	91.5	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.005	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-11.8	176.1	-75	-172.3	-76.8	0	0	115.3	A368 A370 V383 Q384 L413 L436	A368-M372 HydrophobicContact CB-CE 4.25Å; A368-M372 WeakPolarHBondContact O-CB 3.42Å; A368-M372 WeakPolarHBondContact O-CE 3.46Å; A368-M372 VanDerWaalsContact O-CG 3.28Å; A368-M372 WeakPolarHBondContact O-CG 3.49Å; A368-M372 PolarHBondContact O-N 2.69Å; A370-M372 VanDerWaalsContact C-N 3.33Å; A370-M372 PolarHBondContact O-N 3.37Å; M372-V383 HydrophobicContact CB-CG1 4.15Å; M372-V383 HydrophobicContact CG-CB 4.48Å; M372-V383 HydrophobicContact CG-CG1 4.36Å; M372-V383 HydrophobicContact CG-CG2 4.09Å; M372-V383 HydrophobicContact SD-CG2 4.33Å; M372-Q384 PolarHBondContact O-NE2 2.72Å; M372-L413 HydrophobicContact CE-CD1 4.35Å; M372-L413 HydrophobicContact CG-CD1 3.97Å; M372-L413 HydrophobicContact CG-CD2 4.24Å; M372-L413 HydrophobicContact SD-CD1 4.04Å; M372-L436 HydrophobicContact SD-CD2 3.53Å; M372-L436 VanDerWaalsContact SD-CD2 3.53Å; M372-L436 HydrophobicContact SD-CG 3.95Å
373	Q	93.5	Very high	92	Very high	143 Å²	143	53.9 Å²	53.9	67%	0.668	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-25.1	174.7	-73.8	173.2	-13	0	0	112.4	A369 A370 L371 R375	A369-Q373 VanDerWaalsContact O-CG 3.29Å; A369-Q373 WeakPolarHBondContact O-CG 3.48Å; A369-Q373 PolarHBondContact O-N 3.13Å; A370-Q373 WeakPolarHBondContact O-CB 3.43Å; A370-Q373 PolarHBondContact O-N 3.43Å; L371-Q373 PolarHBondContact O-N 3.13Å; Q373-R375 PolarHBondContact O-N 3.4Å
374	D	93.1	Very high	92.6	Very high	70 Å²	70	52.4 Å²	52.4	37%	0.374	27%	0.27	S	S	.	.			trans	-87.4	107.5	-177.8	-175.8	1.7	0	0	0	112	A370 L371 H376 T377 G380	A370-D374 PolarHBondContact O-N 2.86Å; A370-D374 VanDerWaalsContact O-N 3.08Å; L371-D374 PolarHBondContact O-N 3.1Å; L371-D374 VanDerWaalsContact O-N 3.07Å; D374-H376 PolarHBondContact O-N 3.21Å; D374-H376 WeakPolarHBondContact OD1-CB 3.45Å; D374-H376 IonicContact OD1-CD2 3.45Å; D374-H376 PolarHBondContact OD1-CD2 3.23Å; D374-H376 IonicContact OD1-CG 3.9Å; D374-H376 PolarHBondContact OD1-N 3.11Å; D374-T377 HydrophobicContact CB-CG2 4Å; D374-T377 PolarHBondContact O-N 3.21Å; D374-T377 VanDerWaalsContact O-N 3.09Å; D374-T377 PolarHBondContact O-OG1 3.32Å; D374-G380 WeakPolarHBondContact O-CA 3.43Å
375	R	93.4	Very high	92.8	Very high	130 Å²	130	55 Å²	55	49%	0.491	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.3	176.8	-71.1	-172.5	177.6	-150.3	-5.9	114.2	Q373 T377 Q381 Q384	Q373-R375 PolarHBondContact O-N 3.4Å; R375-T377 VanDerWaalsContact C-N 3.28Å; R375-Q381 PolarHBondContact O-OE1 3.01Å; R375-Q384 HydrophobicContact CG-CB 4.03Å; R375-Q384 HydrophobicContact CG-CG 3.86Å
376	H	91.3	Very high	93	Very high	180 Å²	180	54.6 Å²	54.6	83%	0.833	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-12.1	174.5	-56.1	-66.6	0	0	0	112.6	D374	D374-H376 PolarHBondContact O-N 3.21Å; D374-H376 WeakPolarHBondContact OD1-CB 3.45Å; D374-H376 IonicContact OD1-CD2 3.45Å; D374-H376 PolarHBondContact OD1-CD2 3.23Å; D374-H376 IonicContact OD1-CG 3.9Å; D374-H376 PolarHBondContact OD1-N 3.11Å
377	T	94.1	Very high	93.3	Very high	24 Å²	24	46.1 Å²	46.1	15%	0.147	25%	0.246	C	C	.	.	S	Bend	trans	-89.5	149.2	170.6	71.9	0	0	0	0	110.5	L371 D374 R375 G380 Q381	L371-T377 HydrophobicContact CD2-CG2 3.71Å; L371-T377 PolarHBondContact O-OG1 3.11Å; D374-T377 HydrophobicContact CB-CG2 4Å; D374-T377 PolarHBondContact O-N 3.21Å; D374-T377 VanDerWaalsContact O-N 3.09Å; D374-T377 PolarHBondContact O-OG1 3.32Å; R375-T377 VanDerWaalsContact C-N 3.28Å; T377-G380 PolarHBondContact O-N 3Å; T377-G380 VanDerWaalsContact OG1-CA 3.29Å; T377-G380 WeakPolarHBondContact OG1-CA 3.27Å; T377-G380 PolarHBondContact OG1-N 3.49Å; T377-Q381 WeakPolarHBondContact O-CB 3.46Å; T377-Q381 PolarHBondContact O-N 2.96Å
378	A	93	Very high	93.4	Very high	57 Å²	57	47.9 Å²	47.9	47%	0.471	25%	0.254	S	S	.	.	H	α-helix	trans	-71	-38.3	-177.5	0	0	0	0	0	111.3	L382 M412 E416	A378-L382 WeakPolarHBondContact O-CB 3.34Å; A378-L382 PolarHBondContact O-N 3.11Å; A378-L382 VanDerWaalsContact O-N 3.14Å; A378-M412 HydrophobicContact CB-CE 3.46Å; A378-M412 VanDerWaalsContact CB-CE 3.46Å; A378-M412 VanDerWaalsContact O-CE 3.28Å; A378-M412 WeakPolarHBondContact O-CE 3.36Å; A378-E416 WeakPolarHBondContact CA-OE1 3.38Å; A378-E416 WeakPolarHBondContact CB-OE1 3.17Å; A378-E416 PolarHBondContact N-OE1 2.79Å
379	A	93.3	Very high	93.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-67	-38.5	173.6	0	0	0	0	0	112.3	V383 M412 L413 E416	A379-V383 WeakPolarHBondContact O-CB 3.49Å; A379-V383 WeakPolarHBondContact O-CG2 3.46Å; A379-V383 PolarHBondContact O-N 3.46Å; A379-M412 HydrophobicContact CB-CB 3.85Å; A379-L413 HydrophobicContact CB-CD2 3.8Å; A379-L413 HydrophobicContact CB-CG 3.82Å; A379-E416 WeakPolarHBondContact CB-OE2 3.36Å; A379-E416 PolarHBondContact N-OE1 3.33Å
380	G	95.6	Very high	93.1	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.7	-47.2	176.1	0	0	0	0	0	112.6	L371 D374 T377 L382 V383 Q384	L371-G380 WeakPolarHBondContact O-CA 3.49Å; D374-G380 WeakPolarHBondContact O-CA 3.43Å; T377-G380 PolarHBondContact O-N 3Å; T377-G380 VanDerWaalsContact OG1-CA 3.29Å; T377-G380 WeakPolarHBondContact OG1-CA 3.27Å; T377-G380 PolarHBondContact OG1-N 3.49Å; G380-L382 PolarHBondContact O-N 3.48Å; G380-V383 PolarHBondContact O-N 3.15Å; G380-Q384 WeakPolarHBondContact O-CB 3.35Å; G380-Q384 VanDerWaalsContact O-CG 3.29Å; G380-Q384 WeakPolarHBondContact O-CG 3.11Å; G380-Q384 PolarHBondContact O-N 3.11Å
381	Q	95.6	Very high	93	Very high	68 Å²	68	55.4 Å²	55.4	32%	0.318	27%	0.27	S	S	.	.	H	α-helix	trans	-56.6	-50.3	174.6	-176	57.2	25.8	0	0	111.3	R375 T377 V383 Q384 D385	R375-Q381 PolarHBondContact O-OE1 3.01Å; T377-Q381 WeakPolarHBondContact O-CB 3.46Å; T377-Q381 PolarHBondContact O-N 2.96Å; Q381-V383 VanDerWaalsContact C-N 3.3Å; Q381-V383 PolarHBondContact O-N 3.01Å; Q381-Q384 PolarHBondContact O-N 3.13Å; Q381-D385 PolarHBondContact NE2-OD1 2.73Å; Q381-D385 PolarHBondContact NE2-OD2 2.82Å; Q381-D385 WeakPolarHBondContact O-CB 3.24Å; Q381-D385 PolarHBondContact O-N 2.65Å
382	L	95.3	Very high	92.6	Very high	37 Å²	37	57.7 Å²	57.7	19%	0.194	29%	0.293	C	S	.	.	H	α-helix	trans	-57.5	-39.9	176.8	177.5	62.7	0	0	0	112.8	A378 G380 L386 R408 A409 M412	A378-L382 WeakPolarHBondContact O-CB 3.34Å; A378-L382 PolarHBondContact O-N 3.11Å; A378-L382 VanDerWaalsContact O-N 3.14Å; G380-L382 PolarHBondContact O-N 3.48Å; L382-L386 VanDerWaalsContact O-CB 3.26Å; L382-L386 WeakPolarHBondContact O-CB 3.41Å; L382-L386 PolarHBondContact O-N 2.66Å; L382-R408 HydrophobicContact CD2-CB 3.81Å; L382-A409 HydrophobicContact CD2-CB 4.13Å; L382-M412 HydrophobicContact CD2-CE 4.49Å; L382-M412 HydrophobicContact CD2-SD 3.61Å
383	V	95.6	Very high	91.4	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.012	31%	0.306	C	S	.	.	H	α-helix	trans	-72.7	-39.9	178.8	162.5	0	0	0	0	112.3	M372 A379 G380 Q381 L387 A409 L436 V440	M372-V383 HydrophobicContact CB-CG1 4.15Å; M372-V383 HydrophobicContact CG-CB 4.48Å; M372-V383 HydrophobicContact CG-CG1 4.36Å; M372-V383 HydrophobicContact CG-CG2 4.09Å; M372-V383 HydrophobicContact SD-CG2 4.33Å; A379-V383 WeakPolarHBondContact O-CB 3.49Å; A379-V383 WeakPolarHBondContact O-CG2 3.46Å; A379-V383 PolarHBondContact O-N 3.46Å; G380-V383 PolarHBondContact O-N 3.15Å; Q381-V383 VanDerWaalsContact C-N 3.3Å; Q381-V383 PolarHBondContact O-N 3.01Å; V383-L387 HydrophobicContact CG1-CD1 4.01Å; V383-L387 WeakPolarHBondContact O-CB 3.27Å; V383-L387 VanDerWaalsContact O-CG 3.27Å; V383-L387 WeakPolarHBondContact O-CG 3.3Å; V383-L387 PolarHBondContact O-N 2.91Å; V383-A409 HydrophobicContact CG2-CB 3.92Å; V383-L436 HydrophobicContact CG2-CD2 4.24Å; V383-V440 HydrophobicContact CG1-CG2 3.74Å; V383-V440 HydrophobicContact CG2-CG2 4.22Å
384	Q	95.2	Very high	89.8	Confident	38 Å²	38	58 Å²	58	18%	0.178	31%	0.312	C	S	.	.	H	α-helix	trans	-71.3	-36.1	178	-66.6	-57.2	-41.5	0	0	111.9	M372 R375 G380 Q381 L387 T388	M372-Q384 PolarHBondContact O-NE2 2.72Å; R375-Q384 HydrophobicContact CG-CB 4.03Å; R375-Q384 HydrophobicContact CG-CG 3.86Å; G380-Q384 WeakPolarHBondContact O-CB 3.35Å; G380-Q384 VanDerWaalsContact O-CG 3.29Å; G380-Q384 WeakPolarHBondContact O-CG 3.11Å; G380-Q384 PolarHBondContact O-N 3.11Å; Q381-Q384 PolarHBondContact O-N 3.13Å; Q384-L387 PolarHBondContact O-N 2.82Å; Q384-T388 WeakPolarHBondContact O-CB 3.21Å; Q384-T388 PolarHBondContact O-N 3.06Å; Q384-T388 PolarHBondContact O-OG1 3.2Å
385	D	92.4	Very high	88.1	Confident	57 Å²	57	60.9 Å²	60.9	31%	0.305	32%	0.324	S	S	.	.	H	α-helix	trans	-66	-46.8	172.6	-72.6	-21	0	0	0	111.1	Q381 L387 T388 Q389	Q381-D385 PolarHBondContact NE2-OD1 2.73Å; Q381-D385 PolarHBondContact NE2-OD2 2.82Å; Q381-D385 WeakPolarHBondContact O-CB 3.24Å; Q381-D385 PolarHBondContact O-N 2.65Å; D385-L387 VanDerWaalsContact C-N 3.35Å; D385-L387 PolarHBondContact O-N 3.25Å; D385-T388 PolarHBondContact O-N 3.13Å; D385-T388 VanDerWaalsContact O-N 3.09Å; D385-Q389 WeakPolarHBondContact O-CB 3.48Å; D385-Q389 VanDerWaalsContact O-CG 3.26Å; D385-Q389 WeakPolarHBondContact O-CG 3.43Å; D385-Q389 PolarHBondContact O-N 2.97Å
386	L	91.9	Very high	86.4	Confident	8 Å²	8	58.8 Å²	58.8	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-58.1	-45.4	174.6	179.8	67.8	0	0	0	111.9	L382 T388 V390 I402 A405 V440	L382-L386 VanDerWaalsContact O-CB 3.26Å; L382-L386 WeakPolarHBondContact O-CB 3.41Å; L382-L386 PolarHBondContact O-N 2.66Å; L386-T388 VanDerWaalsContact C-N 3.29Å; L386-T388 PolarHBondContact O-N 2.87Å; L386-V390 HydrophobicContact CD1-CG2 4.01Å; L386-V390 HydrophobicContact CG-CG2 4.48Å; L386-V390 WeakPolarHBondContact O-CB 3.48Å; L386-V390 VanDerWaalsContact O-CG2 3.26Å; L386-V390 WeakPolarHBondContact O-CG2 3.46Å; L386-V390 PolarHBondContact O-N 2.73Å; L386-I402 HydrophobicContact CD1-CG1 4.35Å; L386-A405 HydrophobicContact CD1-CB 3.96Å; L386-A405 HydrophobicContact CD2-CB 3.75Å; L386-A405 HydrophobicContact CG-CB 4.39Å; L386-V440 HydrophobicContact CD2-CG1 3.79Å
387	L	93.4	Very high	84.6	Confident	10 Å²	10	53.5 Å²	53.5	5%	0.052	30%	0.303	C	S	.	.	H	α-helix	trans	-61	-37.5	175	-78.3	168.6	0	0	0	112.1	V383 Q384 D385 R391 P443 L444	V383-L387 HydrophobicContact CG1-CD1 4.01Å; V383-L387 WeakPolarHBondContact O-CB 3.27Å; V383-L387 VanDerWaalsContact O-CG 3.27Å; V383-L387 WeakPolarHBondContact O-CG 3.3Å; V383-L387 PolarHBondContact O-N 2.91Å; Q384-L387 PolarHBondContact O-N 2.82Å; D385-L387 VanDerWaalsContact C-N 3.35Å; D385-L387 PolarHBondContact O-N 3.25Å; L387-R391 WeakPolarHBondContact O-CB 3.19Å; L387-R391 VanDerWaalsContact O-CD 3.22Å; L387-R391 WeakPolarHBondContact O-CD 3.15Å; L387-R391 WeakPolarHBondContact O-CG 3.3Å; L387-R391 PolarHBondContact O-N 3.35Å; L387-P443 HydrophobicContact CD2-CG 4.15Å; L387-L444 HydrophobicContact CD2-CD1 4.04Å; L387-L444 HydrophobicContact CD2-CD2 3.97Å; L387-L444 HydrophobicContact CD2-CG 3.84Å
388	T	91.7	Very high	83.5	Confident	65 Å²	65	57.8 Å²	57.8	40%	0.399	32%	0.321	S	S	.	.	H	α-helix	trans	-74.2	-48.7	-179.7	-55.5	0	0	0	0	111	Q384 D385 L386 R391 A392	Q384-T388 WeakPolarHBondContact O-CB 3.21Å; Q384-T388 PolarHBondContact O-N 3.06Å; Q384-T388 PolarHBondContact O-OG1 3.2Å; D385-T388 PolarHBondContact O-N 3.13Å; D385-T388 VanDerWaalsContact O-N 3.09Å; L386-T388 VanDerWaalsContact C-N 3.29Å; L386-T388 PolarHBondContact O-N 2.87Å; T388-R391 PolarHBondContact O-N 3.26Å; T388-A392 WeakPolarHBondContact O-CB 3.36Å; T388-A392 PolarHBondContact O-N 3.07Å
389	Q	88.8	Confident	83.1	Confident	99 Å²	99	55.3 Å²	55.3	46%	0.463	30%	0.3	S	S	.	.	H	α-helix	trans	-58.9	-49	177.6	-70.9	171	13.2	0	0	111.9	D385 R391 A392 G393	D385-Q389 WeakPolarHBondContact O-CB 3.48Å; D385-Q389 VanDerWaalsContact O-CG 3.26Å; D385-Q389 WeakPolarHBondContact O-CG 3.43Å; D385-Q389 PolarHBondContact O-N 2.97Å; Q389-R391 PolarHBondContact O-N 2.58Å; Q389-A392 PolarHBondContact O-N 2.88Å; Q389-G393 PolarHBondContact O-N 3.42Å
390	V	88.6	Confident	82.4	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-27.3	180	179.2	0	0	0	0	111.5	L386 Q397 I402 L444 I447 L448 R451	L386-V390 HydrophobicContact CD1-CG2 4.01Å; L386-V390 HydrophobicContact CG-CG2 4.48Å; L386-V390 WeakPolarHBondContact O-CB 3.48Å; L386-V390 VanDerWaalsContact O-CG2 3.26Å; L386-V390 WeakPolarHBondContact O-CG2 3.46Å; L386-V390 PolarHBondContact O-N 2.73Å; V390-Q397 VanDerWaalsContact CG2-OE1 3.24Å; V390-I402 HydrophobicContact CG2-CD1 3.97Å; V390-I402 HydrophobicContact CG2-CG1 4.24Å; V390-L444 HydrophobicContact CB-CD1 4Å; V390-L444 HydrophobicContact CB-CD2 3.97Å; V390-L444 HydrophobicContact CG1-CB 4.5Å; V390-L444 HydrophobicContact CG1-CD1 3.96Å; V390-L444 HydrophobicContact CG1-CD2 3.77Å; V390-L444 HydrophobicContact CG1-CG 4.29Å; V390-L444 HydrophobicContact CG2-CD1 4.19Å; V390-I447 HydrophobicContact CG1-CG2 4.48Å; V390-L448 HydrophobicContact CG1-CD2 3.81Å; V390-R451 PolarHBondContact O-NH1 2.83Å; V390-R451 VanDerWaalsContact O-NH1 3.15Å; V390-R451 PolarHBondContact O-NH2 2.85Å
391	R	90	Very high	81.8	Confident	139 Å²	139	57.5 Å²	57.5	53%	0.525	32%	0.318	S	S	.	.	H	α-helix	trans	-80.8	-42.9	175.4	-74.1	170.9	-177.5	167.3	-0.4	113.8	L387 T388 Q389 L444 I447	L387-R391 WeakPolarHBondContact O-CB 3.19Å; L387-R391 VanDerWaalsContact O-CD 3.22Å; L387-R391 WeakPolarHBondContact O-CD 3.15Å; L387-R391 WeakPolarHBondContact O-CG 3.3Å; L387-R391 PolarHBondContact O-N 3.35Å; T388-R391 PolarHBondContact O-N 3.26Å; Q389-R391 PolarHBondContact O-N 2.58Å; R391-L444 HydrophobicContact CG-CD2 4.2Å; R391-I447 HydrophobicContact CG-CD1 3.78Å
392	A	83.8	Confident	81.5	Confident	82 Å²	82	54.2 Å²	54.2	68%	0.678	30%	0.302	S	S	*	.	H	α-helix	trans	-88.4	-32.8	-171.6	0	0	0	0	0	113.9	T388 Q389	T388-A392 WeakPolarHBondContact O-CB 3.36Å; T388-A392 PolarHBondContact O-N 3.07Å; Q389-A392 PolarHBondContact O-N 2.88Å
393	G	69.5	Low	81.2	Confident	26 Å²	26	53.7 Å²	53.7	27%	0.268	30%	0.298	S	S	.	.			trans	-72.3	136.1	-176.3	0	0	0	0	0	112.9	Q389 R451	Q389-G393 PolarHBondContact O-N 3.42Å; G393-R451 PolarHBondContact O-NH2 3.28Å
394	P	60.6	Low	80.8	Confident	124 Å²	124	57.7 Å²	57.7	81%	0.805	32%	0.316	S	S	*	.			trans	-69.7	-25.5	163.6	30	-33.6	0	0	0	111.4
395	E	56.7	Low	80.6	Confident	132 Å²	132	56.1 Å²	56.1	62%	0.617	31%	0.31	S	S	*	.	S	Bend	trans	-56.8	137.9	-174.2	-83	-61	110	0	0	114.8	Q397	E395-Q397 VanDerWaalsContact C-N 3.28Å; E395-Q397 PolarHBondContact O-N 3Å
396	P	57.4	Low	80.6	Confident	86 Å²	86	54 Å²	54	56%	0.558	30%	0.298	S	S	*	.			trans	-75.6	80.4	165	34.4	-33.8	0	0	0	109.8	E398	P396-E398 PolarHBondContact O-N 2.61Å
397	Q	55.4	Low	80.5	Confident	68 Å²	68	55.1 Å²	55.1	32%	0.318	31%	0.307	S	S	.	.			trans	-53.1	107.4	153.2	-81.5	-172.4	-14.2	0	0	107.5	V390 E395	V390-Q397 VanDerWaalsContact CG2-OE1 3.24Å; E395-Q397 VanDerWaalsContact C-N 3.28Å; E395-Q397 PolarHBondContact O-N 3Å
398	E	70.4	Confident	80.4	Confident	115 Å²	115	61 Å²	61	54%	0.537	33%	0.328	S	S	.	.			trans	-51.6	143.8	175.6	-61.2	-174.3	150.8	0	0	109.1	P396 Q400 G401 I402	P396-E398 PolarHBondContact O-N 2.61Å; E398-Q400 HydrophobicContact CB-CB 4.09Å; E398-Q400 PolarHBondContact O-N 2.86Å; E398-Q400 VanDerWaalsContact O-N 3.1Å; E398-G401 PolarHBondContact O-N 3.44Å; E398-I402 PolarHBondContact O-N 3.18Å
399	L	83.5	Confident	80.5	Confident	5 Å²	5	58 Å²	58	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-66.2	-21.7	-176.8	-48.8	172.4	0	0	0	110.3	G401 I402 R403 L448 V452 Y561 E564 L565	L399-G401 VanDerWaalsContact C-N 3.35Å; L399-G401 PolarHBondContact O-N 2.97Å; L399-I402 HydrophobicContact CD2-CD1 4.13Å; L399-I402 PolarHBondContact O-N 2.88Å; L399-R403 WeakPolarHBondContact O-CB 3.37Å; L399-R403 PolarHBondContact O-N 2.85Å; L399-L448 HydrophobicContact CD2-CB 4.28Å; L399-L448 HydrophobicContact CD2-CD1 4.19Å; L399-L448 HydrophobicContact CD2-CD2 3.87Å; L399-L448 HydrophobicContact CD2-CG 4.32Å; L399-V452 HydrophobicContact CD1-CG2 4.1Å; L399-Y561 HydrophobicContact CD1-CD2 4.05Å; L399-E564 HydrophobicContact CB-CB 3.6Å; L399-E564 HydrophobicContact CB-CG 4.38Å; L399-E564 WeakPolarHBondContact CB-OE2 3.42Å; L399-E564 HydrophobicContact CD1-CB 4.14Å; L399-E564 HydrophobicContact CG-CB 4.38Å; L399-E564 WeakPolarHBondContact CG-OE2 3.36Å; L399-E564 PolarHBondContact N-OE2 2.83Å; L399-L565 HydrophobicContact CB-CD2 3.82Å; L399-L565 HydrophobicContact CB-CG 3.89Å; L399-L565 HydrophobicContact CD1-CG 4.4Å; L399-L565 WeakPolarHBondContact O-CD2 3.26Å
400	Q	79.3	Confident	80.7	Confident	17 Å²	17	55 Å²	55	8%	0.079	30%	0.295	C	S	.	.	H	α-helix	trans	-47	-48.3	161.5	173.1	96.6	-19.9	0	0	113.1	E398 R403 Q404	E398-Q400 HydrophobicContact CB-CB 4.09Å; E398-Q400 PolarHBondContact O-N 2.86Å; E398-Q400 VanDerWaalsContact O-N 3.1Å; Q400-R403 VanDerWaalsContact CD-NH2 3.34Å; Q400-R403 WeakPolarHBondContact O-CB 3.33Å; Q400-R403 PolarHBondContact O-N 3.49Å; Q400-Q404 WeakPolarHBondContact O-CG 3.26Å; Q400-Q404 PolarHBondContact O-N 2.82Å
401	G	83.2	Confident	80.8	Confident	28 Å²	28	57.7 Å²	57.7	29%	0.289	32%	0.317	S	S	.	.	H	α-helix	trans	-70.4	-39.6	179.2	0	0	0	0	0	112.5	E398 L399 R403 Q404 A405	E398-G401 PolarHBondContact O-N 3.44Å; L399-G401 VanDerWaalsContact C-N 3.35Å; L399-G401 PolarHBondContact O-N 2.97Å; G401-R403 VanDerWaalsContact C-N 3.34Å; G401-R403 PolarHBondContact O-N 3.38Å; G401-Q404 PolarHBondContact O-N 3.48Å; G401-A405 PolarHBondContact O-N 2.93Å
402	I	89.4	Confident	80.9	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.9	-44.8	172.3	-62	177.8	0	0	0	110.1	L386 V390 E398 L399 A405 L406 L441 L448 L565	L386-I402 HydrophobicContact CD1-CG1 4.35Å; V390-I402 HydrophobicContact CG2-CD1 3.97Å; V390-I402 HydrophobicContact CG2-CG1 4.24Å; E398-I402 PolarHBondContact O-N 3.18Å; L399-I402 HydrophobicContact CD2-CD1 4.13Å; L399-I402 PolarHBondContact O-N 2.88Å; I402-A405 WeakPolarHBondContact O-CB 3.28Å; I402-A405 PolarHBondContact O-N 3.44Å; I402-L406 HydrophobicContact CG2-CD1 4.33Å; I402-L406 WeakPolarHBondContact O-CG 3.37Å; I402-L406 PolarHBondContact O-N 3.3Å; I402-L441 HydrophobicContact CG2-CD2 4.23Å; I402-L448 HydrophobicContact CD1-CD1 4.15Å; I402-L448 HydrophobicContact CD1-CD2 3.46Å; I402-L448 VanDerWaalsContact CD1-CD2 3.46Å; I402-L448 HydrophobicContact CD1-CG 4.46Å; I402-L565 HydrophobicContact CB-CD2 4.19Å; I402-L565 HydrophobicContact CG2-CD2 3.99Å
403	R	88.9	Confident	81.2	Confident	25 Å²	25	50 Å²	50	9%	0.094	27%	0.273	C	S	.	.	H	α-helix	trans	-57	-51.5	173.8	-178.3	-179	54.6	77	-2.7	111	L399 Q400 G401 A405 L406 S407 E564 L565 L566	L399-R403 WeakPolarHBondContact O-CB 3.37Å; L399-R403 PolarHBondContact O-N 2.85Å; Q400-R403 VanDerWaalsContact CD-NH2 3.34Å; Q400-R403 WeakPolarHBondContact O-CB 3.33Å; Q400-R403 PolarHBondContact O-N 3.49Å; G401-R403 VanDerWaalsContact C-N 3.34Å; G401-R403 PolarHBondContact O-N 3.38Å; R403-A405 PolarHBondContact O-N 3.31Å; R403-L406 CarbonylContact O-C 3.58Å; R403-L406 WeakPolarHBondContact O-CA 3.33Å; R403-L406 WeakPolarHBondContact O-CB 3.39Å; R403-L406 PolarHBondContact O-N 3.34Å; R403-S407 PolarHBondContact O-N 2.97Å; R403-S407 PolarHBondContact O-OG 3.28Å; R403-E564 VanDerWaalsContact CD-O 3.26Å; R403-E564 WeakPolarHBondContact CD-O 3.31Å; R403-E564 PolarHBondContact NE-O 3.19Å; R403-E564 VanDerWaalsContact NE-O 3.07Å; R403-L565 HydrophobicContact CB-CD2 4.48Å; R403-L565 WeakPolarHBondContact CD-O 3.37Å; R403-L565 WeakPolarHBondContact CG-O 3.5Å; R403-L566 WeakPolarHBondContact CD-O 3.3Å
404	Q	87.1	Confident	82.1	Confident	87 Å²	87	50.8 Å²	50.8	41%	0.407	28%	0.275	S	S	.	.	H	α-helix	trans	-58.4	-32.8	178	-71.3	171.5	5.2	0	0	113.1	Q400 G401 R408	Q400-Q404 WeakPolarHBondContact O-CG 3.26Å; Q400-Q404 PolarHBondContact O-N 2.82Å; G401-Q404 PolarHBondContact O-N 3.48Å; Q404-R408 WeakPolarHBondContact O-CG 3.48Å; Q404-R408 PolarHBondContact O-N 3.33Å; Q404-R408 VanDerWaalsContact O-N 3.16Å; Q404-R408 PolarHBondContact O-NE 3.06Å; Q404-R408 VanDerWaalsContact O-NE 3.09Å
405	A	91.1	Very high	83.4	Confident	4 Å²	4	50.5 Å²	50.5	3%	0.033	27%	0.27	C	S	.	.	H	α-helix	trans	-70.5	-40.5	172.3	0	0	0	0	0	112	L386 G401 I402 R403 R408 A409	L386-A405 HydrophobicContact CD1-CB 3.96Å; L386-A405 HydrophobicContact CD2-CB 3.75Å; L386-A405 HydrophobicContact CG-CB 4.39Å; G401-A405 PolarHBondContact O-N 2.93Å; I402-A405 WeakPolarHBondContact O-CB 3.28Å; I402-A405 PolarHBondContact O-N 3.44Å; R403-A405 PolarHBondContact O-N 3.31Å; A405-R408 PolarHBondContact O-N 2.89Å; A405-A409 WeakPolarHBondContact O-CB 3.21Å; A405-A409 PolarHBondContact O-N 2.91Å
406	L	92.5	Very high	84.9	Confident	12 Å²	12	47.3 Å²	47.3	6%	0.063	26%	0.256	C	S	.	.	H	α-helix	trans	-64.2	-39.6	172.5	-64.5	173.7	0	0	0	112.6	I402 R403 A409 R410 L436 V440 L441	I402-L406 HydrophobicContact CG2-CD1 4.33Å; I402-L406 WeakPolarHBondContact O-CG 3.37Å; I402-L406 PolarHBondContact O-N 3.3Å; R403-L406 CarbonylContact O-C 3.58Å; R403-L406 WeakPolarHBondContact O-CA 3.33Å; R403-L406 WeakPolarHBondContact O-CB 3.39Å; R403-L406 PolarHBondContact O-N 3.34Å; L406-A409 PolarHBondContact O-N 2.93Å; L406-R410 VanDerWaalsContact O-CB 3.3Å; L406-R410 WeakPolarHBondContact O-CB 3.42Å; L406-R410 PolarHBondContact O-N 2.98Å; L406-L436 HydrophobicContact CD2-CB 4.25Å; L406-L436 HydrophobicContact CD2-CD2 4.04Å; L406-V440 HydrophobicContact CD2-CB 3.86Å; L406-V440 HydrophobicContact CD2-CG1 3.89Å; L406-V440 HydrophobicContact CD2-CG2 4.02Å; L406-L441 HydrophobicContact CD1-CD1 4.18Å; L406-L441 HydrophobicContact CD1-CD2 3.95Å; L406-L441 HydrophobicContact CD1-CG 3.99Å
407	S	90.1	Very high	86.2	Confident	33 Å²	33	44.2 Å²	44.2	23%	0.231	23%	0.234	C	C	.	.	H	α-helix	trans	-60.4	-46.1	174.9	-44.9	0	0	0	0	111.1	R403 R410 A411 E567	R403-S407 PolarHBondContact O-N 2.97Å; R403-S407 PolarHBondContact O-OG 3.28Å; S407-R410 PolarHBondContact O-N 3.16Å; S407-A411 PolarHBondContact O-N 3.25Å; S407-A411 VanDerWaalsContact O-N 3.14Å; S407-E567 WeakPolarHBondContact CB-OE1 3.44Å; S407-E567 PolarHBondContact OG-OE1 2.83Å
408	R	91.6	Very high	86.9	Confident	133 Å²	133	42.6 Å²	42.6	50%	0.502	24%	0.235	S	C	.	.	H	α-helix	trans	-64.3	-50	176.1	-75.9	178.6	-70.9	163.2	-3.2	111.5	L382 Q404 A405 R410 A411 M412	L382-R408 HydrophobicContact CD2-CB 3.81Å; Q404-R408 WeakPolarHBondContact O-CG 3.48Å; Q404-R408 PolarHBondContact O-N 3.33Å; Q404-R408 VanDerWaalsContact O-N 3.16Å; Q404-R408 PolarHBondContact O-NE 3.06Å; Q404-R408 VanDerWaalsContact O-NE 3.09Å; A405-R408 PolarHBondContact O-N 2.89Å; R408-R410 VanDerWaalsContact C-N 3.27Å; R408-R410 PolarHBondContact O-N 2.9Å; R408-A411 WeakPolarHBondContact O-CB 3.5Å; R408-A411 PolarHBondContact O-N 3.04Å; R408-M412 HydrophobicContact CB-SD 4.44Å; R408-M412 VanDerWaalsContact O-CG 3.27Å; R408-M412 WeakPolarHBondContact O-CG 3.35Å; R408-M412 PolarHBondContact O-N 3.22Å
409	A	93.8	Very high	86.3	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-59	-36.9	177.6	0	0	0	0	0	112.4	L382 V383 A405 L406 M412 L413 L436	L382-A409 HydrophobicContact CD2-CB 4.13Å; V383-A409 HydrophobicContact CG2-CB 3.92Å; A405-A409 WeakPolarHBondContact O-CB 3.21Å; A405-A409 PolarHBondContact O-N 2.91Å; L406-A409 PolarHBondContact O-N 2.93Å; A409-M412 PolarHBondContact O-N 2.9Å; A409-L413 VanDerWaalsContact O-CB 3.31Å; A409-L413 WeakPolarHBondContact O-CB 3.49Å; A409-L413 WeakPolarHBondContact O-CG 3.41Å; A409-L413 PolarHBondContact O-N 2.92Å; A409-L436 HydrophobicContact CB-CD2 3.73Å
410	R	92.1	Very high	84.8	Confident	38 Å²	38	50.3 Å²	50.3	14%	0.143	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-42.9	172.9	-177.1	-176.4	-177.5	142.5	-2.8	112.2	L406 S407 R408 S414 E429 L432 E433 L436	L406-R410 VanDerWaalsContact O-CB 3.3Å; L406-R410 WeakPolarHBondContact O-CB 3.42Å; L406-R410 PolarHBondContact O-N 2.98Å; S407-R410 PolarHBondContact O-N 3.16Å; R408-R410 VanDerWaalsContact C-N 3.27Å; R408-R410 PolarHBondContact O-N 2.9Å; R410-S414 WeakPolarHBondContact O-CB 3.38Å; R410-S414 PolarHBondContact O-N 2.99Å; R410-S414 VanDerWaalsContact O-N 3.09Å; R410-S414 PolarHBondContact O-OG 3.07Å; R410-E429 IonicContact CZ-OE2 2.81Å; R410-E429 IonicContact NE-OE2 3.69Å; R410-E429 IonicContact NH2-OE2 2.7Å; R410-E429 PolarHBondContact NH2-OE2 3.06Å; R410-L432 HydrophobicContact CG-CB 4.45Å; R410-E433 IonicContact CZ-OE2 2.64Å; R410-E433 IonicContact NH1-OE2 3.22Å; R410-E433 PolarHBondContact NH1-OE2 3.42Å; R410-E433 IonicContact NH2-OE2 3.78Å; R410-E433 PolarHBondContact NH2-OE2 2.85Å; R410-L436 HydrophobicContact CB-CD1 3.62Å; R410-L436 HydrophobicContact CG-CD1 4.33Å
411	A	90.3	Very high	83.8	Confident	57 Å²	57	53 Å²	53	47%	0.471	29%	0.294	S	S	.	.	H	α-helix	trans	-66.1	-45.9	176.5	0	0	0	0	0	111.5	S407 R408 S414 V415	S407-A411 PolarHBondContact O-N 3.25Å; S407-A411 VanDerWaalsContact O-N 3.14Å; R408-A411 WeakPolarHBondContact O-CB 3.5Å; R408-A411 PolarHBondContact O-N 3.04Å; A411-S414 WeakPolarHBondContact O-CB 3.4Å; A411-S414 PolarHBondContact O-N 3.39Å; A411-S414 VanDerWaalsContact O-N 3.11Å; A411-V415 PolarHBondContact O-N 3.45Å
412	M	91.8	Very high	82.8	Confident	58 Å²	58	58.9 Å²	58.9	29%	0.286	32%	0.318	S	S	.	.	H	α-helix	trans	-62.7	-48.2	178.9	-63.3	162.1	80.1	0	0	111.3	A378 A379 L382 R408 A409 S414 V415 E416	A378-M412 HydrophobicContact CB-CE 3.46Å; A378-M412 VanDerWaalsContact CB-CE 3.46Å; A378-M412 VanDerWaalsContact O-CE 3.28Å; A378-M412 WeakPolarHBondContact O-CE 3.36Å; A379-M412 HydrophobicContact CB-CB 3.85Å; L382-M412 HydrophobicContact CD2-CE 4.49Å; L382-M412 HydrophobicContact CD2-SD 3.61Å; R408-M412 HydrophobicContact CB-SD 4.44Å; R408-M412 VanDerWaalsContact O-CG 3.27Å; R408-M412 WeakPolarHBondContact O-CG 3.35Å; R408-M412 PolarHBondContact O-N 3.22Å; A409-M412 PolarHBondContact O-N 2.9Å; M412-S414 PolarHBondContact O-N 3.35Å; M412-V415 PolarHBondContact O-N 2.88Å; M412-E416 WeakPolarHBondContact O-CG 3.4Å; M412-E416 PolarHBondContact O-N 3.2Å
413	L	90.9	Very high	82.1	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58.2	-32.6	172.5	-72.5	170.4	0	0	0	113	A368 L371 M372 A379 A409 V415 L417 L432 L436	A368-L413 HydrophobicContact CB-CD1 4.5Å; L371-L413 HydrophobicContact CB-CD2 3.69Å; L371-L413 HydrophobicContact CD1-CD2 3.81Å; L371-L413 HydrophobicContact CG-CD2 4.42Å; M372-L413 HydrophobicContact CE-CD1 4.35Å; M372-L413 HydrophobicContact CG-CD1 3.97Å; M372-L413 HydrophobicContact CG-CD2 4.24Å; M372-L413 HydrophobicContact SD-CD1 4.04Å; A379-L413 HydrophobicContact CB-CD2 3.8Å; A379-L413 HydrophobicContact CB-CG 3.82Å; A409-L413 VanDerWaalsContact O-CB 3.31Å; A409-L413 WeakPolarHBondContact O-CB 3.49Å; A409-L413 WeakPolarHBondContact O-CG 3.41Å; A409-L413 PolarHBondContact O-N 2.92Å; L413-V415 VanDerWaalsContact C-N 3.26Å; L413-V415 PolarHBondContact O-N 3.48Å; L413-L417 VanDerWaalsContact O-CB 3.29Å; L413-L417 WeakPolarHBondContact O-CB 3.46Å; L413-L417 WeakPolarHBondContact O-CD1 3.44Å; L413-L417 VanDerWaalsContact O-CG 3.22Å; L413-L417 WeakPolarHBondContact O-CG 3.45Å; L413-L417 PolarHBondContact O-N 2.82Å; L413-L417 VanDerWaalsContact O-N 3.1Å; L413-L432 HydrophobicContact CB-CD1 4.16Å; L413-L432 HydrophobicContact CB-CD2 4.32Å; L413-L436 HydrophobicContact CD1-CD1 4.23Å; L413-L436 HydrophobicContact CD1-CD2 4.15Å; L413-L436 HydrophobicContact CD1-CG 4.07Å
414	S	88.8	Confident	81.7	Confident	44 Å²	44	62.5 Å²	62.5	31%	0.308	34%	0.344	S	S	.	.	H	α-helix	trans	-70.8	-22.6	177.1	-57.4	0	0	0	0	112.9	R410 A411 M412 L432	R410-S414 WeakPolarHBondContact O-CB 3.38Å; R410-S414 PolarHBondContact O-N 2.99Å; R410-S414 VanDerWaalsContact O-N 3.09Å; R410-S414 PolarHBondContact O-OG 3.07Å; A411-S414 WeakPolarHBondContact O-CB 3.4Å; A411-S414 PolarHBondContact O-N 3.39Å; A411-S414 VanDerWaalsContact O-N 3.11Å; M412-S414 PolarHBondContact O-N 3.35Å; S414-L432 VanDerWaalsContact OG-CD1 3.24Å; S414-L432 WeakPolarHBondContact OG-CD1 3.45Å
415	V	88	Confident	81.3	Confident	117 Å²	117	63.1 Å²	63.1	71%	0.709	36%	0.356	S	S	*	.	H	α-helix	trans	-89.6	-48.2	174	177.8	0	0	0	0	110.6	A411 M412 L413 L417 G418	A411-V415 PolarHBondContact O-N 3.45Å; M412-V415 PolarHBondContact O-N 2.88Å; L413-V415 VanDerWaalsContact C-N 3.26Å; L413-V415 PolarHBondContact O-N 3.48Å; V415-L417 VanDerWaalsContact C-N 3.3Å; V415-L417 PolarHBondContact O-N 3.26Å; V415-G418 WeakPolarHBondContact O-CA 3.33Å; V415-G418 PolarHBondContact O-N 2.98Å
416	E	88	Confident	80.5	Confident	66 Å²	66	66.6 Å²	66.6	31%	0.308	37%	0.37	S	S	.	.	H	α-helix	trans	-64.1	-29	-177.8	-70.4	175.6	-177.9	0	0	113.8	L371 A378 A379 M412 G418	L371-E416 HydrophobicContact CD1-CB 3.99Å; A378-E416 WeakPolarHBondContact CA-OE1 3.38Å; A378-E416 WeakPolarHBondContact CB-OE1 3.17Å; A378-E416 PolarHBondContact N-OE1 2.79Å; A379-E416 WeakPolarHBondContact CB-OE2 3.36Å; A379-E416 PolarHBondContact N-OE1 3.33Å; M412-E416 WeakPolarHBondContact O-CG 3.4Å; M412-E416 PolarHBondContact O-N 3.2Å; E416-G418 VanDerWaalsContact C-N 3.25Å; E416-G418 PolarHBondContact O-N 3.45Å
417	L	84.1	Confident	80	Confident	21 Å²	21	72.7 Å²	72.7	11%	0.11	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-12.1	173.2	-71.1	167.9	0	0	0	113.6	V364 A367 A368 L371 L413 V415 L432	V364-L417 HydrophobicContact CG1-CD1 4.3Å; A367-L417 HydrophobicContact CB-CD2 3.59Å; A368-L417 HydrophobicContact CB-CD1 4.3Å; L371-L417 HydrophobicContact CD1-CD2 3.62Å; L371-L417 HydrophobicContact CD1-CG 3.75Å; L413-L417 VanDerWaalsContact O-CB 3.29Å; L413-L417 WeakPolarHBondContact O-CB 3.46Å; L413-L417 WeakPolarHBondContact O-CD1 3.44Å; L413-L417 VanDerWaalsContact O-CG 3.22Å; L413-L417 WeakPolarHBondContact O-CG 3.45Å; L413-L417 PolarHBondContact O-N 2.82Å; L413-L417 VanDerWaalsContact O-N 3.1Å; V415-L417 VanDerWaalsContact C-N 3.3Å; V415-L417 PolarHBondContact O-N 3.26Å; L417-L432 HydrophobicContact CD1-CD2 3.51Å
418	G	70.3	Confident	79.8	Confident	33 Å²	33	72.8 Å²	72.8	34%	0.34	39%	0.39	S	S	.	.			trans	62.6	-169.2	178.5	0	0	0	0	0	114.8	V415 E416 E420	V415-G418 WeakPolarHBondContact O-CA 3.33Å; V415-G418 PolarHBondContact O-N 2.98Å; E416-G418 VanDerWaalsContact C-N 3.25Å; E416-G418 PolarHBondContact O-N 3.45Å; G418-E420 PolarHBondContact O-N 3.27Å
419	P	57.3	Low	79.5	Confident	133 Å²	133	69.1 Å²	69.1	86%	0.864	38%	0.378	S	S	*	.	S	Bend	trans	-71.1	-17.2	172.7	29.7	-34.6	0	0	0	112.9	K421	P419-K421 PolarHBondContact O-N 2.89Å; P419-K421 VanDerWaalsContact O-N 3.15Å
420	E	52.7	Low	79.1	Confident	150 Å²	150	74.3 Å²	74.3	70%	0.701	40%	0.399	S	S	*	.			trans	-86.2	85.4	-173.5	-67	-157.3	151.3	0	0	113.6	G418	G418-E420 PolarHBondContact O-N 3.27Å
421	K	58.2	Low	79	Confident	72 Å²	72	73.1 Å²	73.1	31%	0.313	40%	0.395	S	S	.	.	S	Bend	trans	-177	52.4	140	-93.6	148.2	-144.5	88.3	0	113.8	Q363 V364 P419 L423	Q363-K421 HydrophobicContact CG-CD 4.36Å; V364-K421 HydrophobicContact CG2-CB 3.55Å; V364-K421 HydrophobicContact CG2-CD 4.33Å; V364-K421 HydrophobicContact CG2-CG 4.33Å; P419-K421 PolarHBondContact O-N 2.89Å; P419-K421 VanDerWaalsContact O-N 3.15Å; K421-L423 PolarHBondContact O-N 3.37Å
422	L	62.4	Low	79	Confident	152 Å²	152	70.4 Å²	70.4	80%	0.796	37%	0.373	S	S	*	.			trans	55.1	7.1	153.5	-64.9	169.8	0	0	0	119.6
423	L	74	Confident	78.9	Confident	25 Å²	25	68.4 Å²	68.4	13%	0.131	36%	0.363	C	S	.	.			trans	-96.5	130.7	178.6	-67.7	-177.9	0	0	0	111.2	P360 E361 V364 K421 R427 L428 V431	P360-L423 HydrophobicContact CB-CD2 4.04Å; P360-L423 HydrophobicContact CB-CG 4.46Å; P360-L423 HydrophobicContact CG-CD2 4.06Å; E361-L423 HydrophobicContact CG-CD1 4.18Å; E361-L423 HydrophobicContact CG-CD2 3.77Å; V364-L423 HydrophobicContact CB-CD1 4.07Å; V364-L423 HydrophobicContact CG1-CD1 4.28Å; V364-L423 HydrophobicContact CG2-CD1 3.82Å; V364-L423 HydrophobicContact CG2-CG 4.38Å; K421-L423 PolarHBondContact O-N 3.37Å; L423-R427 HydrophobicContact CB-CB 4.32Å; L423-R427 HydrophobicContact CD2-CB 4.45Å; L423-L428 HydrophobicContact CB-CB 4.18Å; L423-V431 HydrophobicContact CD1-CG2 4.09Å
424	P	80.8	Confident	79	Confident	77 Å²	77	74.2 Å²	74.2	50%	0.5	39%	0.388	S	S	.	.			trans	-54.1	143.6	167.7	-25.7	34.4	0	0	0	110.8	K426 R427 L428	P424-K426 PolarHBondContact O-N 3.42Å; P424-R427 WeakPolarHBondContact O-CA 3.37Å; P424-R427 WeakPolarHBondContact O-CB 3.27Å; P424-R427 PolarHBondContact O-N 2.98Å; P424-L428 PolarHBondContact O-N 2.7Å; P424-L428 VanDerWaalsContact O-N 3.11Å
425	P	79.7	Confident	79.2	Confident	100 Å²	100	72.8 Å²	72.8	65%	0.649	38%	0.378	S	S	*	.	H	α-helix	trans	-50.8	-39.2	-170.6	-31.9	35.7	0	0	0	114.7	R427 L428 E429	P425-R427 VanDerWaalsContact C-N 3.3Å; P425-R427 PolarHBondContact O-N 3.45Å; P425-L428 PolarHBondContact O-N 3.48Å; P425-E429 WeakPolarHBondContact O-CB 3.45Å; P425-E429 WeakPolarHBondContact O-CG 3.26Å; P425-E429 PolarHBondContact O-N 3.25Å
426	K	74.3	Confident	79.5	Confident	77 Å²	77	67.3 Å²	67.3	34%	0.335	35%	0.345	S	S	.	.	H	α-helix	trans	-63.5	-29.5	177.3	-49.7	-172.9	-164.6	-171.8	0	113.9	T236 E239 P424	T236-K426 WeakPolarHBondContact O-CE 3.41Å; T236-K426 PolarHBondContact O-NZ 2.9Å; E239-K426 IonicContact OE2-NZ 2.7Å; E239-K426 PolarHBondContact OE2-NZ 3.25Å; P424-K426 PolarHBondContact O-N 3.42Å
427	R	82.2	Confident	79.9	Confident	139 Å²	139	65 Å²	65	53%	0.525	33%	0.334	S	S	.	.	H	α-helix	trans	-82.2	-42.6	174.4	-74.4	-161.2	-175.2	-159.9	11.9	111.5	E361 L423 P424 P425 E429 Y430 V431	E361-R427 WeakPolarHBondContact OE1-CD 3.4Å; E361-R427 IonicContact OE1-CZ 3.03Å; E361-R427 IonicContact OE1-NE 3.75Å; E361-R427 IonicContact OE1-NH1 3.54Å; E361-R427 PolarHBondContact OE1-NH1 2.83Å; L423-R427 HydrophobicContact CB-CB 4.32Å; L423-R427 HydrophobicContact CD2-CB 4.45Å; P424-R427 WeakPolarHBondContact O-CA 3.37Å; P424-R427 WeakPolarHBondContact O-CB 3.27Å; P424-R427 PolarHBondContact O-N 2.98Å; P425-R427 VanDerWaalsContact C-N 3.3Å; P425-R427 PolarHBondContact O-N 3.45Å; R427-E429 PolarHBondContact O-N 3.23Å; R427-Y430 PolarHBondContact O-N 3.24Å; R427-V431 WeakPolarHBondContact O-CG2 3.41Å; R427-V431 PolarHBondContact O-N 2.7Å
428	L	85.8	Confident	80.4	Confident	36 Å²	36	72.1 Å²	72.1	19%	0.188	36%	0.359	C	S	.	.	H	α-helix	trans	-53.6	-54.4	173.8	174.9	58.9	0	0	0	109.9	V364 L423 P424 P425 Y430 V431 L432	V364-L428 HydrophobicContact CG1-CD1 3.6Å; L423-L428 HydrophobicContact CB-CB 4.18Å; P424-L428 PolarHBondContact O-N 2.7Å; P424-L428 VanDerWaalsContact O-N 3.11Å; P425-L428 PolarHBondContact O-N 3.48Å; L428-Y430 VanDerWaalsContact C-N 3.3Å; L428-Y430 PolarHBondContact O-N 3.48Å; L428-V431 PolarHBondContact O-N 2.93Å; L428-V431 VanDerWaalsContact O-N 3.07Å; L428-L432 HydrophobicContact CD1-CD1 4Å; L428-L432 HydrophobicContact CD1-CD2 4.23Å; L428-L432 HydrophobicContact CD1-CG 3.95Å; L428-L432 HydrophobicContact CG-CD1 4.11Å; L428-L432 HydrophobicContact CG-CG 4.39Å; L428-L432 WeakPolarHBondContact O-CG 3.39Å; L428-L432 PolarHBondContact O-N 2.91Å
429	E	84.4	Confident	81.5	Confident	55 Å²	55	72 Å²	72	26%	0.257	35%	0.354	S	S	.	.	H	α-helix	trans	-43.4	-51.4	173.1	-91.6	-161.4	-109.4	0	0	113.8	K240 R410 P425 R427 L432 E433	K240-E429 WeakPolarHBondContact CE-OE1 3.41Å; K240-E429 IonicContact NZ-OE1 2.82Å; K240-E429 PolarHBondContact NZ-OE1 2.81Å; K240-E429 IonicContact NZ-OE2 3.17Å; K240-E429 PolarHBondContact NZ-OE2 3.32Å; R410-E429 IonicContact CZ-OE2 2.81Å; R410-E429 IonicContact NE-OE2 3.69Å; R410-E429 IonicContact NH2-OE2 2.7Å; R410-E429 PolarHBondContact NH2-OE2 3.06Å; P425-E429 WeakPolarHBondContact O-CB 3.45Å; P425-E429 WeakPolarHBondContact O-CG 3.26Å; P425-E429 PolarHBondContact O-N 3.25Å; R427-E429 PolarHBondContact O-N 3.23Å; E429-L432 PolarHBondContact O-N 2.69Å; E429-E433 WeakPolarHBondContact O-CB 3.32Å; E429-E433 PolarHBondContact O-N 3.07Å
430	Y	85	Confident	83.3	Confident	111 Å²	111	65.7 Å²	65.7	44%	0.435	31%	0.312	S	S	.	.	H	α-helix	trans	-69.4	-37.1	-177.6	172.3	-109.4	0	0	0	112.8	R427 L428 K434	R427-Y430 PolarHBondContact O-N 3.24Å; L428-Y430 VanDerWaalsContact C-N 3.3Å; L428-Y430 PolarHBondContact O-N 3.48Å; Y430-K434 WeakPolarHBondContact O-CB 3.47Å; Y430-K434 PolarHBondContact O-N 3.04Å
431	V	89.4	Confident	85.3	Confident	13 Å²	13	58.6 Å²	58.6	8%	0.079	28%	0.279	C	S	.	.	H	α-helix	trans	-67	-40.2	175	173.6	0	0	0	0	110.7	E361 V364 L423 R427 L428 S435	E361-V431 HydrophobicContact CB-CG2 3.9Å; E361-V431 HydrophobicContact CG-CG2 4.05Å; E361-V431 WeakPolarHBondContact O-CG1 3.3Å; V364-V431 HydrophobicContact CB-CG1 4.06Å; V364-V431 HydrophobicContact CG1-CB 4.38Å; V364-V431 HydrophobicContact CG1-CG1 3.73Å; L423-V431 HydrophobicContact CD1-CG2 4.09Å; R427-V431 WeakPolarHBondContact O-CG2 3.41Å; R427-V431 PolarHBondContact O-N 2.7Å; L428-V431 PolarHBondContact O-N 2.93Å; L428-V431 VanDerWaalsContact O-N 3.07Å; V431-S435 WeakPolarHBondContact O-CB 3.45Å; V431-S435 PolarHBondContact O-N 3.26Å; V431-S435 PolarHBondContact O-OG 2.94Å
432	L	90.9	Very high	87.1	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.3	-45.6	175.6	-62.1	-176	0	0	0	111.7	V364 A368 R410 L413 S414 L417 L428 E429 K434 S435 L436	V364-L432 HydrophobicContact CG1-CD2 4.26Å; A368-L432 HydrophobicContact CB-CD2 3.7Å; R410-L432 HydrophobicContact CG-CB 4.45Å; L413-L432 HydrophobicContact CB-CD1 4.16Å; L413-L432 HydrophobicContact CB-CD2 4.32Å; S414-L432 VanDerWaalsContact OG-CD1 3.24Å; S414-L432 WeakPolarHBondContact OG-CD1 3.45Å; L417-L432 HydrophobicContact CD1-CD2 3.51Å; L428-L432 HydrophobicContact CD1-CD1 4Å; L428-L432 HydrophobicContact CD1-CD2 4.23Å; L428-L432 HydrophobicContact CD1-CG 3.95Å; L428-L432 HydrophobicContact CG-CD1 4.11Å; L428-L432 HydrophobicContact CG-CG 4.39Å; L428-L432 WeakPolarHBondContact O-CG 3.39Å; L428-L432 PolarHBondContact O-N 2.91Å; E429-L432 PolarHBondContact O-N 2.69Å; L432-K434 PolarHBondContact O-N 2.82Å; L432-S435 PolarHBondContact O-N 2.85Å; L432-S435 VanDerWaalsContact O-N 3.12Å; L432-L436 WeakPolarHBondContact O-CB 3.36Å; L432-L436 PolarHBondContact O-N 3.13Å
433	E	90.8	Very high	88.7	Confident	16 Å²	16	55.7 Å²	55.7	8%	0.075	27%	0.265	C	S	.	.	H	α-helix	trans	-54.8	-50.6	174.1	-170.9	-179.2	129.1	0	0	111.7	R410 E429 S435 L436 H437 S509	R410-E433 IonicContact CZ-OE2 2.64Å; R410-E433 IonicContact NH1-OE2 3.22Å; R410-E433 PolarHBondContact NH1-OE2 3.42Å; R410-E433 IonicContact NH2-OE2 3.78Å; R410-E433 PolarHBondContact NH2-OE2 2.85Å; E429-E433 WeakPolarHBondContact O-CB 3.32Å; E429-E433 PolarHBondContact O-N 3.07Å; E433-S435 VanDerWaalsContact C-N 3.27Å; E433-S435 PolarHBondContact O-N 3.32Å; E433-L436 PolarHBondContact O-N 2.89Å; E433-H437 WeakPolarHBondContact O-CB 3.03Å; E433-H437 VanDerWaalsContact O-CG 3.23Å; E433-H437 PolarHBondContact O-N 3.41Å; E433-H437 IonicContact OE1-CE1 3.25Å; E433-S509 WeakPolarHBondContact OE1-CB 3.47Å; E433-S509 PolarHBondContact OE1-OG 3.33Å
434	K	91.1	Very high	89.6	Confident	122 Å²	122	54.5 Å²	54.5	53%	0.53	26%	0.259	S	S	.	.	H	α-helix	trans	-62.7	-34.1	177.7	-173.6	173	-178.2	175	0	112.5	Y430 L432 R438	Y430-K434 WeakPolarHBondContact O-CB 3.47Å; Y430-K434 PolarHBondContact O-N 3.04Å; L432-K434 PolarHBondContact O-N 2.82Å; K434-R438 WeakPolarHBondContact O-CB 3.47Å; K434-R438 PolarHBondContact O-N 3.32Å; K434-R438 VanDerWaalsContact O-N 3.13Å
435	S	94.1	Very high	90.2	Very high	13 Å²	13	52.5 Å²	52.5	9%	0.091	24%	0.241	C	C	.	.	H	α-helix	trans	-72.8	-46	178.7	-57	0	0	0	0	111.3	G365 V431 L432 E433 R438 S439	G365-S435 WeakPolarHBondContact CA-OG 3.37Å; V431-S435 WeakPolarHBondContact O-CB 3.45Å; V431-S435 PolarHBondContact O-N 3.26Å; V431-S435 PolarHBondContact O-OG 2.94Å; L432-S435 PolarHBondContact O-N 2.85Å; L432-S435 VanDerWaalsContact O-N 3.12Å; E433-S435 VanDerWaalsContact C-N 3.27Å; E433-S435 PolarHBondContact O-N 3.32Å; S435-R438 WeakPolarHBondContact O-CB 3.47Å; S435-R438 PolarHBondContact O-N 3.39Å; S435-R438 VanDerWaalsContact O-N 3.13Å; S435-S439 PolarHBondContact O-N 3.3Å; S435-S439 PolarHBondContact O-OG 3.29Å
436	L	94.8	Very high	90.8	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-59	-46.7	174	-81.8	159.8	0	0	0	111.7	M372 V383 L406 A409 R410 L413 L432 E433 R438 S439 V440	M372-L436 HydrophobicContact SD-CD2 3.53Å; M372-L436 VanDerWaalsContact SD-CD2 3.53Å; M372-L436 HydrophobicContact SD-CG 3.95Å; V383-L436 HydrophobicContact CG2-CD2 4.24Å; L406-L436 HydrophobicContact CD2-CB 4.25Å; L406-L436 HydrophobicContact CD2-CD2 4.04Å; A409-L436 HydrophobicContact CB-CD2 3.73Å; R410-L436 HydrophobicContact CB-CD1 3.62Å; R410-L436 HydrophobicContact CG-CD1 4.33Å; L413-L436 HydrophobicContact CD1-CD1 4.23Å; L413-L436 HydrophobicContact CD1-CD2 4.15Å; L413-L436 HydrophobicContact CD1-CG 4.07Å; L432-L436 WeakPolarHBondContact O-CB 3.36Å; L432-L436 PolarHBondContact O-N 3.13Å; E433-L436 PolarHBondContact O-N 2.89Å; L436-R438 VanDerWaalsContact C-N 3.27Å; L436-R438 PolarHBondContact O-N 3.34Å; L436-S439 PolarHBondContact O-N 3.01Å; L436-V440 WeakPolarHBondContact O-CB 3.41Å; L436-V440 PolarHBondContact O-N 3.29Å
437	H	95	Very high	91.6	Very high	17 Å²	17	50.7 Å²	50.7	8%	0.079	23%	0.234	C	C	.	.	I	π-helix	trans	-60.1	-37.3	174.6	-65.9	172.7	0	0	0	112	E433 L441 K442 Y506 S507 S509	E433-H437 WeakPolarHBondContact O-CB 3.03Å; E433-H437 VanDerWaalsContact O-CG 3.23Å; E433-H437 PolarHBondContact O-N 3.41Å; E433-H437 IonicContact OE1-CE1 3.25Å; H437-L441 HydrophobicContact CB-CD1 4.46Å; H437-L441 WeakPolarHBondContact O-CB 3.1Å; H437-L441 PolarHBondContact O-N 3.02Å; H437-K442 PolarHBondContact O-N 2.85Å; H437-Y506 HydrophobicContact CB-CE2 4.26Å; H437-Y506 WeakPolarHBondContact O-CE2 3.29Å; H437-S507 PolarHBondContact ND1-OG 2.89Å; H437-S509 PolarHBondContact CE1-OG 2.8Å
438	R	95.1	Very high	92	Very high	171 Å²	171	44.2 Å²	44.2	65%	0.645	21%	0.21	S	C	*	.	I	π-helix	trans	-71.1	-40.7	177.2	177.5	-180	171	165.7	1.1	113.1	K434 S435 L436 K442	K434-R438 WeakPolarHBondContact O-CB 3.47Å; K434-R438 PolarHBondContact O-N 3.32Å; K434-R438 VanDerWaalsContact O-N 3.13Å; S435-R438 WeakPolarHBondContact O-CB 3.47Å; S435-R438 PolarHBondContact O-N 3.39Å; S435-R438 VanDerWaalsContact O-N 3.13Å; L436-R438 VanDerWaalsContact C-N 3.27Å; L436-R438 PolarHBondContact O-N 3.34Å; R438-K442 WeakPolarHBondContact O-CB 3.37Å
439	S	94.8	Very high	92.3	Very high	31 Å²	31	43.6 Å²	43.6	22%	0.217	21%	0.21	C	C	.	.	I	π-helix	trans	-84.2	-27.9	-176.2	-65.1	0	0	0	0	113.5	S435 L436 P443	S435-S439 PolarHBondContact O-N 3.3Å; S435-S439 PolarHBondContact O-OG 3.29Å; L436-S439 PolarHBondContact O-N 3.01Å; S439-P443 VanDerWaalsContact O-CG 3.23Å; S439-P443 WeakPolarHBondContact O-CG 3.41Å
440	V	95	Very high	92.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.217	C	C	.	.	I	π-helix	trans	-112.6	-62.2	-174.4	-174	0	0	0	0	111.8	V383 L386 L406 L436 K442 P443 L444	V383-V440 HydrophobicContact CG1-CG2 3.74Å; V383-V440 HydrophobicContact CG2-CG2 4.22Å; L386-V440 HydrophobicContact CD2-CG1 3.79Å; L406-V440 HydrophobicContact CD2-CB 3.86Å; L406-V440 HydrophobicContact CD2-CG1 3.89Å; L406-V440 HydrophobicContact CD2-CG2 4.02Å; L436-V440 WeakPolarHBondContact O-CB 3.41Å; L436-V440 PolarHBondContact O-N 3.29Å; V440-K442 PolarHBondContact O-N 3Å; V440-P443 VanDerWaalsContact O-CD 3.26Å; V440-P443 WeakPolarHBondContact O-CD 3.26Å; V440-P443 WeakPolarHBondContact O-CG 3.47Å; V440-L444 HydrophobicContact CG1-CD1 3.76Å; V440-L444 WeakPolarHBondContact O-CB 3.23Å; V440-L444 VanDerWaalsContact O-CG 3.26Å; V440-L444 WeakPolarHBondContact O-CG 3.49Å; V440-L444 PolarHBondContact O-N 3.33Å
441	L	94.8	Very high	92.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.206	C	C	.	.	I	π-helix	trans	-67.4	-38.7	-174.7	-66.3	-174.9	0	0	0	112.7	I402 L406 H437 L444 R445 L448 P508 L565	I402-L441 HydrophobicContact CG2-CD2 4.23Å; L406-L441 HydrophobicContact CD1-CD1 4.18Å; L406-L441 HydrophobicContact CD1-CD2 3.95Å; L406-L441 HydrophobicContact CD1-CG 3.99Å; H437-L441 HydrophobicContact CB-CD1 4.46Å; H437-L441 WeakPolarHBondContact O-CB 3.1Å; H437-L441 PolarHBondContact O-N 3.02Å; L441-L444 PolarHBondContact O-N 3.22Å; L441-R445 WeakPolarHBondContact O-CA 3.49Å; L441-R445 WeakPolarHBondContact O-CB 3.42Å; L441-R445 PolarHBondContact O-N 2.88Å; L441-L448 HydrophobicContact CD2-CD1 4.3Å; L441-P508 HydrophobicContact CD1-CG 4.24Å; L441-L565 HydrophobicContact CD1-CD1 4.17Å; L441-L565 HydrophobicContact CD2-CD1 3.99Å; L441-L565 HydrophobicContact CD2-CD2 4.19Å
442	K	95.7	Very high	92.6	Very high	115 Å²	115	40.2 Å²	40.2	50%	0.5	20%	0.203	S	C	.	.	H	α-helix	trans	-58.4	-51.5	179.5	-167.4	175	179.1	172.7	0	113.4	H437 R438 V440 Y506	H437-K442 PolarHBondContact O-N 2.85Å; R438-K442 WeakPolarHBondContact O-CB 3.37Å; V440-K442 PolarHBondContact O-N 3Å; K442-Y506 HydrophobicContact CB-CD1 4.45Å; K442-Y506 HydrophobicContact CB-CD2 3.61Å; K442-Y506 HydrophobicContact CB-CE2 3.72Å; K442-Y506 HydrophobicContact CB-CG 4.01Å; K442-Y506 HydrophobicContact CD-CD1 4.17Å; K442-Y506 HydrophobicContact CD-CE1 3.9Å; K442-Y506 HydrophobicContact CD-CE2 4.44Å; K442-Y506 HydrophobicContact CG-CD1 4.04Å; K442-Y506 HydrophobicContact CG-CD2 4.11Å; K442-Y506 HydrophobicContact CG-CE1 4.22Å; K442-Y506 HydrophobicContact CG-CE2 4.28Å; K442-Y506 HydrophobicContact CG-CG 4Å
443	P	95.1	Very high	92.5	Very high	49 Å²	49	45.9 Å²	45.9	32%	0.318	23%	0.225	S	C	.	.	H	α-helix	trans	-73.2	-23.6	176.7	27.5	-35.2	0	0	0	114.3	L387 S439 V440	L387-P443 HydrophobicContact CD2-CG 4.15Å; S439-P443 VanDerWaalsContact O-CG 3.23Å; S439-P443 WeakPolarHBondContact O-CG 3.41Å; V440-P443 VanDerWaalsContact O-CD 3.26Å; V440-P443 WeakPolarHBondContact O-CD 3.26Å; V440-P443 WeakPolarHBondContact O-CG 3.47Å
444	L	93	Very high	92.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-86.1	-20.8	177.7	-64.2	178.7	0	0	0	113.7	L387 V390 R391 V440 L441 P446 I447 L448	L387-L444 HydrophobicContact CD2-CD1 4.04Å; L387-L444 HydrophobicContact CD2-CD2 3.97Å; L387-L444 HydrophobicContact CD2-CG 3.84Å; V390-L444 HydrophobicContact CB-CD1 4Å; V390-L444 HydrophobicContact CB-CD2 3.97Å; V390-L444 HydrophobicContact CG1-CB 4.5Å; V390-L444 HydrophobicContact CG1-CD1 3.96Å; V390-L444 HydrophobicContact CG1-CD2 3.77Å; V390-L444 HydrophobicContact CG1-CG 4.29Å; V390-L444 HydrophobicContact CG2-CD1 4.19Å; R391-L444 HydrophobicContact CG-CD2 4.2Å; V440-L444 HydrophobicContact CG1-CD1 3.76Å; V440-L444 WeakPolarHBondContact O-CB 3.23Å; V440-L444 VanDerWaalsContact O-CG 3.26Å; V440-L444 WeakPolarHBondContact O-CG 3.49Å; V440-L444 PolarHBondContact O-N 3.33Å; L441-L444 PolarHBondContact O-N 3.22Å; L444-P446 VanDerWaalsContact C-CD 3.47Å; L444-P446 VanDerWaalsContact O-N 3.17Å; L444-I447 HydrophobicContact CD2-CD1 4.28Å; L444-I447 WeakPolarHBondContact O-CA 3.49Å; L444-I447 WeakPolarHBondContact O-CB 3.25Å; L444-I447 PolarHBondContact O-N 2.85Å; L444-L448 HydrophobicContact CB-CD1 4Å; L444-L448 HydrophobicContact CB-CG 4.15Å; L444-L448 WeakPolarHBondContact O-CG 3.29Å; L444-L448 PolarHBondContact O-N 3.46Å
445	R	93.2	Very high	92.1	Very high	35 Å²	35	53.1 Å²	53.1	13%	0.132	25%	0.248	C	C	.	.	H	α-helix	trans	-41.5	-49.2	-178.5	176.8	62.4	171.8	141.5	11.2	115.1	L441 L448 A449 L503 E558	L441-R445 WeakPolarHBondContact O-CA 3.49Å; L441-R445 WeakPolarHBondContact O-CB 3.42Å; L441-R445 PolarHBondContact O-N 2.88Å; R445-L448 PolarHBondContact O-N 3.39Å; R445-A449 VanDerWaalsContact O-CB 3.25Å; R445-A449 WeakPolarHBondContact O-CB 3.25Å; R445-A449 PolarHBondContact O-N 3.02Å; R445-L503 PolarHBondContact NH2-O 2.95Å; R445-E558 IonicContact CZ-OE1 2.66Å; R445-E558 VanDerWaalsContact CZ-OE1 3.29Å; R445-E558 IonicContact CZ-OE2 2.7Å; R445-E558 VanDerWaalsContact CZ-OE2 3.31Å; R445-E558 VanDerWaalsContact NH1-CD 3.33Å; R445-E558 IonicContact NH1-OE1 3.99Å; R445-E558 PolarHBondContact NH1-OE1 2.97Å; R445-E558 IonicContact NH1-OE2 3.33Å; R445-E558 PolarHBondContact NH1-OE2 3.48Å; R445-E558 IonicContact NH2-OE1 2.87Å; R445-E558 PolarHBondContact NH2-OE1 2.92Å; R445-E558 IonicContact NH2-OE2 3.21Å; R445-E558 PolarHBondContact NH2-OE2 3.35Å
446	P	92.7	Very high	91.7	Very high	87 Å²	87	52.6 Å²	52.6	57%	0.565	24%	0.244	S	C	*	.	H	α-helix	trans	-66	-36.6	178.9	25.2	-34.1	0	0	0	113.1	L444 A450	L444-P446 VanDerWaalsContact C-CD 3.47Å; L444-P446 VanDerWaalsContact O-N 3.17Å; P446-A450 VanDerWaalsContact O-CB 3.29Å; P446-A450 WeakPolarHBondContact O-CB 3.12Å; P446-A450 PolarHBondContact O-N 3.06Å
447	I	91.7	Very high	91.3	Very high	51 Å²	51	55.4 Å²	55.4	26%	0.262	27%	0.268	S	S	.	.	H	α-helix	trans	-68.4	-46	178.1	-56.1	172.8	0	0	0	110	V390 R391 L444 A450 R451	V390-I447 HydrophobicContact CG1-CG2 4.48Å; R391-I447 HydrophobicContact CG-CD1 3.78Å; L444-I447 HydrophobicContact CD2-CD1 4.28Å; L444-I447 WeakPolarHBondContact O-CA 3.49Å; L444-I447 WeakPolarHBondContact O-CB 3.25Å; L444-I447 PolarHBondContact O-N 2.85Å; I447-A450 PolarHBondContact O-N 3.17Å; I447-R451 PolarHBondContact O-N 3.03Å
448	L	90.7	Very high	90.8	Very high	3 Å²	3	59 Å²	59	2%	0.016	30%	0.301	C	S	.	.	H	α-helix	trans	-65.1	-43.3	178.8	-60.3	180	0	0	0	111.5	V390 L399 I402 L441 L444 R445 R451 V452 Y561	V390-L448 HydrophobicContact CG1-CD2 3.81Å; L399-L448 HydrophobicContact CD2-CB 4.28Å; L399-L448 HydrophobicContact CD2-CD1 4.19Å; L399-L448 HydrophobicContact CD2-CD2 3.87Å; L399-L448 HydrophobicContact CD2-CG 4.32Å; I402-L448 HydrophobicContact CD1-CD1 4.15Å; I402-L448 HydrophobicContact CD1-CD2 3.46Å; I402-L448 VanDerWaalsContact CD1-CD2 3.46Å; I402-L448 HydrophobicContact CD1-CG 4.46Å; L441-L448 HydrophobicContact CD2-CD1 4.3Å; L444-L448 HydrophobicContact CB-CD1 4Å; L444-L448 HydrophobicContact CB-CG 4.15Å; L444-L448 WeakPolarHBondContact O-CG 3.29Å; L444-L448 PolarHBondContact O-N 3.46Å; R445-L448 PolarHBondContact O-N 3.39Å; L448-R451 PolarHBondContact O-N 3.48Å; L448-V452 WeakPolarHBondContact O-CG2 3.27Å; L448-V452 PolarHBondContact O-N 3.42Å; L448-Y561 HydrophobicContact CB-CE2 4.26Å; L448-Y561 HydrophobicContact CD1-CE2 4.13Å
449	A	90.8	Very high	90.2	Very high	24 Å²	24	53.9 Å²	53.9	20%	0.198	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-42.3	173.7	0	0	0	0	0	111.8	R445 R451 R453 L557	R445-A449 VanDerWaalsContact O-CB 3.25Å; R445-A449 WeakPolarHBondContact O-CB 3.25Å; R445-A449 PolarHBondContact O-N 3.02Å; A449-R451 PolarHBondContact O-N 3.49Å; A449-R453 WeakPolarHBondContact O-CB 3.3Å; A449-R453 PolarHBondContact O-N 3.39Å; A449-L557 HydrophobicContact CB-CD2 4.36Å; A449-L557 WeakPolarHBondContact O-CD1 3.46Å
450	A	90.5	Very high	89.7	Confident	48 Å²	48	53.6 Å²	53.6	40%	0.397	29%	0.288	S	S	.	.	H	α-helix	trans	-62	-42.9	175.8	0	0	0	0	0	112.4	P446 I447 R454	P446-A450 VanDerWaalsContact O-CB 3.29Å; P446-A450 WeakPolarHBondContact O-CB 3.12Å; P446-A450 PolarHBondContact O-N 3.06Å; I447-A450 PolarHBondContact O-N 3.17Å; A450-R454 VanDerWaalsContact O-CB 3.27Å; A450-R454 WeakPolarHBondContact O-CB 3.45Å; A450-R454 PolarHBondContact O-N 2.86Å
451	R	88.3	Confident	89.2	Confident	55 Å²	55	54.5 Å²	54.5	21%	0.208	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-50.5	176.8	-74.2	-169.1	-176.8	131.5	16.5	112.3	V390 G393 I447 L448 A449 R453 R454 R455	V390-R451 PolarHBondContact O-NH1 2.83Å; V390-R451 VanDerWaalsContact O-NH1 3.15Å; V390-R451 PolarHBondContact O-NH2 2.85Å; G393-R451 PolarHBondContact O-NH2 3.28Å; I447-R451 PolarHBondContact O-N 3.03Å; L448-R451 PolarHBondContact O-N 3.48Å; A449-R451 PolarHBondContact O-N 3.49Å; R451-R453 PolarHBondContact O-N 2.73Å; R451-R454 PolarHBondContact O-N 2.82Å; R451-R455 PolarHBondContact O-N 3.2Å
452	V	86.1	Confident	88.9	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.024	30%	0.301	C	S	.	.	H	α-helix	trans	-65.5	-39.4	-179.7	-179.8	0	0	0	0	111.2	L399 L448 R454 R455 L456 L557	L399-V452 HydrophobicContact CD1-CG2 4.1Å; L448-V452 WeakPolarHBondContact O-CG2 3.27Å; L448-V452 PolarHBondContact O-N 3.42Å; V452-R454 VanDerWaalsContact C-N 3.33Å; V452-R454 PolarHBondContact O-N 3.13Å; V452-R455 WeakPolarHBondContact O-CB 3.43Å; V452-R455 PolarHBondContact O-N 3.23Å; V452-L456 HydrophobicContact CG1-CD1 3.75Å; V452-L456 HydrophobicContact CG1-CG 4.24Å; V452-L456 WeakPolarHBondContact O-CB 3.3Å; V452-L456 WeakPolarHBondContact O-CG 3.46Å; V452-L456 PolarHBondContact O-N 3.13Å; V452-L557 HydrophobicContact CB-CD1 4.09Å; V452-L557 HydrophobicContact CB-CG 4Å; V452-L557 HydrophobicContact CG1-CB 4.41Å; V452-L557 HydrophobicContact CG1-CD1 4.19Å; V452-L557 HydrophobicContact CG1-CG 3.74Å
453	R	89.7	Confident	88.6	Confident	120 Å²	120	52.6 Å²	52.6	45%	0.453	30%	0.301	S	S	.	.	H	α-helix	trans	-63.2	-39	174.2	-165.3	-176.5	-173.3	96	-1.1	111.8	A449 R451 A457 L462 E554 L557	A449-R453 WeakPolarHBondContact O-CB 3.3Å; A449-R453 PolarHBondContact O-N 3.39Å; R451-R453 PolarHBondContact O-N 2.73Å; R453-A457 VanDerWaalsContact O-CB 3.27Å; R453-A457 WeakPolarHBondContact O-CB 3.45Å; R453-A457 PolarHBondContact O-N 3.12Å; R453-L462 HydrophobicContact CG-CD1 3.89Å; R453-E554 IonicContact CZ-OE1 2.73Å; R453-E554 IonicContact NH1-OE1 2.82Å; R453-E554 PolarHBondContact NH1-OE1 2.97Å; R453-E554 IonicContact NH2-OE1 3.74Å; R453-E554 PolarHBondContact NH2-OE1 3.1Å; R453-L557 HydrophobicContact CB-CD1 3.72Å
454	R	88.6	Confident	88.2	Confident	196 Å²	196	54.8 Å²	54.8	74%	0.74	30%	0.303	S	S	*	.	H	α-helix	trans	-67.7	-41	177.6	-162.3	-177.9	-65.2	179.2	-2	111.4	A450 R451 V452 A457 A458	A450-R454 VanDerWaalsContact O-CB 3.27Å; A450-R454 WeakPolarHBondContact O-CB 3.45Å; A450-R454 PolarHBondContact O-N 2.86Å; R451-R454 PolarHBondContact O-N 2.82Å; V452-R454 VanDerWaalsContact C-N 3.33Å; V452-R454 PolarHBondContact O-N 3.13Å; R454-A457 PolarHBondContact O-N 3.5Å; R454-A458 WeakPolarHBondContact O-CB 3.47Å; R454-A458 PolarHBondContact O-N 3.21Å
455	R	85.8	Confident	88.2	Confident	94 Å²	94	54.8 Å²	54.8	36%	0.355	30%	0.303	S	S	.	.	H	α-helix	trans	-57.1	-55.2	171.1	179.3	175.5	75.4	-169	6.1	111.6	R451 V452 A457 A458 D459 E560 E564	R451-R455 PolarHBondContact O-N 3.2Å; V452-R455 WeakPolarHBondContact O-CB 3.43Å; V452-R455 PolarHBondContact O-N 3.23Å; R455-A457 PolarHBondContact O-N 3.37Å; R455-A458 PolarHBondContact O-N 3.34Å; R455-D459 PolarHBondContact O-N 2.69Å; R455-D459 VanDerWaalsContact O-N 3.11Å; R455-E560 IonicContact CZ-OE2 3.7Å; R455-E560 IonicContact NE-OE2 3.9Å; R455-E560 IonicContact NH2-OE2 3.91Å; R455-E560 PolarHBondContact NH2-OE2 2.87Å; R455-E564 IonicContact CZ-OE1 2.73Å; R455-E564 IonicContact NH1-OE1 2.82Å; R455-E564 IonicContact NH2-OE1 2.86Å; R455-E564 PolarHBondContact NH2-OE1 2.93Å
456	L	84.3	Confident	88.2	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-73.5	-8.1	-177.3	-66.2	173.6	0	0	0	114.7	V452 D459 S461 L462 L556 L557	V452-L456 HydrophobicContact CG1-CD1 3.75Å; V452-L456 HydrophobicContact CG1-CG 4.24Å; V452-L456 WeakPolarHBondContact O-CB 3.3Å; V452-L456 WeakPolarHBondContact O-CG 3.46Å; V452-L456 PolarHBondContact O-N 3.13Å; L456-D459 WeakPolarHBondContact CA-OD1 3.31Å; L456-D459 VanDerWaalsContact O-OD1 3.08Å; L456-S461 PolarHBondContact O-N 3.08Å; L456-L462 HydrophobicContact CB-CD1 3.99Å; L456-L462 HydrophobicContact CB-CG 3.85Å; L456-L462 WeakPolarHBondContact O-CB 3.16Å; L456-L462 WeakPolarHBondContact O-CG 3.16Å; L456-L462 PolarHBondContact O-N 3.25Å; L456-L556 HydrophobicContact CD1-CD2 4.16Å; L456-L556 HydrophobicContact CD1-CG 4.04Å; L456-L556 HydrophobicContact CD2-CD2 4.23Å; L456-L557 HydrophobicContact CD1-CB 4.38Å
457	A	87.6	Confident	88.1	Confident	61 Å²	61	54.6 Å²	54.6	50%	0.504	30%	0.304	S	S	.	.	H	α-helix	trans	-88.5	-43.9	167.7	0	0	0	0	0	110.9	R453 R454 R455 G460 L462	R453-A457 VanDerWaalsContact O-CB 3.27Å; R453-A457 WeakPolarHBondContact O-CB 3.45Å; R453-A457 PolarHBondContact O-N 3.12Å; R454-A457 PolarHBondContact O-N 3.5Å; R455-A457 PolarHBondContact O-N 3.37Å; A457-G460 PolarHBondContact O-N 3.05Å; A457-G460 VanDerWaalsContact O-N 3.13Å; A457-L462 HydrophobicContact CB-CD1 4.4Å
458	A	84.1	Confident	88.1	Confident	93 Å²	93	52.1 Å²	52.1	77%	0.769	29%	0.291	S	S	*	.	H	α-helix	trans	-67.1	-34.9	-178.4	0	0	0	0	0	113.4	R454 R455 G460	R454-A458 WeakPolarHBondContact O-CB 3.47Å; R454-A458 PolarHBondContact O-N 3.21Å; R455-A458 PolarHBondContact O-N 3.34Å; A458-G460 PolarHBondContact O-N 3.43Å
459	D	81.1	Confident	88.2	Confident	63 Å²	63	52.1 Å²	52.1	34%	0.337	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-1.5	174.1	80.3	-19.8	0	0	0	113.5	R455 L456 S461 R464	R455-D459 PolarHBondContact O-N 2.69Å; R455-D459 VanDerWaalsContact O-N 3.11Å; L456-D459 WeakPolarHBondContact CA-OD1 3.31Å; L456-D459 VanDerWaalsContact O-OD1 3.08Å; D459-S461 VanDerWaalsContact C-N 3.28Å; D459-S461 PolarHBondContact O-N 3.42Å; D459-S461 WeakPolarHBondContact OD1-CB 3.34Å; D459-S461 PolarHBondContact OD1-N 3.21Å; D459-S461 PolarHBondContact OD1-OG 3.34Å; D459-S461 WeakPolarHBondContact OD2-CB 3.37Å; D459-S461 PolarHBondContact OD2-OG 3.46Å; D459-R464 VanDerWaalsContact O-CZ 3.26Å; D459-R464 PolarHBondContact O-NH1 2.81Å; D459-R464 PolarHBondContact O-NH2 3.03Å; D459-R464 IonicContact OD2-NH2 2.69Å
460	G	84.4	Confident	88.4	Confident	26 Å²	26	57.4 Å²	57.4	27%	0.268	31%	0.306	S	S	.	.	S	Bend	trans	72	6.4	-176.3	0	0	0	0	0	115.9	A457 A458 L462 G463 R464	A457-G460 PolarHBondContact O-N 3.05Å; A457-G460 VanDerWaalsContact O-N 3.13Å; A458-G460 PolarHBondContact O-N 3.43Å; G460-L462 PolarHBondContact O-N 3.11Å; G460-G463 PolarHBondContact O-N 3.4Å; G460-G463 VanDerWaalsContact O-N 3.13Å; G460-R464 PolarHBondContact O-N 3.2Å
461	S	84.6	Confident	88.5	Confident	19 Å²	19	56.5 Å²	56.5	13%	0.133	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-40.5	-174.5	-75	0	0	0	0	113	L456 D459 G463 R464 L465	L456-S461 PolarHBondContact O-N 3.08Å; D459-S461 VanDerWaalsContact C-N 3.28Å; D459-S461 PolarHBondContact O-N 3.42Å; D459-S461 WeakPolarHBondContact OD1-CB 3.34Å; D459-S461 PolarHBondContact OD1-N 3.21Å; D459-S461 PolarHBondContact OD1-OG 3.34Å; D459-S461 WeakPolarHBondContact OD2-CB 3.37Å; D459-S461 PolarHBondContact OD2-OG 3.46Å; S461-G463 VanDerWaalsContact C-N 3.29Å; S461-G463 PolarHBondContact O-N 3.12Å; S461-R464 PolarHBondContact O-N 2.64Å; S461-R464 PolarHBondContact OG-NH2 2.87Å; S461-L465 WeakPolarHBondContact O-CB 3.05Å; S461-L465 PolarHBondContact O-N 2.95Å
462	L	89.3	Confident	88.6	Confident	26 Å²	26	53.9 Å²	53.9	14%	0.136	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-35.2	173.8	-72.1	168.6	0	0	0	112.2	R453 L456 A457 G460 A466 L556	R453-L462 HydrophobicContact CG-CD1 3.89Å; L456-L462 HydrophobicContact CB-CD1 3.99Å; L456-L462 HydrophobicContact CB-CG 3.85Å; L456-L462 WeakPolarHBondContact O-CB 3.16Å; L456-L462 WeakPolarHBondContact O-CG 3.16Å; L456-L462 PolarHBondContact O-N 3.25Å; A457-L462 HydrophobicContact CB-CD1 4.4Å; G460-L462 PolarHBondContact O-N 3.11Å; L462-A466 WeakPolarHBondContact O-CB 3.23Å; L462-A466 PolarHBondContact O-N 2.78Å; L462-L556 HydrophobicContact CD2-CD2 4.3Å
463	G	88.8	Confident	88.8	Confident	48 Å²	48	58 Å²	58	50%	0.495	30%	0.3	S	S	.	.	H	α-helix	trans	-68.7	-46.7	176.4	0	0	0	0	0	112.3	G460 S461 L465 A466 E467	G460-G463 PolarHBondContact O-N 3.4Å; G460-G463 VanDerWaalsContact O-N 3.13Å; S461-G463 VanDerWaalsContact C-N 3.29Å; S461-G463 PolarHBondContact O-N 3.12Å; G463-L465 VanDerWaalsContact C-N 3.33Å; G463-L465 PolarHBondContact O-N 2.94Å; G463-A466 PolarHBondContact O-N 3.42Å; G463-E467 PolarHBondContact O-N 2.84Å
464	R	87.8	Confident	88.9	Confident	96 Å²	96	56.1 Å²	56.1	36%	0.362	31%	0.31	S	S	.	.	H	α-helix	trans	-58.7	-43.1	174.1	-72.2	-174.3	-68.3	-86.4	1.8	111.9	D459 G460 S461 G468	D459-R464 VanDerWaalsContact O-CZ 3.26Å; D459-R464 PolarHBondContact O-NH1 2.81Å; D459-R464 PolarHBondContact O-NH2 3.03Å; D459-R464 IonicContact OD2-NH2 2.69Å; G460-R464 PolarHBondContact O-N 3.2Å; S461-R464 PolarHBondContact O-N 2.64Å; S461-R464 PolarHBondContact OG-NH2 2.87Å; R464-G468 PolarHBondContact O-N 2.96Å
465	L	91.8	Very high	88.8	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65.7	-45.3	176.4	178.7	58.5	0	0	0	111.9	S461 G463 E467 G468 L469 P553 L556 L586 L589	S461-L465 WeakPolarHBondContact O-CB 3.05Å; S461-L465 PolarHBondContact O-N 2.95Å; G463-L465 VanDerWaalsContact C-N 3.33Å; G463-L465 PolarHBondContact O-N 2.94Å; L465-E467 VanDerWaalsContact C-N 3.34Å; L465-E467 PolarHBondContact O-N 3.27Å; L465-G468 CarbonylContact O-C 3.47Å; L465-G468 WeakPolarHBondContact O-CA 3.24Å; L465-G468 PolarHBondContact O-N 2.84Å; L465-G468 VanDerWaalsContact O-N 3.11Å; L465-L469 HydrophobicContact CD1-CD1 4.29Å; L465-L469 HydrophobicContact CD1-CD2 4.29Å; L465-L469 HydrophobicContact CD1-CG 3.99Å; L465-L469 HydrophobicContact CG-CD1 4.01Å; L465-L469 HydrophobicContact CG-CG 4.21Å; L465-L469 VanDerWaalsContact O-CG 3.27Å; L465-L469 WeakPolarHBondContact O-CG 3.28Å; L465-L469 PolarHBondContact O-N 3.42Å; L465-P553 HydrophobicContact CD2-CB 4.32Å; L465-L556 HydrophobicContact CD2-CB 3.71Å; L465-L556 HydrophobicContact CD2-CD2 4.16Å; L465-L556 HydrophobicContact CD2-CG 4.4Å; L465-L586 HydrophobicContact CD1-CD2 4.13Å; L465-L586 HydrophobicContact CD2-CD2 4.01Å; L465-L589 HydrophobicContact CD1-CB 3.73Å; L465-L589 HydrophobicContact CD1-CD1 4.34Å
466	A	92.8	Very high	88.7	Confident	47 Å²	47	47.8 Å²	47.8	39%	0.388	29%	0.287	S	S	.	.	H	α-helix	trans	-59.3	-43.8	179.7	0	0	0	0	0	112.3	L462 G463 L469 R470	L462-A466 WeakPolarHBondContact O-CB 3.23Å; L462-A466 PolarHBondContact O-N 2.78Å; G463-A466 PolarHBondContact O-N 3.42Å; A466-L469 PolarHBondContact O-N 3.16Å; A466-R470 PolarHBondContact O-N 3.15Å; A466-R470 VanDerWaalsContact O-N 3.1Å
467	E	92.1	Very high	88.7	Confident	70 Å²	70	49.8 Å²	49.8	33%	0.327	30%	0.3	S	S	.	.	H	α-helix	trans	-66.2	-39.5	173.6	179.3	57.7	-168.9	0	0	111.7	G463 L465 L469 R470 L471	G463-E467 PolarHBondContact O-N 2.84Å; L465-E467 VanDerWaalsContact C-N 3.34Å; L465-E467 PolarHBondContact O-N 3.27Å; E467-L469 PolarHBondContact O-N 3.14Å; E467-R470 WeakPolarHBondContact O-CB 3.23Å; E467-R470 PolarHBondContact O-N 3.38Å; E467-R470 VanDerWaalsContact O-N 3.13Å; E467-R470 IonicContact OE1-CZ 3.2Å; E467-R470 IonicContact OE1-NE 3.31Å; E467-R470 IonicContact OE1-NH2 3.29Å; E467-R470 PolarHBondContact OE1-NH2 3.34Å; E467-R470 IonicContact OE2-CZ 2.67Å; E467-R470 IonicContact OE2-NE 2.84Å; E467-R470 PolarHBondContact OE2-NE 3.16Å; E467-R470 IonicContact OE2-NH2 3Å; E467-R470 PolarHBondContact OE2-NH2 3.05Å; E467-L471 HydrophobicContact CG-CD1 3.97Å; E467-L471 HydrophobicContact CG-CG 4.35Å; E467-L471 WeakPolarHBondContact O-CG 3.11Å; E467-L471 PolarHBondContact O-N 2.9Å
468	G	90.8	Very high	88.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-56.9	-46.7	172	0	0	0	0	0	114.3	R464 L465 R470 L471 A472 L589	R464-G468 PolarHBondContact O-N 2.96Å; L465-G468 CarbonylContact O-C 3.47Å; L465-G468 WeakPolarHBondContact O-CA 3.24Å; L465-G468 PolarHBondContact O-N 2.84Å; L465-G468 VanDerWaalsContact O-N 3.11Å; G468-R470 VanDerWaalsContact C-N 3.26Å; G468-R470 PolarHBondContact O-N 2.82Å; G468-L471 PolarHBondContact O-N 2.84Å; G468-A472 WeakPolarHBondContact O-CB 3.49Å; G468-A472 PolarHBondContact O-N 2.85Å; G468-L589 WeakPolarHBondContact CA-O 3.25Å
469	L	94	Very high	87.9	Confident	3 Å²	3	46 Å²	46	2%	0.016	28%	0.275	C	S	.	.	H	α-helix	trans	-62.6	-32.7	174.9	-65.4	167.5	0	0	0	111.6	L465 A466 E467 R473 A548 P553 L589	L465-L469 HydrophobicContact CD1-CD1 4.29Å; L465-L469 HydrophobicContact CD1-CD2 4.29Å; L465-L469 HydrophobicContact CD1-CG 3.99Å; L465-L469 HydrophobicContact CG-CD1 4.01Å; L465-L469 HydrophobicContact CG-CG 4.21Å; L465-L469 VanDerWaalsContact O-CG 3.27Å; L465-L469 WeakPolarHBondContact O-CG 3.28Å; L465-L469 PolarHBondContact O-N 3.42Å; A466-L469 PolarHBondContact O-N 3.16Å; E467-L469 PolarHBondContact O-N 3.14Å; L469-R473 WeakPolarHBondContact O-CG 3.4Å; L469-R473 PolarHBondContact O-N 3.13Å; L469-R473 PolarHBondContact O-NE 2.76Å; L469-A548 HydrophobicContact CD2-CB 4.47Å; L469-P553 HydrophobicContact CD1-CB 4.1Å; L469-L589 HydrophobicContact CD2-CD1 3.82Å; L469-L589 HydrophobicContact CD2-CD2 4.37Å
470	R	94.1	Very high	87.8	Confident	134 Å²	134	43.9 Å²	43.9	51%	0.506	26%	0.263	S	S	.	.	H	α-helix	trans	-72.1	-48.2	175.4	-166.2	-173.1	72.4	85.8	2.3	111.5	A466 E467 G468 R473 A474	A466-R470 PolarHBondContact O-N 3.15Å; A466-R470 VanDerWaalsContact O-N 3.1Å; E467-R470 WeakPolarHBondContact O-CB 3.23Å; E467-R470 PolarHBondContact O-N 3.38Å; E467-R470 VanDerWaalsContact O-N 3.13Å; E467-R470 IonicContact OE1-CZ 3.2Å; E467-R470 IonicContact OE1-NE 3.31Å; E467-R470 IonicContact OE1-NH2 3.29Å; E467-R470 PolarHBondContact OE1-NH2 3.34Å; E467-R470 IonicContact OE2-CZ 2.67Å; E467-R470 IonicContact OE2-NE 2.84Å; E467-R470 PolarHBondContact OE2-NE 3.16Å; E467-R470 IonicContact OE2-NH2 3Å; E467-R470 PolarHBondContact OE2-NH2 3.05Å; G468-R470 VanDerWaalsContact C-N 3.26Å; G468-R470 PolarHBondContact O-N 2.82Å; R470-R473 PolarHBondContact O-N 3.02Å; R470-A474 PolarHBondContact O-N 3.08Å; R470-A474 VanDerWaalsContact O-N 3.11Å
471	L	91.6	Very high	87	Confident	29 Å²	29	45.9 Å²	45.9	15%	0.152	28%	0.283	C	S	.	.	H	α-helix	trans	-64.4	-44.8	179.9	-69.4	170.8	0	0	0	112.1	E467 G468 R473 A474 Q475 L592	E467-L471 HydrophobicContact CG-CD1 3.97Å; E467-L471 HydrophobicContact CG-CG 4.35Å; E467-L471 WeakPolarHBondContact O-CG 3.11Å; E467-L471 PolarHBondContact O-N 2.9Å; G468-L471 PolarHBondContact O-N 2.84Å; L471-R473 VanDerWaalsContact C-N 3.31Å; L471-R473 PolarHBondContact O-N 3.44Å; L471-A474 PolarHBondContact O-N 2.77Å; L471-A474 VanDerWaalsContact O-N 3.13Å; L471-Q475 WeakPolarHBondContact O-CB 3.39Å; L471-Q475 WeakPolarHBondContact O-CG 3.44Å; L471-Q475 PolarHBondContact O-N 2.81Å; L471-L592 HydrophobicContact CB-CB 4.44Å; L471-L592 HydrophobicContact CD1-CB 4.33Å
472	A	90.4	Very high	86.4	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-34.4	177.4	0	0	0	0	0	113.2	G468 G476 F480 A548 L589 L592	G468-A472 WeakPolarHBondContact O-CB 3.49Å; G468-A472 PolarHBondContact O-N 2.85Å; A472-G476 WeakPolarHBondContact O-CA 3.44Å; A472-G476 PolarHBondContact O-N 3.3Å; A472-F480 HydrophobicContact CB-CE2 4.2Å; A472-F480 HydrophobicContact CB-CZ 3.97Å; A472-A548 HydrophobicContact CB-CB 3.52Å; A472-L589 HydrophobicContact CB-CD2 3.56Å; A472-L592 HydrophobicContact CB-CD1 3.72Å
473	R	92.3	Very high	85.5	Confident	90 Å²	90	53.4 Å²	53.4	34%	0.34	32%	0.317	S	S	.	.	H	α-helix	trans	-68.7	-39.3	171.8	-80.8	179.4	-73.1	-172.1	-10.5	112.6	L469 R470 L471 A548 D551	L469-R473 WeakPolarHBondContact O-CG 3.4Å; L469-R473 PolarHBondContact O-N 3.13Å; L469-R473 PolarHBondContact O-NE 2.76Å; R470-R473 PolarHBondContact O-N 3.02Å; L471-R473 VanDerWaalsContact C-N 3.31Å; L471-R473 PolarHBondContact O-N 3.44Å; R473-A548 WeakPolarHBondContact CD-O 3.37Å; R473-A548 HydrophobicContact CG-CB 4.19Å; R473-A548 WeakPolarHBondContact CG-O 3.36Å; R473-A548 PolarHBondContact NE-O 3.39Å; R473-D551 VanDerWaalsContact CZ-CG 3.4Å; R473-D551 IonicContact CZ-OD1 2.99Å; R473-D551 IonicContact CZ-OD2 2.7Å; R473-D551 VanDerWaalsContact CZ-OD2 3.25Å; R473-D551 IonicContact NH1-OD1 2.69Å; R473-D551 IonicContact NH1-OD2 3.78Å; R473-D551 PolarHBondContact NH1-OD2 2.94Å; R473-D551 IonicContact NH2-OD1 3.32Å; R473-D551 PolarHBondContact NH2-OD1 2.7Å; R473-D551 IonicContact NH2-OD2 2.85Å; R473-D551 PolarHBondContact NH2-OD2 2.78Å
474	A	90.3	Very high	84.9	Confident	81 Å²	81	51.5 Å²	51.5	67%	0.669	30%	0.295	S	S	*	.	H	α-helix	trans	-72.3	-31.7	179.5	0	0	0	0	0	113.3	R470 L471	R470-A474 PolarHBondContact O-N 3.08Å; R470-A474 VanDerWaalsContact O-N 3.11Å; L471-A474 PolarHBondContact O-N 2.77Å; L471-A474 VanDerWaalsContact O-N 3.13Å
475	Q	86.3	Confident	84.5	Confident	102 Å²	102	50.4 Å²	50.4	48%	0.477	30%	0.303	S	S	.	.	H	α-helix	trans	-95	-16.9	-178.1	-66.6	172.9	19.4	0	0	113.6	L471 G478 A479	L471-Q475 WeakPolarHBondContact O-CB 3.39Å; L471-Q475 WeakPolarHBondContact O-CG 3.44Å; L471-Q475 PolarHBondContact O-N 2.81Å; Q475-G478 PolarHBondContact O-N 2.7Å; Q475-A479 HydrophobicContact CB-CB 3.85Å
476	G	85.1	Confident	84.2	Confident	13 Å²	13	53.6 Å²	53.6	13%	0.134	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	61.7	-148.9	179.8	0	0	0	0	0	113.2	A472 G478 A479	A472-G476 WeakPolarHBondContact O-CA 3.44Å; A472-G476 PolarHBondContact O-N 3.3Å; G476-G478 PolarHBondContact O-N 3.18Å; G476-G478 VanDerWaalsContact O-N 3.12Å; G476-A479 VanDerWaalsContact O-CB 3.27Å; G476-A479 WeakPolarHBondContact O-CB 3.45Å; G476-A479 PolarHBondContact O-N 2.69Å; G476-A479 VanDerWaalsContact O-N 3.08Å
477	P	82.9	Confident	84.1	Confident	44 Å²	44	51.8 Å²	51.8	29%	0.286	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-55.6	-28.4	178.2	-24.7	33.6	0	0	0	114.2	A479 F480 G481 S482 L484 L545	P477-A479 PolarHBondContact O-N 3.32Å; P477-F480 PolarHBondContact O-N 3.42Å; P477-G481 PolarHBondContact O-N 3.04Å; P477-S482 CarbonylContact C-O 3.36Å; P477-S482 WeakPolarHBondContact CB-O 3.22Å; P477-S482 PolarHBondContact O-N 3.32Å; P477-S482 PolarHBondContact O-OG 3.26Å; P477-L484 WeakPolarHBondContact CB-O 3.46Å; P477-L484 VanDerWaalsContact CG-O 3.25Å; P477-L484 WeakPolarHBondContact CG-O 3.4Å; P477-L545 HydrophobicContact CB-CD2 4.31Å; P477-L545 HydrophobicContact CG-CD2 3.88Å
478	G	76.8	Confident	84.1	Confident	60 Å²	60	50.9 Å²	50.9	62%	0.619	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-59.4	-26.2	176.9	0	0	0	0	0	114.1	Q475 G476 F480 G481	Q475-G478 PolarHBondContact O-N 2.7Å; G476-G478 PolarHBondContact O-N 3.18Å; G476-G478 VanDerWaalsContact O-N 3.12Å; G478-F480 PolarHBondContact O-N 3Å; G478-F480 VanDerWaalsContact O-N 3.13Å; G478-G481 PolarHBondContact O-N 2.75Å
479	A	78	Confident	84.2	Confident	16 Å²	16	56.3 Å²	56.3	13%	0.132	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-57.4	-27.5	177.3	0	0	0	0	0	113.7	Q475 G476 P477 L592	Q475-A479 HydrophobicContact CB-CB 3.85Å; G476-A479 VanDerWaalsContact O-CB 3.27Å; G476-A479 WeakPolarHBondContact O-CB 3.45Å; G476-A479 PolarHBondContact O-N 2.69Å; G476-A479 VanDerWaalsContact O-N 3.08Å; P477-A479 PolarHBondContact O-N 3.32Å; A479-L592 HydrophobicContact CB-CD1 4.46Å
480	F	79.1	Confident	84.1	Confident	17 Å²	17	60.8 Å²	60.8	8%	0.075	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-117.5	4.2	-175.8	-53.6	-66.7	0	0	0	113.1	A472 P477 G478 S482 P541 L545 L589 L592	A472-F480 HydrophobicContact CB-CE2 4.2Å; A472-F480 HydrophobicContact CB-CZ 3.97Å; P477-F480 PolarHBondContact O-N 3.42Å; G478-F480 PolarHBondContact O-N 3Å; G478-F480 VanDerWaalsContact O-N 3.13Å; F480-S482 VanDerWaalsContact C-N 3.27Å; F480-S482 PolarHBondContact O-N 3.13Å; F480-P541 HydrophobicContact CB-CB 3.99Å; F480-L545 HydrophobicContact CD2-CB 4.32Å; F480-L545 HydrophobicContact CE2-CB 4.12Å; F480-L545 HydrophobicContact CE2-CD1 4.38Å; F480-L589 HydrophobicContact CZ-CD2 3.85Å; F480-L589 HydrophobicContact CZ-CG 4.44Å; F480-L592 HydrophobicContact CE1-CD1 4.05Å; F480-L592 HydrophobicContact CE1-CD2 4.38Å; F480-L592 HydrophobicContact CZ-CD1 4.05Å
481	G	68.6	Low	84.1	Confident	68 Å²	68	57 Å²	57	70%	0.701	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	22.6	-175.4	0	0	0	0	0	114.3	P477 G478	P477-G481 PolarHBondContact O-N 3.04Å; G478-G481 PolarHBondContact O-N 2.75Å
482	S	70.7	Confident	84.2	Confident	16 Å²	16	56.9 Å²	56.9	11%	0.112	36%	0.355	C	S	.	.			trans	-103.9	144.2	-179.5	59.8	0	0	0	0	112	P477 F480 L484	P477-S482 CarbonylContact C-O 3.36Å; P477-S482 WeakPolarHBondContact CB-O 3.22Å; P477-S482 PolarHBondContact O-N 3.32Å; P477-S482 PolarHBondContact O-OG 3.26Å; F480-S482 VanDerWaalsContact C-N 3.27Å; F480-S482 PolarHBondContact O-N 3.13Å; S482-L484 VanDerWaalsContact C-N 3.33Å
483	H	71.2	Confident	84.4	Confident	187 Å²	187	60.8 Å²	60.8	87%	0.866	37%	0.373	S	S	*	.			trans	-86.5	-3.4	172.7	-62.4	-69.6	0	0	0	113.7
484	L	75.6	Confident	84.6	Confident	8 Å²	8	60.9 Å²	60.9	4%	0.042	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-60	135.4	-176.5	-58.8	171.8	0	0	0	111.9	P477 S482 L526 E530 E538 L542	P477-L484 WeakPolarHBondContact CB-O 3.46Å; P477-L484 VanDerWaalsContact CG-O 3.25Å; P477-L484 WeakPolarHBondContact CG-O 3.4Å; S482-L484 VanDerWaalsContact C-N 3.33Å; L484-L526 HydrophobicContact CD1-CD1 4.34Å; L484-L526 HydrophobicContact CD2-CD1 4.02Å; L484-E530 HydrophobicContact CD2-CG 3.43Å; L484-E530 VanDerWaalsContact CD2-CG 3.43Å; L484-E530 WeakPolarHBondContact CD2-OE1 3.36Å; L484-E538 HydrophobicContact CD1-CB 4Å; L484-E538 WeakPolarHBondContact CD1-O 3.44Å; L484-E538 HydrophobicContact CD2-CB 4.46Å; L484-L542 HydrophobicContact CD1-CB 4.1Å
485	S	80.4	Confident	84.8	Confident	74 Å²	74	57.1 Å²	57.1	52%	0.517	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-83.7	154.8	175.4	-67.9	0	0	0	0	111.3	Q529	S485-Q529 PolarHBondContact O-NE2 3.21Å; S485-Q529 PolarHBondContact O-OE1 3.36Å
486	L	85.7	Confident	85.3	Confident	67 Å²	67	56 Å²	56	35%	0.351	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-62.2	141	168.2	-80.6	160.3	0	0	0	110.3	M492 L545 V546	L486-M492 HydrophobicContact CD2-CE 3.94Å; L486-M492 HydrophobicContact CD2-SD 4.19Å; L486-L545 HydrophobicContact CD2-CD2 4.05Å; L486-L545 HydrophobicContact CD2-CG 3.91Å; L486-L545 HydrophobicContact CG-CD2 4.03Å; L486-L545 HydrophobicContact CG-CG 4.35Å; L486-V546 HydrophobicContact CD2-CG2 4.34Å
487	P	90.6	Very high	85.9	Confident	8 Å²	8	59.3 Å²	59.3	5%	0.052	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-55.4	161.1	166	-24	34.3	0	0	0	111.7	E491 M492 L522 A525 L542 V546	P487-E491 HydrophobicContact CB-CB 3.91Å; P487-M492 HydrophobicContact CB-CG 4.13Å; P487-M492 HydrophobicContact CB-SD 4.08Å; P487-M492 HydrophobicContact CG-SD 4Å; P487-M492 WeakPolarHBondContact O-CG 3.37Å; P487-L522 HydrophobicContact CG-CD2 4.34Å; P487-A525 HydrophobicContact CB-CB 3.86Å; P487-A525 HydrophobicContact CG-CB 3.94Å; P487-L542 HydrophobicContact CG-CD1 4.21Å; P487-V546 HydrophobicContact CG-CG2 4.04Å
488	S	91.6	Very high	86.6	Confident	52 Å²	52	59.4 Å²	59.4	36%	0.364	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-60.1	154.6	179.4	69.7	0	0	0	0	111.6	V490 E491 M492	S488-V490 PolarHBondContact O-N 3.45Å; S488-E491 WeakPolarHBondContact CB-OE2 3.04Å; S488-E491 PolarHBondContact N-OE2 3.22Å; S488-E491 PolarHBondContact O-N 3.49Å; S488-E491 WeakPolarHBondContact OG-CG 3.49Å; S488-E491 PolarHBondContact OG-N 3.16Å; S488-E491 PolarHBondContact OG-OE2 3.3Å; S488-M492 WeakPolarHBondContact O-CB 3.44Å; S488-M492 WeakPolarHBondContact O-CG 3.29Å; S488-M492 PolarHBondContact O-N 2.88Å
489	P	92.6	Very high	87.6	Confident	114 Å²	114	56.8 Å²	56.8	74%	0.74	32%	0.317	S	S	*	.	H	α-helix	trans	-54.1	-28.9	179.5	-28.6	36.1	0	0	0	114.2	E493	P489-E493 WeakPolarHBondContact O-CB 3.04Å; P489-E493 PolarHBondContact O-N 3.16Å
490	V	93.3	Very high	88.5	Confident	97 Å²	97	58 Å²	58	59%	0.588	32%	0.321	S	S	*	.	H	α-helix	trans	-72.7	-45.3	176.9	-179.6	0	0	0	0	111.4	S488 E493 Q494	S488-V490 PolarHBondContact O-N 3.45Å; V490-E493 PolarHBondContact O-N 3.46Å; V490-Q494 VanDerWaalsContact O-CG 3.3Å; V490-Q494 WeakPolarHBondContact O-CG 3.16Å; V490-Q494 PolarHBondContact O-N 3.38Å
491	E	92.2	Very high	89.4	Confident	55 Å²	55	60 Å²	60	26%	0.257	33%	0.331	S	S	.	.	H	α-helix	trans	-66.4	-40.2	175.7	-66.8	163.3	118.6	0	0	111.3	P487 S488 E493 Q494 V495 A525	P487-E491 HydrophobicContact CB-CB 3.91Å; S488-E491 WeakPolarHBondContact CB-OE2 3.04Å; S488-E491 PolarHBondContact N-OE2 3.22Å; S488-E491 PolarHBondContact O-N 3.49Å; S488-E491 WeakPolarHBondContact OG-CG 3.49Å; S488-E491 PolarHBondContact OG-N 3.16Å; S488-E491 PolarHBondContact OG-OE2 3.3Å; E491-E493 PolarHBondContact O-N 3.44Å; E491-Q494 PolarHBondContact O-N 3.42Å; E491-V495 WeakPolarHBondContact O-CG2 3.37Å; E491-V495 PolarHBondContact O-N 2.91Å; E491-A525 WeakPolarHBondContact OE1-CB 3.28Å
492	M	94	Very high	90.7	Very high	26 Å²	26	56.8 Å²	56.8	13%	0.128	30%	0.297	C	S	.	.	H	α-helix	trans	-57.2	-47.1	174.1	-72.7	-64.5	-70.1	0	0	111.8	L486 P487 S488 V495 R496 V546 H549	L486-M492 HydrophobicContact CD2-CE 3.94Å; L486-M492 HydrophobicContact CD2-SD 4.19Å; P487-M492 HydrophobicContact CB-CG 4.13Å; P487-M492 HydrophobicContact CB-SD 4.08Å; P487-M492 HydrophobicContact CG-SD 4Å; P487-M492 WeakPolarHBondContact O-CG 3.37Å; S488-M492 WeakPolarHBondContact O-CB 3.44Å; S488-M492 WeakPolarHBondContact O-CG 3.29Å; S488-M492 PolarHBondContact O-N 2.88Å; M492-V495 PolarHBondContact O-N 3.32Å; M492-R496 WeakPolarHBondContact O-CB 3.44Å; M492-R496 PolarHBondContact O-N 2.82Å; M492-V546 HydrophobicContact CE-CB 4.28Å; M492-V546 HydrophobicContact CE-CG1 3.79Å; M492-V546 HydrophobicContact CE-CG2 4.17Å; M492-V546 HydrophobicContact SD-CB 4.2Å; M492-V546 HydrophobicContact SD-CG1 3.7Å; M492-V546 HydrophobicContact SD-CG2 3.62Å; M492-H549 HydrophobicContact CE-CB 3.48Å; M492-H549 VanDerWaalsContact CE-CB 3.48Å
493	E	94.8	Very high	91.9	Very high	82 Å²	82	57.4 Å²	57.4	38%	0.383	30%	0.299	S	S	.	.	H	α-helix	trans	-68.8	-36.5	176.5	-178.1	54.2	-155.5	0	0	111.8	P489 V490 E491 V495 R496 Q497	P489-E493 WeakPolarHBondContact O-CB 3.04Å; P489-E493 PolarHBondContact O-N 3.16Å; V490-E493 PolarHBondContact O-N 3.46Å; E491-E493 PolarHBondContact O-N 3.44Å; E493-V495 VanDerWaalsContact C-N 3.34Å; E493-V495 PolarHBondContact O-N 3.49Å; E493-R496 WeakPolarHBondContact O-CB 3.46Å; E493-R496 PolarHBondContact O-N 2.78Å; E493-R496 WeakPolarHBondContact OE2-CD 3.4Å; E493-Q497 HydrophobicContact CG-CG 4.36Å; E493-Q497 WeakPolarHBondContact O-CB 3.47Å; E493-Q497 WeakPolarHBondContact O-CG 3.38Å; E493-Q497 PolarHBondContact O-N 3.18Å; E493-Q497 WeakPolarHBondContact OE1-CG 3.15Å; E493-Q497 PolarHBondContact OE1-NE2 3.38Å
494	Q	95.9	Very high	92.9	Very high	91 Å²	91	58.3 Å²	58.3	43%	0.425	30%	0.295	S	S	.	.	H	α-helix	trans	-60.8	-41.7	172.8	-70.9	174.6	24.2	0	0	112.1	V490 E491 K498 L521	V490-Q494 VanDerWaalsContact O-CG 3.3Å; V490-Q494 WeakPolarHBondContact O-CG 3.16Å; V490-Q494 PolarHBondContact O-N 3.38Å; E491-Q494 PolarHBondContact O-N 3.42Å; Q494-K498 WeakPolarHBondContact O-CG 3.37Å; Q494-K498 PolarHBondContact O-N 3.12Å; Q494-L521 HydrophobicContact CB-CD1 3.92Å
495	V	95.9	Very high	93.9	Very high	3 Å²	3	59.2 Å²	59.2	2%	0.018	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-47.1	173.4	171	0	0	0	0	110.6	E491 M492 E493 Q497 K498 L499 A518 L521 L522 V546	E491-V495 WeakPolarHBondContact O-CG2 3.37Å; E491-V495 PolarHBondContact O-N 2.91Å; M492-V495 PolarHBondContact O-N 3.32Å; E493-V495 VanDerWaalsContact C-N 3.34Å; E493-V495 PolarHBondContact O-N 3.49Å; V495-Q497 VanDerWaalsContact C-N 3.33Å; V495-Q497 PolarHBondContact O-N 3.43Å; V495-K498 PolarHBondContact O-N 2.92Å; V495-K498 VanDerWaalsContact O-N 3.09Å; V495-L499 HydrophobicContact CG1-CD1 4.02Å; V495-L499 WeakPolarHBondContact O-CG 3.26Å; V495-L499 PolarHBondContact O-N 3.05Å; V495-A518 HydrophobicContact CG1-CB 4.31Å; V495-L521 HydrophobicContact CG2-CB 3.79Å; V495-L521 HydrophobicContact CG2-CD1 4.3Å; V495-L522 HydrophobicContact CG1-CD1 4.38Å; V495-L522 HydrophobicContact CG1-CD2 4.4Å; V495-L522 HydrophobicContact CG1-CG 4.33Å; V495-L522 HydrophobicContact CG2-CD2 3.97Å; V495-L522 HydrophobicContact CG2-CG 3.94Å; V495-V546 HydrophobicContact CG1-CG1 3.86Å
496	R	96.6	Very high	94.6	Very high	77 Å²	77	57.5 Å²	57.5	29%	0.291	28%	0.284	S	S	.	.	H	α-helix	trans	-55.4	-45.8	176	-164.5	-168.2	-170.9	88.8	14.1	111.5	M492 E493 K498 L499 L500 H549 C550	M492-R496 WeakPolarHBondContact O-CB 3.44Å; M492-R496 PolarHBondContact O-N 2.82Å; E493-R496 WeakPolarHBondContact O-CB 3.46Å; E493-R496 PolarHBondContact O-N 2.78Å; E493-R496 WeakPolarHBondContact OE2-CD 3.4Å; R496-K498 VanDerWaalsContact C-N 3.34Å; R496-K498 PolarHBondContact O-N 3.03Å; R496-L499 PolarHBondContact O-N 2.86Å; R496-L500 HydrophobicContact CG-CD1 4.19Å; R496-L500 WeakPolarHBondContact O-CB 3.35Å; R496-L500 WeakPolarHBondContact O-CG 3.35Å; R496-L500 PolarHBondContact O-N 2.82Å; R496-H549 PolarHBondContact NH1-O 2.92Å; R496-C550 PolarHBondContact NH1-O 3.11Å; R496-C550 PolarHBondContact NH2-O 3.22Å
497	Q	97.1	Very high	95	Very high	84 Å²	84	55.1 Å²	55.1	39%	0.393	27%	0.272	S	S	.	.	H	α-helix	trans	-59.2	-41.1	176.1	-72.8	-74	-28.6	0	0	112.1	E493 V495 L500 Q501	E493-Q497 HydrophobicContact CG-CG 4.36Å; E493-Q497 WeakPolarHBondContact O-CB 3.47Å; E493-Q497 WeakPolarHBondContact O-CG 3.38Å; E493-Q497 PolarHBondContact O-N 3.18Å; E493-Q497 WeakPolarHBondContact OE1-CG 3.15Å; E493-Q497 PolarHBondContact OE1-NE2 3.38Å; V495-Q497 VanDerWaalsContact C-N 3.33Å; V495-Q497 PolarHBondContact O-N 3.43Å; Q497-L500 PolarHBondContact O-N 2.98Å; Q497-Q501 WeakPolarHBondContact O-CB 3.32Å; Q497-Q501 VanDerWaalsContact O-CG 3.24Å; Q497-Q501 WeakPolarHBondContact O-CG 3.5Å; Q497-Q501 PolarHBondContact O-N 3.32Å
498	K	97.4	Very high	95.1	Very high	45 Å²	45	54.8 Å²	54.8	20%	0.196	27%	0.27	C	S	.	.	H	α-helix	trans	-68.5	-37	176.3	-66	-56.5	179.3	178.9	0	112.8	Q494 V495 R496 Q501 L502 Q517 A518 L521	Q494-K498 WeakPolarHBondContact O-CG 3.37Å; Q494-K498 PolarHBondContact O-N 3.12Å; V495-K498 PolarHBondContact O-N 2.92Å; V495-K498 VanDerWaalsContact O-N 3.09Å; R496-K498 VanDerWaalsContact C-N 3.34Å; R496-K498 PolarHBondContact O-N 3.03Å; K498-Q501 PolarHBondContact O-N 3.45Å; K498-L502 PolarHBondContact O-N 3.37Å; K498-Q517 HydrophobicContact CD-CB 3.85Å; K498-Q517 HydrophobicContact CG-CB 4.06Å; K498-A518 HydrophobicContact CB-CB 3.91Å; K498-L521 HydrophobicContact CG-CD1 4.11Å
499	L	97.4	Very high	94.9	Very high	5 Å²	5	53.4 Å²	53.4	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-69.2	-40	173.7	-64	171.9	0	0	0	111.8	V495 R496 Q501 L502 L503 L515 A518 L547 C550 L552 L555	V495-L499 HydrophobicContact CG1-CD1 4.02Å; V495-L499 WeakPolarHBondContact O-CG 3.26Å; V495-L499 PolarHBondContact O-N 3.05Å; R496-L499 PolarHBondContact O-N 2.86Å; L499-Q501 VanDerWaalsContact C-N 3.32Å; L499-Q501 PolarHBondContact O-N 3.19Å; L499-L502 WeakPolarHBondContact O-CA 3.33Å; L499-L502 WeakPolarHBondContact O-CB 3.3Å; L499-L502 PolarHBondContact O-N 2.88Å; L499-L503 PolarHBondContact O-N 3.18Å; L499-L515 HydrophobicContact CD2-CD1 4.49Å; L499-A518 HydrophobicContact CD2-CB 4.09Å; L499-A518 HydrophobicContact CG-CB 4.25Å; L499-L547 HydrophobicContact CD1-CD2 3.94Å; L499-C550 HydrophobicContact CD1-CB 4.27Å; L499-L552 HydrophobicContact CB-CD1 3.73Å; L499-L555 HydrophobicContact CB-CD1 4.38Å; L499-L555 HydrophobicContact CB-CD2 4.46Å; L499-L555 HydrophobicContact CD1-CD1 4.1Å; L499-L555 HydrophobicContact CD2-CD1 4.16Å; L499-L555 HydrophobicContact CD2-CD2 4.18Å; L499-L555 HydrophobicContact CG-CD1 4.45Å
500	L	97.7	Very high	94.9	Very high	43 Å²	43	49.7 Å²	49.7	23%	0.225	24%	0.239	C	C	.	.	H	α-helix	trans	-64	-35.1	172.7	-70.7	170.9	0	0	0	112.5	R496 Q497 L502 L503 R504 L552	R496-L500 HydrophobicContact CG-CD1 4.19Å; R496-L500 WeakPolarHBondContact O-CB 3.35Å; R496-L500 WeakPolarHBondContact O-CG 3.35Å; R496-L500 PolarHBondContact O-N 2.82Å; Q497-L500 PolarHBondContact O-N 2.98Å; L500-L502 VanDerWaalsContact C-N 3.32Å; L500-L503 HydrophobicContact CD2-CD1 4.35Å; L500-R504 WeakPolarHBondContact O-CG 3.41Å; L500-R504 PolarHBondContact O-N 3.03Å; L500-L552 HydrophobicContact CD2-CD1 4.23Å; L500-L552 HydrophobicContact CD2-CD2 3.85Å; L500-L552 HydrophobicContact CG-CD1 4.36Å
501	Q	97.1	Very high	94.9	Very high	58 Å²	58	45 Å²	45	27%	0.271	21%	0.211	S	C	.	.	H	α-helix	trans	-66.3	-32.4	171	-73.5	170.2	17.3	0	0	112.2	Q497 K498 L499 T505 R514	Q497-Q501 WeakPolarHBondContact O-CB 3.32Å; Q497-Q501 VanDerWaalsContact O-CG 3.24Å; Q497-Q501 WeakPolarHBondContact O-CG 3.5Å; Q497-Q501 PolarHBondContact O-N 3.32Å; K498-Q501 PolarHBondContact O-N 3.45Å; L499-Q501 VanDerWaalsContact C-N 3.32Å; L499-Q501 PolarHBondContact O-N 3.19Å; Q501-T505 PolarHBondContact O-N 2.83Å; Q501-T505 PolarHBondContact O-OG1 3.34Å; Q501-R514 HydrophobicContact CB-CG 4.17Å
502	L	96.9	Very high	94.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.8	-51.3	173.8	-168.4	167	0	0	0	110.9	K498 L499 L500 R504 T505 Q511 R514 L515 L555 E558 M562	K498-L502 PolarHBondContact O-N 3.37Å; L499-L502 WeakPolarHBondContact O-CA 3.33Å; L499-L502 WeakPolarHBondContact O-CB 3.3Å; L499-L502 PolarHBondContact O-N 2.88Å; L500-L502 VanDerWaalsContact C-N 3.32Å; L502-R504 VanDerWaalsContact C-N 3.26Å; L502-R504 PolarHBondContact O-N 3.02Å; L502-T505 WeakPolarHBondContact O-CB 3.45Å; L502-T505 PolarHBondContact O-N 2.92Å; L502-Q511 HydrophobicContact CD2-CB 4.02Å; L502-Q511 HydrophobicContact CD2-CG 4.16Å; L502-Q511 HydrophobicContact CG-CB 3.92Å; L502-Q511 HydrophobicContact CG-CG 4.34Å; L502-Q511 PolarHBondContact O-NE2 3.35Å; L502-R514 HydrophobicContact CB-CB 3.9Å; L502-R514 HydrophobicContact CG-CB 4.41Å; L502-L515 HydrophobicContact CD1-CB 3.79Å; L502-L515 HydrophobicContact CD1-CD1 4.36Å; L502-L555 HydrophobicContact CD2-CD2 4.34Å; L502-E558 HydrophobicContact CD2-CB 3.59Å; L502-E558 HydrophobicContact CD2-CG 3.92Å; L502-M562 HydrophobicContact CD1-CE 4.06Å; L502-M562 HydrophobicContact CD1-SD 4.34Å; L502-M562 HydrophobicContact CD2-CE 3.95Å; L502-M562 HydrophobicContact CD2-SD 4.32Å; L502-M562 HydrophobicContact CG-CE 4.49Å
503	L	95.4	Very high	94.4	Very high	30 Å²	30	44.7 Å²	44.7	16%	0.157	21%	0.209	C	C	.	.	H	α-helix	trans	-55.6	-39.8	179.3	-59.7	-173.8	0	0	0	112.6	R445 L499 L500 T505 L552 E554 L555 E558	R445-L503 PolarHBondContact NH2-O 2.95Å; L499-L503 PolarHBondContact O-N 3.18Å; L500-L503 HydrophobicContact CD2-CD1 4.35Å; L503-T505 VanDerWaalsContact C-N 3.3Å; L503-T505 PolarHBondContact O-N 3.43Å; L503-L552 HydrophobicContact CD1-CD1 4.49Å; L503-L552 HydrophobicContact CD1-CD2 4.37Å; L503-E554 HydrophobicContact CD1-CB 3.99Å; L503-E554 HydrophobicContact CD2-CB 3.8Å; L503-L555 HydrophobicContact CD2-CD2 3.67Å; L503-L555 HydrophobicContact CD2-CG 4.1Å; L503-L555 HydrophobicContact CG-CD2 4.45Å; L503-E558 HydrophobicContact CD2-CB 4.49Å; L503-E558 HydrophobicContact CD2-CG 3.48Å; L503-E558 VanDerWaalsContact CD2-CG 3.48Å
504	R	93.4	Very high	94.4	Very high	206 Å²	206	43.8 Å²	43.8	78%	0.777	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-13.8	-179.9	-67.9	174.6	-177.3	173.6	2.8	114.2	L500 L502	L500-R504 WeakPolarHBondContact O-CG 3.41Å; L500-R504 PolarHBondContact O-N 3.03Å; L502-R504 VanDerWaalsContact C-N 3.26Å; L502-R504 PolarHBondContact O-N 3.02Å
505	T	95.1	Very high	94.3	Very high	26 Å²	26	39.5 Å²	39.5	16%	0.16	18%	0.182	C	C	.	.			trans	-88.3	132.4	-175.5	-63	0	0	0	0	110.8	Q501 L502 L503 A510 Q511	Q501-T505 PolarHBondContact O-N 2.83Å; Q501-T505 PolarHBondContact O-OG1 3.34Å; L502-T505 WeakPolarHBondContact O-CB 3.45Å; L502-T505 PolarHBondContact O-N 2.92Å; L503-T505 VanDerWaalsContact C-N 3.3Å; L503-T505 PolarHBondContact O-N 3.43Å; T505-A510 HydrophobicContact CG2-CB 3.61Å; T505-Q511 HydrophobicContact CG2-CG 3.8Å; T505-Q511 WeakPolarHBondContact O-CG 3.42Å; T505-Q511 PolarHBondContact O-NE2 3.4Å; T505-Q511 VanDerWaalsContact O-NE2 3.13Å
506	Y	95.1	Very high	93.9	Very high	39 Å²	39	40 Å²	40	15%	0.153	18%	0.184	C	C	.	.			trans	-92.6	-14.2	-178.8	70.2	-89.9	0	0	0	114.7	H437 K442 Y561	H437-Y506 HydrophobicContact CB-CE2 4.26Å; H437-Y506 WeakPolarHBondContact O-CE2 3.29Å; K442-Y506 HydrophobicContact CB-CD1 4.45Å; K442-Y506 HydrophobicContact CB-CD2 3.61Å; K442-Y506 HydrophobicContact CB-CE2 3.72Å; K442-Y506 HydrophobicContact CB-CG 4.01Å; K442-Y506 HydrophobicContact CD-CD1 4.17Å; K442-Y506 HydrophobicContact CD-CE1 3.9Å; K442-Y506 HydrophobicContact CD-CE2 4.44Å; K442-Y506 HydrophobicContact CG-CD1 4.04Å; K442-Y506 HydrophobicContact CG-CD2 4.11Å; K442-Y506 HydrophobicContact CG-CE1 4.22Å; K442-Y506 HydrophobicContact CG-CE2 4.28Å; K442-Y506 HydrophobicContact CG-CG 4Å; Y506-Y561 PolarHBondContact O-OH 3.43Å
507	S	94.4	Very high	93.6	Very high	17 Å²	17	39.8 Å²	39.8	12%	0.119	19%	0.187	C	C	.	.			trans	-102.1	120.6	-176.4	170.1	0	0	0	0	109.4	H437 S509 A510 Q511	H437-S507 PolarHBondContact ND1-OG 2.89Å; S507-S509 VanDerWaalsContact C-N 3.33Å; S507-S509 PolarHBondContact O-N 3.29Å; S507-A510 WeakPolarHBondContact O-CA 3.5Å; S507-A510 WeakPolarHBondContact O-CB 3.27Å; S507-A510 PolarHBondContact O-N 2.99Å; S507-Q511 PolarHBondContact O-N 2.88Å
508	P	92.1	Very high	93.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-35.3	-172.4	29	-37.2	0	0	0	112.2	L441 A510 Q511 V512 M562 L565 L566	L441-P508 HydrophobicContact CD1-CG 4.24Å; P508-A510 PolarHBondContact O-N 3.47Å; P508-Q511 PolarHBondContact O-N 3.35Å; P508-Q511 VanDerWaalsContact O-N 3.15Å; P508-V512 PolarHBondContact O-N 3.36Å; P508-M562 HydrophobicContact CB-CG 4.44Å; P508-L565 HydrophobicContact CB-CB 4.48Å; P508-L565 HydrophobicContact CG-CB 4.01Å; P508-L566 HydrophobicContact CB-CD2 4.35Å; P508-L566 HydrophobicContact CB-CG 4.03Å; P508-L566 HydrophobicContact CG-CD2 4.42Å; P508-L566 HydrophobicContact CG-CG 4.42Å
509	S	89.1	Confident	93.1	Very high	24 Å²	24	33.8 Å²	33.8	17%	0.168	16%	0.159	C	C	.	.	H	α-helix	trans	-62.6	-12.3	171.1	-41.6	0	0	0	0	114.5	E433 H437 S507 K513	E433-S509 WeakPolarHBondContact OE1-CB 3.47Å; E433-S509 PolarHBondContact OE1-OG 3.33Å; H437-S509 PolarHBondContact CE1-OG 2.8Å; S507-S509 VanDerWaalsContact C-N 3.33Å; S507-S509 PolarHBondContact O-N 3.29Å; S509-K513 WeakPolarHBondContact O-CE 3.24Å; S509-K513 WeakPolarHBondContact O-CG 2.94Å
510	A	91.2	Very high	92.6	Very high	35 Å²	35	39.9 Å²	39.9	29%	0.289	19%	0.186	S	C	.	.	H	α-helix	trans	-104.7	-31.9	173.8	0	0	0	0	0	111.9	T505 S507 P508 K513 R514	T505-A510 HydrophobicContact CG2-CB 3.61Å; S507-A510 WeakPolarHBondContact O-CA 3.5Å; S507-A510 WeakPolarHBondContact O-CB 3.27Å; S507-A510 PolarHBondContact O-N 2.99Å; P508-A510 PolarHBondContact O-N 3.47Å; A510-K513 WeakPolarHBondContact O-CB 3.33Å; A510-K513 PolarHBondContact O-N 3.05Å; A510-K513 VanDerWaalsContact O-N 3.14Å; A510-R514 PolarHBondContact O-N 2.81Å; A510-R514 VanDerWaalsContact O-N 3.12Å
511	Q	94.4	Very high	92.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.6	-46.2	169.6	-69.8	179.7	-59.9	0	0	111.5	L502 T505 S507 P508 K513 R514 L515 E558 Y561 M562	L502-Q511 HydrophobicContact CD2-CB 4.02Å; L502-Q511 HydrophobicContact CD2-CG 4.16Å; L502-Q511 HydrophobicContact CG-CB 3.92Å; L502-Q511 HydrophobicContact CG-CG 4.34Å; L502-Q511 PolarHBondContact O-NE2 3.35Å; T505-Q511 HydrophobicContact CG2-CG 3.8Å; T505-Q511 WeakPolarHBondContact O-CG 3.42Å; T505-Q511 PolarHBondContact O-NE2 3.4Å; T505-Q511 VanDerWaalsContact O-NE2 3.13Å; S507-Q511 PolarHBondContact O-N 2.88Å; P508-Q511 PolarHBondContact O-N 3.35Å; P508-Q511 VanDerWaalsContact O-N 3.15Å; Q511-K513 PolarHBondContact O-N 3.12Å; Q511-R514 CarbonylContact O-C 3.48Å; Q511-R514 WeakPolarHBondContact O-CA 3.49Å; Q511-R514 WeakPolarHBondContact O-CB 3.23Å; Q511-R514 PolarHBondContact O-N 2.67Å; Q511-L515 PolarHBondContact O-N 3.1Å; Q511-E558 PolarHBondContact NE2-OE2 3Å; Q511-Y561 VanDerWaalsContact OE1-CD1 3.23Å; Q511-M562 HydrophobicContact CB-CG 3.6Å; Q511-M562 HydrophobicContact CB-SD 3.46Å; Q511-M562 WeakPolarHBondContact CB-SD 2.84Å; Q511-M562 HydrophobicContact CG-CG 4.42Å
512	V	89.1	Confident	91.8	Very high	8 Å²	8	37 Å²	37	5%	0.048	17%	0.172	C	C	.	.	H	α-helix	trans	-59.4	-32.5	173.9	168.2	0	0	0	0	112.1	P508 L515 L516 M562 L566 L579	P508-V512 PolarHBondContact O-N 3.36Å; V512-L515 WeakPolarHBondContact O-CB 3.37Å; V512-L515 PolarHBondContact O-N 3.37Å; V512-L516 HydrophobicContact CG1-CD1 3.83Å; V512-L516 VanDerWaalsContact O-CD1 3.24Å; V512-L516 WeakPolarHBondContact O-CD1 3.14Å; V512-L516 PolarHBondContact O-N 2.78Å; V512-M562 HydrophobicContact CG2-CB 4.48Å; V512-M562 HydrophobicContact CG2-CG 4.33Å; V512-M562 HydrophobicContact CG2-SD 3.68Å; V512-L566 HydrophobicContact CG2-CD1 3.54Å; V512-L579 HydrophobicContact CG2-CD2 4.46Å
513	K	86.4	Confident	91.3	Very high	66 Å²	66	37.1 Å²	37.1	29%	0.287	17%	0.173	S	C	.	.	H	α-helix	trans	-69.1	-32.6	173.9	-66.5	179.5	-178	-166.4	0	112.7	S244 S509 A510 Q511 Q517	S244-K513 PolarHBondContact OG-NZ 3.42Å; S509-K513 WeakPolarHBondContact O-CE 3.24Å; S509-K513 WeakPolarHBondContact O-CG 2.94Å; A510-K513 WeakPolarHBondContact O-CB 3.33Å; A510-K513 PolarHBondContact O-N 3.05Å; A510-K513 VanDerWaalsContact O-N 3.14Å; Q511-K513 PolarHBondContact O-N 3.12Å; K513-Q517 WeakPolarHBondContact O-CG 3.35Å; K513-Q517 PolarHBondContact O-N 2.67Å
514	R	94.3	Very high	90.9	Very high	63 Å²	63	40.7 Å²	40.7	24%	0.238	19%	0.19	C	C	.	.	H	α-helix	trans	-73	-36.3	171.5	-61.5	-56.9	-177.8	-165.8	4.4	111.5	Q501 L502 A510 Q511 Q517 A518	Q501-R514 HydrophobicContact CB-CG 4.17Å; L502-R514 HydrophobicContact CB-CB 3.9Å; L502-R514 HydrophobicContact CG-CB 4.41Å; A510-R514 PolarHBondContact O-N 2.81Å; A510-R514 VanDerWaalsContact O-N 3.12Å; Q511-R514 CarbonylContact O-C 3.48Å; Q511-R514 WeakPolarHBondContact O-CA 3.49Å; Q511-R514 WeakPolarHBondContact O-CB 3.23Å; Q511-R514 PolarHBondContact O-N 2.67Å; R514-Q517 WeakPolarHBondContact O-CB 3.42Å; R514-Q517 PolarHBondContact O-N 3.12Å; R514-A518 PolarHBondContact O-N 3.13Å
515	L	93.8	Very high	90.6	Very high	1 Å²	1	31 Å²	31	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-60	-49.1	172.1	-175	55.3	0	0	0	111.6	L499 L502 Q511 V512 Q517 A518 C519 M562 L579 L582	L499-L515 HydrophobicContact CD2-CD1 4.49Å; L502-L515 HydrophobicContact CD1-CB 3.79Å; L502-L515 HydrophobicContact CD1-CD1 4.36Å; Q511-L515 PolarHBondContact O-N 3.1Å; V512-L515 WeakPolarHBondContact O-CB 3.37Å; V512-L515 PolarHBondContact O-N 3.37Å; L515-Q517 VanDerWaalsContact C-N 3.27Å; L515-Q517 PolarHBondContact O-N 3.44Å; L515-A518 WeakPolarHBondContact O-CB 3.43Å; L515-A518 PolarHBondContact O-N 2.71Å; L515-C519 PolarHBondContact O-N 3.33Å; L515-C519 PolarHBondContact O-SG 3.16Å; L515-M562 HydrophobicContact CD2-CE 4.46Å; L515-L579 HydrophobicContact CD2-CB 4.35Å; L515-L579 HydrophobicContact CD2-CD1 4.4Å; L515-L582 HydrophobicContact CD1-CB 4.29Å; L515-L582 HydrophobicContact CD1-CD2 3.97Å; L515-L582 HydrophobicContact CD2-CB 4.1Å; L515-L582 HydrophobicContact CD2-CD2 3.81Å
516	L	87.8	Confident	90.1	Very high	12 Å²	12	29.8 Å²	29.8	6%	0.063	15%	0.147	C	C	.	.	H	α-helix	trans	-59	-36.7	174.6	-95.7	73.4	0	0	0	112.8	F241 F245 V512 A518 C519 K520 E574 Y578	F241-L516 HydrophobicContact CE1-CD2 3.57Å; F241-L516 HydrophobicContact CZ-CD2 3.52Å; F245-L516 HydrophobicContact CZ-CD2 4.47Å; V512-L516 HydrophobicContact CG1-CD1 3.83Å; V512-L516 VanDerWaalsContact O-CD1 3.24Å; V512-L516 WeakPolarHBondContact O-CD1 3.14Å; V512-L516 PolarHBondContact O-N 2.78Å; L516-A518 VanDerWaalsContact C-N 3.35Å; L516-C519 PolarHBondContact O-N 2.99Å; L516-K520 VanDerWaalsContact O-CB 3.29Å; L516-K520 WeakPolarHBondContact O-CB 3.22Å; L516-K520 PolarHBondContact O-N 2.79Å; L516-E574 HydrophobicContact CD2-CG 3.85Å; L516-E574 HydrophobicContact CG-CG 4.33Å; L516-Y578 HydrophobicContact CD1-CD2 3.67Å; L516-Y578 HydrophobicContact CD1-CG 4.39Å; L516-Y578 HydrophobicContact CG-CD2 3.67Å; L516-Y578 HydrophobicContact CG-CE2 4.06Å
517	Q	89.9	Confident	89.6	Confident	74 Å²	74	29.8 Å²	29.8	35%	0.346	15%	0.146	S	C	.	.	H	α-helix	trans	-65.1	-38	175	-74	176.7	1.9	0	0	111.8	K498 K513 R514 L515 L521	K498-Q517 HydrophobicContact CD-CB 3.85Å; K498-Q517 HydrophobicContact CG-CB 4.06Å; K513-Q517 WeakPolarHBondContact O-CG 3.35Å; K513-Q517 PolarHBondContact O-N 2.67Å; R514-Q517 WeakPolarHBondContact O-CB 3.42Å; R514-Q517 PolarHBondContact O-N 3.12Å; L515-Q517 VanDerWaalsContact C-N 3.27Å; L515-Q517 PolarHBondContact O-N 3.44Å; Q517-L521 WeakPolarHBondContact O-CG 3.32Å; Q517-L521 PolarHBondContact O-N 2.97Å
518	A	94.5	Very high	89.1	Confident	2 Å²	2	34.6 Å²	34.6	2%	0.017	18%	0.175	C	C	.	.	H	α-helix	trans	-67.4	-50.3	172.4	0	0	0	0	0	111.9	V495 K498 L499 R514 L515 L516 K520 L521 L522	V495-A518 HydrophobicContact CG1-CB 4.31Å; K498-A518 HydrophobicContact CB-CB 3.91Å; L499-A518 HydrophobicContact CD2-CB 4.09Å; L499-A518 HydrophobicContact CG-CB 4.25Å; R514-A518 PolarHBondContact O-N 3.13Å; L515-A518 WeakPolarHBondContact O-CB 3.43Å; L515-A518 PolarHBondContact O-N 2.71Å; L516-A518 VanDerWaalsContact C-N 3.35Å; A518-K520 VanDerWaalsContact C-N 3.31Å; A518-K520 PolarHBondContact O-N 2.8Å; A518-L521 WeakPolarHBondContact O-CB 3.35Å; A518-L521 PolarHBondContact O-N 3.43Å; A518-L522 PolarHBondContact O-N 3.5Å
519	C	89.2	Confident	88.5	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63	-33.6	-179.1	-63	0	0	0	0	113.1	L515 L516 L522 Y523 F539 Y578	L515-C519 PolarHBondContact O-N 3.33Å; L515-C519 PolarHBondContact O-SG 3.16Å; L516-C519 PolarHBondContact O-N 2.99Å; C519-L522 PolarHBondContact O-N 3.05Å; C519-Y523 PolarHBondContact O-N 2.87Å; C519-F539 HydrophobicContact CB-CE2 4.46Å; C519-F539 HydrophobicContact CB-CZ 3.91Å; C519-Y578 HydrophobicContact CB-CD1 3.44Å; C519-Y578 VanDerWaalsContact CB-CD1 3.44Å; C519-Y578 HydrophobicContact CB-CD2 4.35Å; C519-Y578 HydrophobicContact CB-CE1 3.46Å; C519-Y578 VanDerWaalsContact CB-CE1 3.46Å; C519-Y578 HydrophobicContact CB-CE2 4.35Å; C519-Y578 HydrophobicContact CB-CG 3.9Å; C519-Y578 VanDerWaalsContact SG-CD1 3.51Å
520	K	87.1	Confident	87.8	Confident	133 Å²	133	41 Å²	41	58%	0.578	20%	0.202	S	C	*	.	H	α-helix	trans	-66.9	-40.2	174.7	-175.9	174.2	179.7	178	0	112.3	L516 A518 L522 Y523 M524	L516-K520 VanDerWaalsContact O-CB 3.29Å; L516-K520 WeakPolarHBondContact O-CB 3.22Å; L516-K520 PolarHBondContact O-N 2.79Å; A518-K520 VanDerWaalsContact C-N 3.31Å; A518-K520 PolarHBondContact O-N 2.8Å; K520-L522 VanDerWaalsContact C-N 3.33Å; K520-Y523 PolarHBondContact O-N 3.08Å; K520-M524 WeakPolarHBondContact O-CG 3.33Å; K520-M524 PolarHBondContact O-N 2.83Å
521	L	89.5	Confident	86.8	Confident	39 Å²	39	40.9 Å²	40.9	20%	0.204	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-42.8	174.1	-69.3	166.9	0	0	0	110.6	Q494 V495 K498 Q517 A518 Y523 M524 A525	Q494-L521 HydrophobicContact CB-CD1 3.92Å; V495-L521 HydrophobicContact CG2-CB 3.79Å; V495-L521 HydrophobicContact CG2-CD1 4.3Å; K498-L521 HydrophobicContact CG-CD1 4.11Å; Q517-L521 WeakPolarHBondContact O-CG 3.32Å; Q517-L521 PolarHBondContact O-N 2.97Å; A518-L521 WeakPolarHBondContact O-CB 3.35Å; A518-L521 PolarHBondContact O-N 3.43Å; L521-Y523 PolarHBondContact O-N 2.93Å; L521-M524 WeakPolarHBondContact O-CB 3.29Å; L521-M524 PolarHBondContact O-N 3.13Å; L521-M524 VanDerWaalsContact O-N 3.17Å; L521-A525 PolarHBondContact O-N 3.15Å
522	L	90	Very high	85.3	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-61.1	-41.6	174.4	-70.4	173.4	0	0	0	112.9	P487 V495 A518 C519 K520 M524 A525 L526 F539 L543 V546	P487-L522 HydrophobicContact CG-CD2 4.34Å; V495-L522 HydrophobicContact CG1-CD1 4.38Å; V495-L522 HydrophobicContact CG1-CD2 4.4Å; V495-L522 HydrophobicContact CG1-CG 4.33Å; V495-L522 HydrophobicContact CG2-CD2 3.97Å; V495-L522 HydrophobicContact CG2-CG 3.94Å; A518-L522 PolarHBondContact O-N 3.5Å; C519-L522 PolarHBondContact O-N 3.05Å; K520-L522 VanDerWaalsContact C-N 3.33Å; L522-M524 VanDerWaalsContact C-N 3.31Å; L522-M524 PolarHBondContact O-N 3.12Å; L522-A525 PolarHBondContact O-N 3.46Å; L522-L526 VanDerWaalsContact O-CB 3.25Å; L522-L526 WeakPolarHBondContact O-CB 3.1Å; L522-L526 PolarHBondContact O-N 3.44Å; L522-F539 HydrophobicContact CB-CE2 3.9Å; L522-L543 HydrophobicContact CD1-CD1 3.55Å; L522-V546 HydrophobicContact CD2-CB 4.04Å; L522-V546 HydrophobicContact CD2-CG1 3.99Å; L522-V546 HydrophobicContact CD2-CG2 3.74Å
523	Y	85.2	Confident	83.8	Confident	3 Å²	3	51.6 Å²	51.6	1%	0.012	26%	0.258	C	S	.	.	H	α-helix	trans	-67.8	-28.3	174.8	-99.8	-66.4	0	0	0	113.5	P211 C519 K520 L521 L526 R527 G535 F539 Y578	P211-Y523 VanDerWaalsContact CD-CE1 3.46Å; P211-Y523 VanDerWaalsContact CD-CZ 3.45Å; P211-Y523 HydrophobicContact CG-CD1 4.32Å; P211-Y523 HydrophobicContact CG-CD2 3.77Å; P211-Y523 HydrophobicContact CG-CE1 4.06Å; P211-Y523 HydrophobicContact CG-CE2 3.44Å; P211-Y523 VanDerWaalsContact CG-CE2 3.44Å; P211-Y523 HydrophobicContact CG-CG 4.21Å; C519-Y523 PolarHBondContact O-N 2.87Å; K520-Y523 PolarHBondContact O-N 3.08Å; L521-Y523 PolarHBondContact O-N 2.93Å; Y523-L526 HydrophobicContact CD1-CD2 4.02Å; Y523-L526 HydrophobicContact CE1-CD2 3.87Å; Y523-R527 WeakPolarHBondContact O-CB 3.45Å; Y523-R527 WeakPolarHBondContact O-CD 3.13Å; Y523-R527 VanDerWaalsContact O-CG 3.22Å; Y523-R527 WeakPolarHBondContact O-CG 3.15Å; Y523-R527 PolarHBondContact O-N 3Å; Y523-R527 VanDerWaalsContact O-N 3.16Å; Y523-G535 PolarHBondContact OH-O 2.96Å; Y523-F539 HydrophobicContact CD1-CD2 4.4Å; Y523-F539 AromaticContact CD2-CD2 3.58Å; Y523-F539 HydrophobicContact CD2-CD2 3.58Å; Y523-F539 AromaticContact CD2-CE2 3.52Å; Y523-F539 HydrophobicContact CD2-CE2 3.52Å; Y523-F539 HydrophobicContact CD2-CG 4.3Å; Y523-F539 HydrophobicContact CD2-CZ 4.21Å; Y523-F539 HydrophobicContact CE1-CB 4.17Å; Y523-F539 HydrophobicContact CE1-CD2 4.16Å; Y523-F539 HydrophobicContact CE1-CG 4.35Å; Y523-F539 HydrophobicContact CE2-CB 4.17Å; Y523-F539 AromaticContact CE2-CD1 3.97Å; Y523-F539 HydrophobicContact CE2-CD1 3.97Å; Y523-F539 AromaticContact CE2-CD2 3.29Å; Y523-F539 HydrophobicContact CE2-CD2 3.29Å; Y523-F539 HydrophobicContact CE2-CE1 4.17Å; Y523-F539 AromaticContact CE2-CE2 3.52Å; Y523-F539 HydrophobicContact CE2-CE2 3.52Å; Y523-F539 AromaticContact CE2-CG 3.54Å; Y523-F539 HydrophobicContact CE2-CG 3.54Å; Y523-F539 AromaticContact CE2-CZ 3.97Å; Y523-F539 HydrophobicContact CE2-CZ 3.97Å; Y523-F539 HydrophobicContact CG-CD2 4.13Å; Y523-F539 HydrophobicContact CG-CE2 4.32Å; Y523-F539 AromaticContact CZ-CD2 3.6Å; Y523-F539 AromaticContact CZ-CG 3.55Å; Y523-F539 VanDerWaalsContact OH-CB 3.29Å; Y523-F539 WeakPolarHBondContact OH-CB 3.4Å; Y523-F539 WeakPolarHBondContact OH-CG 3.45Å; Y523-Y578 HydrophobicContact CD2-CE1 4.18Å; Y523-Y578 AromaticContact CE2-CE1 3.93Å; Y523-Y578 HydrophobicContact CE2-CE1 3.93Å
524	M	86.6	Confident	82.7	Confident	105 Å²	105	48.4 Å²	48.4	52%	0.517	24%	0.244	S	C	.	.	H	α-helix	trans	-68.7	-49.2	171.8	-72	174.2	58.5	0	0	110.8	K520 L521 L522 L526 R527 T528	K520-M524 WeakPolarHBondContact O-CG 3.33Å; K520-M524 PolarHBondContact O-N 2.83Å; L521-M524 WeakPolarHBondContact O-CB 3.29Å; L521-M524 PolarHBondContact O-N 3.13Å; L521-M524 VanDerWaalsContact O-N 3.17Å; L522-M524 VanDerWaalsContact C-N 3.31Å; L522-M524 PolarHBondContact O-N 3.12Å; M524-L526 PolarHBondContact O-N 3.05Å; M524-R527 PolarHBondContact O-N 2.78Å; M524-T528 PolarHBondContact O-N 3.27Å; M524-T528 PolarHBondContact O-OG1 3.38Å; M524-T528 VanDerWaalsContact O-OG1 3.13Å
525	A	87.6	Confident	81.4	Confident	3 Å²	3	45.4 Å²	45.4	3%	0.025	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-41	176.5	0	0	0	0	0	112.6	P487 E491 L521 L522 R527 T528 Q529	P487-A525 HydrophobicContact CB-CB 3.86Å; P487-A525 HydrophobicContact CG-CB 3.94Å; E491-A525 WeakPolarHBondContact OE1-CB 3.28Å; L521-A525 PolarHBondContact O-N 3.15Å; L522-A525 PolarHBondContact O-N 3.46Å; A525-R527 PolarHBondContact O-N 3.22Å; A525-T528 WeakPolarHBondContact O-CB 3.42Å; A525-T528 PolarHBondContact O-N 3.37Å; A525-Q529 PolarHBondContact O-N 2.93Å
526	L	85.6	Confident	80	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-44.1	176.9	179.6	60.2	0	0	0	111.9	L484 L522 Y523 M524 T528 Q529 E530 A534 E538 F539 L542	L484-L526 HydrophobicContact CD1-CD1 4.34Å; L484-L526 HydrophobicContact CD2-CD1 4.02Å; L522-L526 VanDerWaalsContact O-CB 3.25Å; L522-L526 WeakPolarHBondContact O-CB 3.1Å; L522-L526 PolarHBondContact O-N 3.44Å; Y523-L526 HydrophobicContact CD1-CD2 4.02Å; Y523-L526 HydrophobicContact CE1-CD2 3.87Å; M524-L526 PolarHBondContact O-N 3.05Å; L526-T528 PolarHBondContact O-N 2.88Å; L526-Q529 PolarHBondContact O-N 3.44Å; L526-E530 HydrophobicContact CD1-CB 4.4Å; L526-E530 HydrophobicContact CD1-CG 3.96Å; L526-E530 PolarHBondContact O-N 3.28Å; L526-A534 HydrophobicContact CD1-CB 4.4Å; L526-A534 HydrophobicContact CD2-CB 3.87Å; L526-A534 HydrophobicContact CG-CB 3.7Å; L526-E538 HydrophobicContact CD1-CB 4.04Å; L526-E538 HydrophobicContact CD2-CB 4.37Å; L526-F539 HydrophobicContact CD2-CB 3.98Å; L526-F539 HydrophobicContact CD2-CD2 4.42Å; L526-L542 HydrophobicContact CB-CD2 3.68Å; L526-L542 HydrophobicContact CD1-CD2 3.98Å; L526-L542 HydrophobicContact CD2-CD2 4.46Å; L526-L542 HydrophobicContact CG-CD2 4.23Å
527	R	83.3	Confident	79	Confident	38 Å²	38	50.8 Å²	50.8	14%	0.143	27%	0.265	C	S	.	.	H	α-helix	trans	-66.6	-25.3	177.8	-76.7	170.2	152.7	-126.3	-20.2	113.3	S210 Y523 M524 A525 Q529 G531 E532	S210-R527 PolarHBondContact OG-NH2 3.12Å; S210-R527 VanDerWaalsContact OG-NH2 3.1Å; Y523-R527 WeakPolarHBondContact O-CB 3.45Å; Y523-R527 WeakPolarHBondContact O-CD 3.13Å; Y523-R527 VanDerWaalsContact O-CG 3.22Å; Y523-R527 WeakPolarHBondContact O-CG 3.15Å; Y523-R527 PolarHBondContact O-N 3Å; Y523-R527 VanDerWaalsContact O-N 3.16Å; M524-R527 PolarHBondContact O-N 2.78Å; A525-R527 PolarHBondContact O-N 3.22Å; R527-Q529 VanDerWaalsContact C-N 3.26Å; R527-G531 WeakPolarHBondContact CA-O 3.43Å; R527-G531 WeakPolarHBondContact CG-O 3.36Å; R527-G531 VanDerWaalsContact O-CA 3.27Å; R527-G531 WeakPolarHBondContact O-CA 3.48Å; R527-G531 PolarHBondContact O-N 2.84Å; R527-G531 VanDerWaalsContact O-N 3.12Å; R527-E532 IonicContact CZ-OE1 2.67Å; R527-E532 IonicContact CZ-OE2 2.74Å; R527-E532 IonicContact NE-OE1 2.65Å; R527-E532 IonicContact NH1-OE1 3.09Å; R527-E532 PolarHBondContact NH1-OE1 2.91Å; R527-E532 IonicContact NH1-OE2 3.97Å; R527-E532 PolarHBondContact NH1-OE2 2.97Å; R527-E532 PolarHBondContact NH2-O 3.13Å; R527-E532 VanDerWaalsContact NH2-O 3.12Å; R527-E532 IonicContact NH2-OE1 3.37Å; R527-E532 IonicContact NH2-OE2 2.69Å; R527-E532 PolarHBondContact NH2-OE2 3.13Å
528	T	84.9	Confident	78.5	Confident	119 Å²	119	48.8 Å²	48.8	73%	0.73	26%	0.256	S	S	*	.	H	α-helix	trans	-72.3	-19.1	171.2	-52.8	0	0	0	0	112.7	M524 A525 L526	M524-T528 PolarHBondContact O-N 3.27Å; M524-T528 PolarHBondContact O-OG1 3.38Å; M524-T528 VanDerWaalsContact O-OG1 3.13Å; A525-T528 WeakPolarHBondContact O-CB 3.42Å; A525-T528 PolarHBondContact O-N 3.37Å; L526-T528 PolarHBondContact O-N 2.88Å
529	Q	79.3	Confident	78.1	Confident	66 Å²	66	48.8 Å²	48.8	31%	0.308	26%	0.255	S	S	.	.	H	α-helix	trans	-98.3	-52.1	176.4	-61.2	-177.2	35.2	0	0	112.6	S485 A525 L526 R527	S485-Q529 PolarHBondContact O-NE2 3.21Å; S485-Q529 PolarHBondContact O-OE1 3.36Å; A525-Q529 PolarHBondContact O-N 2.93Å; L526-Q529 PolarHBondContact O-N 3.44Å; R527-Q529 VanDerWaalsContact C-N 3.26Å
530	E	74.3	Confident	77.9	Confident	91 Å²	91	49.7 Å²	49.7	43%	0.425	26%	0.26	S	S	.	.	H	α-helix	trans	-104.9	1.5	-169.6	-64.1	-65.4	137.1	0	0	113.9	L484 L526 A534	L484-E530 HydrophobicContact CD2-CG 3.43Å; L484-E530 VanDerWaalsContact CD2-CG 3.43Å; L484-E530 WeakPolarHBondContact CD2-OE1 3.36Å; L526-E530 HydrophobicContact CD1-CB 4.4Å; L526-E530 HydrophobicContact CD1-CG 3.96Å; L526-E530 PolarHBondContact O-N 3.28Å; E530-A534 HydrophobicContact CB-CB 3.92Å
531	G	69.3	Low	77.8	Confident	33 Å²	33	44 Å²	44	34%	0.34	24%	0.237	S	C	.	.			trans	76.4	-168.8	-177.4	0	0	0	0	0	114.6	R527 D533	R527-G531 WeakPolarHBondContact CA-O 3.43Å; R527-G531 WeakPolarHBondContact CG-O 3.36Å; R527-G531 VanDerWaalsContact O-CA 3.27Å; R527-G531 WeakPolarHBondContact O-CA 3.48Å; R527-G531 PolarHBondContact O-N 2.84Å; R527-G531 VanDerWaalsContact O-N 3.12Å; G531-D533 VanDerWaalsContact C-N 3.33Å; G531-D533 PolarHBondContact O-N 2.92Å
532	E	63.2	Low	77.8	Confident	119 Å²	119	42.2 Å²	42.2	56%	0.556	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-28.8	-174	-77	-69.5	111.9	0	0	113.9	R527 A534	R527-E532 IonicContact CZ-OE1 2.67Å; R527-E532 IonicContact CZ-OE2 2.74Å; R527-E532 IonicContact NE-OE1 2.65Å; R527-E532 IonicContact NH1-OE1 3.09Å; R527-E532 PolarHBondContact NH1-OE1 2.91Å; R527-E532 IonicContact NH1-OE2 3.97Å; R527-E532 PolarHBondContact NH1-OE2 2.97Å; R527-E532 PolarHBondContact NH2-O 3.13Å; R527-E532 VanDerWaalsContact NH2-O 3.12Å; R527-E532 IonicContact NH2-OE1 3.37Å; R527-E532 IonicContact NH2-OE2 2.69Å; R527-E532 PolarHBondContact NH2-OE2 3.13Å; E532-A534 PolarHBondContact O-N 3.28Å; E532-A534 VanDerWaalsContact O-N 3.13Å
533	D	57.2	Low	77.9	Confident	114 Å²	114	42.4 Å²	42.4	61%	0.61	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	7.7	-178.1	-66.3	-31.4	0	0	0	113.9	K207 G531 G535	K207-D533 VanDerWaalsContact CE-O 3.23Å; K207-D533 WeakPolarHBondContact CE-O 3.36Å; K207-D533 PolarHBondContact NZ-O 3.34Å; G531-D533 VanDerWaalsContact C-N 3.33Å; G531-D533 PolarHBondContact O-N 2.92Å; D533-G535 PolarHBondContact O-N 3.21Å
534	A	63.6	Low	78.2	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.228	C	C	.	.			trans	-72.1	124.2	-174.2	0	0	0	0	0	112.6	S210 L526 E530 E532	S210-A534 WeakPolarHBondContact CA-O 3.32Å; S210-A534 VanDerWaalsContact CB-O 3.24Å; S210-A534 WeakPolarHBondContact CB-O 3.14Å; L526-A534 HydrophobicContact CD1-CB 4.4Å; L526-A534 HydrophobicContact CD2-CB 3.87Å; L526-A534 HydrophobicContact CG-CB 3.7Å; E530-A534 HydrophobicContact CB-CB 3.92Å; E532-A534 PolarHBondContact O-N 3.28Å; E532-A534 VanDerWaalsContact O-N 3.13Å
535	G	67.4	Low	78.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.203	C	C	.	.			trans	-103.9	-155.8	-162.8	0	0	0	0	0	115.8	A208 Y523 D533 E538 F539	A208-G535 WeakPolarHBondContact O-CA 3.33Å; Y523-G535 PolarHBondContact OH-O 2.96Å; D533-G535 PolarHBondContact O-N 3.21Å; G535-E538 WeakPolarHBondContact CA-OE2 3.32Å; G535-E538 PolarHBondContact N-OE2 3.37Å; G535-F539 WeakPolarHBondContact O-CB 3.43Å; G535-F539 PolarHBondContact O-N 2.97Å
536	A	64.6	Low	78.8	Confident	25 Å²	25	37.1 Å²	37.1	21%	0.207	20%	0.202	C	C	.	.	H	α-helix	trans	-83.3	-28.9	169.9	0	0	0	0	0	112.1	A208 E538 F539 L540 Y577	A208-A536 HydrophobicContact CB-CB 3.44Å; A208-A536 VanDerWaalsContact CB-CB 3.44Å; A536-E538 VanDerWaalsContact C-N 3.33Å; A536-F539 PolarHBondContact O-N 2.82Å; A536-L540 PolarHBondContact O-N 2.76Å; A536-Y577 VanDerWaalsContact CB-OH 3.26Å; A536-Y577 WeakPolarHBondContact CB-OH 3.37Å
537	D	67.3	Low	79.3	Confident	100 Å²	100	37.3 Å²	37.3	54%	0.535	20%	0.203	S	C	.	.	H	α-helix	trans	-66.9	-35.2	-178.6	-58.7	-72.9	0	0	0	111.3	A208 P541	A208-D537 WeakPolarHBondContact CB-OD2 3.45Å; A208-D537 PolarHBondContact N-OD2 3.15Å; D537-P541 WeakPolarHBondContact O-CD 3.39Å; D537-P541 WeakPolarHBondContact O-CG 3.4Å
538	E	80	Confident	79.8	Confident	33 Å²	33	35.5 Å²	35.5	15%	0.154	20%	0.196	C	C	.	.	H	α-helix	trans	-84.6	-36	172.1	-54.4	83.9	172.5	0	0	112.2	K207 L484 L526 G535 A536 P541 L542	K207-E538 WeakPolarHBondContact CE-OE1 3.42Å; K207-E538 IonicContact NZ-OE1 2.71Å; K207-E538 PolarHBondContact NZ-OE1 3.2Å; L484-E538 HydrophobicContact CD1-CB 4Å; L484-E538 WeakPolarHBondContact CD1-O 3.44Å; L484-E538 HydrophobicContact CD2-CB 4.46Å; L526-E538 HydrophobicContact CD1-CB 4.04Å; L526-E538 HydrophobicContact CD2-CB 4.37Å; G535-E538 WeakPolarHBondContact CA-OE2 3.32Å; G535-E538 PolarHBondContact N-OE2 3.37Å; A536-E538 VanDerWaalsContact C-N 3.33Å; E538-P541 WeakPolarHBondContact O-CD 3.41Å; E538-L542 PolarHBondContact O-N 3.25Å
539	F	84.7	Confident	80.2	Confident	1 Å²	1	32.5 Å²	32.5	0%	0.004	17%	0.174	C	C	.	.	H	α-helix	trans	-67.3	-37.3	-177.7	176.9	-101.2	0	0	0	113.9	C519 L522 Y523 L526 G535 A536 L542 L543 Y578	C519-F539 HydrophobicContact CB-CE2 4.46Å; C519-F539 HydrophobicContact CB-CZ 3.91Å; L522-F539 HydrophobicContact CB-CE2 3.9Å; Y523-F539 HydrophobicContact CD1-CD2 4.4Å; Y523-F539 AromaticContact CD2-CD2 3.58Å; Y523-F539 HydrophobicContact CD2-CD2 3.58Å; Y523-F539 AromaticContact CD2-CE2 3.52Å; Y523-F539 HydrophobicContact CD2-CE2 3.52Å; Y523-F539 HydrophobicContact CD2-CG 4.3Å; Y523-F539 HydrophobicContact CD2-CZ 4.21Å; Y523-F539 HydrophobicContact CE1-CB 4.17Å; Y523-F539 HydrophobicContact CE1-CD2 4.16Å; Y523-F539 HydrophobicContact CE1-CG 4.35Å; Y523-F539 HydrophobicContact CE2-CB 4.17Å; Y523-F539 AromaticContact CE2-CD1 3.97Å; Y523-F539 HydrophobicContact CE2-CD1 3.97Å; Y523-F539 AromaticContact CE2-CD2 3.29Å; Y523-F539 HydrophobicContact CE2-CD2 3.29Å; Y523-F539 HydrophobicContact CE2-CE1 4.17Å; Y523-F539 AromaticContact CE2-CE2 3.52Å; Y523-F539 HydrophobicContact CE2-CE2 3.52Å; Y523-F539 AromaticContact CE2-CG 3.54Å; Y523-F539 HydrophobicContact CE2-CG 3.54Å; Y523-F539 AromaticContact CE2-CZ 3.97Å; Y523-F539 HydrophobicContact CE2-CZ 3.97Å; Y523-F539 HydrophobicContact CG-CD2 4.13Å; Y523-F539 HydrophobicContact CG-CE2 4.32Å; Y523-F539 AromaticContact CZ-CD2 3.6Å; Y523-F539 AromaticContact CZ-CG 3.55Å; Y523-F539 VanDerWaalsContact OH-CB 3.29Å; Y523-F539 WeakPolarHBondContact OH-CB 3.4Å; Y523-F539 WeakPolarHBondContact OH-CG 3.45Å; L526-F539 HydrophobicContact CD2-CB 3.98Å; L526-F539 HydrophobicContact CD2-CD2 4.42Å; G535-F539 WeakPolarHBondContact O-CB 3.43Å; G535-F539 PolarHBondContact O-N 2.97Å; A536-F539 PolarHBondContact O-N 2.82Å; F539-L542 PolarHBondContact O-N 3.38Å; F539-L543 HydrophobicContact CE1-CB 4.43Å; F539-L543 HydrophobicContact CE1-CD2 3.9Å; F539-L543 HydrophobicContact CZ-CB 4.47Å; F539-L543 HydrophobicContact CZ-CD2 4.19Å; F539-L543 VanDerWaalsContact O-CB 3.31Å; F539-L543 WeakPolarHBondContact O-CB 3.27Å; F539-L543 PolarHBondContact O-N 2.9Å; F539-Y578 HydrophobicContact CE1-CD1 4.03Å; F539-Y578 AromaticContact CE1-CE1 3.99Å; F539-Y578 HydrophobicContact CE1-CE1 3.99Å; F539-Y578 HydrophobicContact CZ-CD1 4Å; F539-Y578 AromaticContact CZ-CE1 3.81Å; F539-Y578 HydrophobicContact CZ-CE1 3.81Å
540	L	84.5	Confident	80.9	Confident	19 Å²	19	29.4 Å²	29.4	10%	0.099	16%	0.16	C	C	.	.	H	α-helix	trans	-70.2	-42.6	-176.4	-167.8	72.7	0	0	0	113.5	A536 S544 S581 A584 S585 L588 L606	A536-L540 PolarHBondContact O-N 2.76Å; L540-S544 WeakPolarHBondContact O-CB 3.34Å; L540-S544 PolarHBondContact O-N 3.23Å; L540-S544 PolarHBondContact O-OG 2.68Å; L540-S581 WeakPolarHBondContact CD1-O 3.4Å; L540-A584 HydrophobicContact CD1-CB 4.24Å; L540-S585 WeakPolarHBondContact CD1-OG 3.33Å; L540-L588 HydrophobicContact CD2-CD1 3.84Å; L540-L588 HydrophobicContact CG-CD1 4.08Å; L540-L606 HydrophobicContact CD2-CB 4.36Å; L540-L606 HydrophobicContact CD2-CD1 4.25Å; L540-L606 HydrophobicContact CD2-CD2 3.99Å; L540-L606 HydrophobicContact CD2-CG 4.43Å
541	P	85.4	Confident	81.9	Confident	15 Å²	15	28 Å²	28	10%	0.097	16%	0.155	C	C	.	.	H	α-helix	trans	-59.2	-44.9	168.4	-26	35.8	0	0	0	112.7	F480 D537 E538 L543 S544 L545	F480-P541 HydrophobicContact CB-CB 3.99Å; D537-P541 WeakPolarHBondContact O-CD 3.39Å; D537-P541 WeakPolarHBondContact O-CG 3.4Å; E538-P541 WeakPolarHBondContact O-CD 3.41Å; P541-L543 PolarHBondContact O-N 2.85Å; P541-S544 PolarHBondContact O-N 3.39Å; P541-L545 WeakPolarHBondContact O-CB 3.19Å; P541-L545 PolarHBondContact O-N 2.99Å
542	L	89.8	Confident	83.1	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.1	-47.8	177.7	178.4	64.5	0	0	0	111.9	L484 P487 L526 E538 F539 S544 L545 V546	L484-L542 HydrophobicContact CD1-CB 4.1Å; P487-L542 HydrophobicContact CG-CD1 4.21Å; L526-L542 HydrophobicContact CB-CD2 3.68Å; L526-L542 HydrophobicContact CD1-CD2 3.98Å; L526-L542 HydrophobicContact CD2-CD2 4.46Å; L526-L542 HydrophobicContact CG-CD2 4.23Å; E538-L542 PolarHBondContact O-N 3.25Å; F539-L542 PolarHBondContact O-N 3.38Å; L542-S544 VanDerWaalsContact C-N 3.31Å; L542-S544 PolarHBondContact O-N 3.15Å; L542-L545 PolarHBondContact O-N 3.49Å; L542-V546 HydrophobicContact CD1-CG2 4.08Å; L542-V546 WeakPolarHBondContact O-CG2 3.17Å; L542-V546 PolarHBondContact O-N 2.94Å
543	L	92.1	Very high	84.5	Confident	6 Å²	6	23 Å²	23	3%	0.031	13%	0.125	C	C	.	.	H	α-helix	trans	-59.4	-43.2	177.2	177.8	60.8	0	0	0	111	L522 F539 P541 V546 L547 S585	L522-L543 HydrophobicContact CD1-CD1 3.55Å; F539-L543 HydrophobicContact CE1-CB 4.43Å; F539-L543 HydrophobicContact CE1-CD2 3.9Å; F539-L543 HydrophobicContact CZ-CB 4.47Å; F539-L543 HydrophobicContact CZ-CD2 4.19Å; F539-L543 VanDerWaalsContact O-CB 3.31Å; F539-L543 WeakPolarHBondContact O-CB 3.27Å; F539-L543 PolarHBondContact O-N 2.9Å; P541-L543 PolarHBondContact O-N 2.85Å; L543-V546 PolarHBondContact O-N 2.95Å; L543-L547 HydrophobicContact CD1-CD1 3.98Å; L543-L547 HydrophobicContact CD1-CG 4.15Å; L543-L547 HydrophobicContact CG-CD1 3.92Å; L543-L547 WeakPolarHBondContact O-CB 3.21Å; L543-L547 WeakPolarHBondContact O-CD1 3.19Å; L543-L547 WeakPolarHBondContact O-CG 3.03Å; L543-L547 PolarHBondContact O-N 2.81Å; L543-S585 WeakPolarHBondContact CG-OG 3.22Å
544	S	90.9	Very high	86.3	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.5	-43.3	177.9	-50.5	0	0	0	0	111.9	L540 P541 L542 L547 A548 S585	L540-S544 WeakPolarHBondContact O-CB 3.34Å; L540-S544 PolarHBondContact O-N 3.23Å; L540-S544 PolarHBondContact O-OG 2.68Å; P541-S544 PolarHBondContact O-N 3.39Å; L542-S544 VanDerWaalsContact C-N 3.31Å; L542-S544 PolarHBondContact O-N 3.15Å; S544-L547 PolarHBondContact O-N 2.8Å; S544-A548 PolarHBondContact O-N 2.91Å; S544-A548 VanDerWaalsContact O-N 3.11Å; S544-S585 WeakPolarHBondContact OG-CA 3.32Å; S544-S585 VanDerWaalsContact OG-CB 3.3Å; S544-S585 WeakPolarHBondContact OG-CB 3.21Å; S544-S585 PolarHBondContact OG-OG 2.89Å
545	L	92.2	Very high	87.7	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-67	-40.9	177.6	-174.1	65.1	0	0	0	112.4	P477 F480 L486 P541 L542 A548 H549	P477-L545 HydrophobicContact CB-CD2 4.31Å; P477-L545 HydrophobicContact CG-CD2 3.88Å; F480-L545 HydrophobicContact CD2-CB 4.32Å; F480-L545 HydrophobicContact CE2-CB 4.12Å; F480-L545 HydrophobicContact CE2-CD1 4.38Å; L486-L545 HydrophobicContact CD2-CD2 4.05Å; L486-L545 HydrophobicContact CD2-CG 3.91Å; L486-L545 HydrophobicContact CG-CD2 4.03Å; L486-L545 HydrophobicContact CG-CG 4.35Å; P541-L545 WeakPolarHBondContact O-CB 3.19Å; P541-L545 PolarHBondContact O-N 2.99Å; L542-L545 PolarHBondContact O-N 3.49Å; L545-A548 WeakPolarHBondContact O-CB 3.26Å; L545-A548 PolarHBondContact O-N 3.02Å; L545-H549 PolarHBondContact O-N 2.65Å; L545-H549 PolarHBondContact O-ND1 2.71Å
546	V	95.1	Very high	88.9	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-70.4	-36.5	177.2	173.2	0	0	0	0	111.8	L486 P487 M492 V495 L522 L542 L543 A548 H549 C550	L486-V546 HydrophobicContact CD2-CG2 4.34Å; P487-V546 HydrophobicContact CG-CG2 4.04Å; M492-V546 HydrophobicContact CE-CB 4.28Å; M492-V546 HydrophobicContact CE-CG1 3.79Å; M492-V546 HydrophobicContact CE-CG2 4.17Å; M492-V546 HydrophobicContact SD-CB 4.2Å; M492-V546 HydrophobicContact SD-CG1 3.7Å; M492-V546 HydrophobicContact SD-CG2 3.62Å; V495-V546 HydrophobicContact CG1-CG1 3.86Å; L522-V546 HydrophobicContact CD2-CB 4.04Å; L522-V546 HydrophobicContact CD2-CG1 3.99Å; L522-V546 HydrophobicContact CD2-CG2 3.74Å; L542-V546 HydrophobicContact CD1-CG2 4.08Å; L542-V546 WeakPolarHBondContact O-CG2 3.17Å; L542-V546 PolarHBondContact O-N 2.94Å; L543-V546 PolarHBondContact O-N 2.95Å; V546-A548 VanDerWaalsContact C-N 3.32Å; V546-A548 PolarHBondContact O-N 3.27Å; V546-H549 PolarHBondContact O-N 2.74Å; V546-C550 WeakPolarHBondContact O-CB 3.46Å; V546-C550 PolarHBondContact O-N 3.43Å; V546-C550 PolarHBondContact O-SG 3.1Å
547	L	95.3	Very high	90.2	Very high	3 Å²	3	20.6 Å²	20.6	2%	0.016	11%	0.107	C	C	.	.	H	α-helix	trans	-61.6	-39.4	173.1	-73.6	167.9	0	0	0	111.8	L499 L543 S544 H549 C550 D551 L555 L582 L586 L589	L499-L547 HydrophobicContact CD1-CD2 3.94Å; L543-L547 HydrophobicContact CD1-CD1 3.98Å; L543-L547 HydrophobicContact CD1-CG 4.15Å; L543-L547 HydrophobicContact CG-CD1 3.92Å; L543-L547 WeakPolarHBondContact O-CB 3.21Å; L543-L547 WeakPolarHBondContact O-CD1 3.19Å; L543-L547 WeakPolarHBondContact O-CG 3.03Å; L543-L547 PolarHBondContact O-N 2.81Å; S544-L547 PolarHBondContact O-N 2.8Å; L547-H549 VanDerWaalsContact C-N 3.31Å; L547-H549 PolarHBondContact O-N 2.69Å; L547-C550 PolarHBondContact O-N 3.12Å; L547-D551 PolarHBondContact O-N 2.67Å; L547-L555 HydrophobicContact CD2-CD1 3.47Å; L547-L555 VanDerWaalsContact CD2-CD1 3.47Å; L547-L582 HydrophobicContact CD1-CD1 3.82Å; L547-L582 HydrophobicContact CD2-CD1 4.08Å; L547-L586 HydrophobicContact CD1-CD2 4.49Å; L547-L589 HydrophobicContact CB-CD1 3.96Å
548	A	94.6	Very high	91.4	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-57.4	-41.6	172.9	0	0	0	0	0	113.1	L469 A472 R473 S544 L545 V546 D551 L589	L469-A548 HydrophobicContact CD2-CB 4.47Å; A472-A548 HydrophobicContact CB-CB 3.52Å; R473-A548 WeakPolarHBondContact CD-O 3.37Å; R473-A548 HydrophobicContact CG-CB 4.19Å; R473-A548 WeakPolarHBondContact CG-O 3.36Å; R473-A548 PolarHBondContact NE-O 3.39Å; S544-A548 PolarHBondContact O-N 2.91Å; S544-A548 VanDerWaalsContact O-N 3.11Å; L545-A548 WeakPolarHBondContact O-CB 3.26Å; L545-A548 PolarHBondContact O-N 3.02Å; V546-A548 VanDerWaalsContact C-N 3.32Å; V546-A548 PolarHBondContact O-N 3.27Å; A548-D551 PolarHBondContact O-N 2.69Å; A548-L589 HydrophobicContact CB-CD2 4.01Å
549	H	93.6	Very high	92	Very high	57 Å²	57	14.8 Å²	14.8	26%	0.264	8%	0.078	S	C	.	.	H	α-helix	trans	-81.5	-24.5	179.5	-69.6	78	0	0	0	113.2	M492 R496 L545 V546 L547 D551	M492-H549 HydrophobicContact CE-CB 3.48Å; M492-H549 VanDerWaalsContact CE-CB 3.48Å; R496-H549 PolarHBondContact NH1-O 2.92Å; L545-H549 PolarHBondContact O-N 2.65Å; L545-H549 PolarHBondContact O-ND1 2.71Å; V546-H549 PolarHBondContact O-N 2.74Å; L547-H549 VanDerWaalsContact C-N 3.31Å; L547-H549 PolarHBondContact O-N 2.69Å; H549-D551 VanDerWaalsContact C-N 3.33Å
550	C	94.9	Very high	92	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.007	8%	0.083	C	C	.	.	H	α-helix	trans	-68.1	-33.6	168.1	-69.9	0	0	0	0	111.6	R496 L499 V546 L547 L552	R496-C550 PolarHBondContact NH1-O 3.11Å; R496-C550 PolarHBondContact NH2-O 3.22Å; L499-C550 HydrophobicContact CD1-CB 4.27Å; V546-C550 WeakPolarHBondContact O-CB 3.46Å; V546-C550 PolarHBondContact O-N 3.43Å; V546-C550 PolarHBondContact O-SG 3.1Å; L547-C550 PolarHBondContact O-N 3.12Å; C550-L552 HydrophobicContact CB-CD1 4.29Å; C550-L552 HydrophobicContact CB-CG 4.24Å; C550-L552 WeakPolarHBondContact O-CG 3.32Å
551	D	94.5	Very high	92.3	Very high	61 Å²	61	15 Å²	15	33%	0.326	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	54.7	176	-159.3	23.2	0	0	0	112.9	R473 L547 A548 H549 P553	R473-D551 VanDerWaalsContact CZ-CG 3.4Å; R473-D551 IonicContact CZ-OD1 2.99Å; R473-D551 IonicContact CZ-OD2 2.7Å; R473-D551 VanDerWaalsContact CZ-OD2 3.25Å; R473-D551 IonicContact NH1-OD1 2.69Å; R473-D551 IonicContact NH1-OD2 3.78Å; R473-D551 PolarHBondContact NH1-OD2 2.94Å; R473-D551 IonicContact NH2-OD1 3.32Å; R473-D551 PolarHBondContact NH2-OD1 2.7Å; R473-D551 IonicContact NH2-OD2 2.85Å; R473-D551 PolarHBondContact NH2-OD2 2.78Å; L547-D551 PolarHBondContact O-N 2.67Å; A548-D551 PolarHBondContact O-N 2.69Å; H549-D551 VanDerWaalsContact C-N 3.33Å; D551-P553 WeakPolarHBondContact O-CD 3.3Å
552	L	95.1	Very high	92.5	Very high	16 Å²	16	14.3 Å²	14.3	8%	0.084	7%	0.074	C	C	.	.			trans	-121.6	75.8	-176.7	-61.7	178.5	0	0	0	110.4	L499 L500 L503 C550 E554 L555	L499-L552 HydrophobicContact CB-CD1 3.73Å; L500-L552 HydrophobicContact CD2-CD1 4.23Å; L500-L552 HydrophobicContact CD2-CD2 3.85Å; L500-L552 HydrophobicContact CG-CD1 4.36Å; L503-L552 HydrophobicContact CD1-CD1 4.49Å; L503-L552 HydrophobicContact CD1-CD2 4.37Å; C550-L552 HydrophobicContact CB-CD1 4.29Å; C550-L552 HydrophobicContact CB-CG 4.24Å; C550-L552 WeakPolarHBondContact O-CG 3.32Å; L552-E554 PolarHBondContact O-N 2.91Å; L552-L555 HydrophobicContact CB-CD1 3.76Å; L552-L555 HydrophobicContact CB-CG 3.93Å; L552-L555 HydrophobicContact CD1-CD1 4.23Å; L552-L555 WeakPolarHBondContact O-CB 3.41Å; L552-L555 WeakPolarHBondContact O-CG 3.35Å; L552-L555 PolarHBondContact O-N 3Å
553	P	92.4	Very high	92	Very high	30 Å²	30	14.7 Å²	14.7	20%	0.195	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.4	-178.7	25.3	-33.7	0	0	0	113.2	L465 L469 D551 L555 L556	L465-P553 HydrophobicContact CD2-CB 4.32Å; L469-P553 HydrophobicContact CD1-CB 4.1Å; D551-P553 WeakPolarHBondContact O-CD 3.3Å; P553-L555 PolarHBondContact O-N 2.84Å; P553-L555 VanDerWaalsContact O-N 3.1Å; P553-L556 WeakPolarHBondContact O-CB 3.3Å; P553-L556 PolarHBondContact O-N 3.2Å; P553-L556 VanDerWaalsContact O-N 3.13Å
554	E	93.3	Very high	91.6	Very high	55 Å²	55	15.7 Å²	15.7	26%	0.257	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-23.3	170.1	-75.6	63.6	-144.9	0	0	113.7	R453 L503 L552 L556 L557 E558	R453-E554 IonicContact CZ-OE1 2.73Å; R453-E554 IonicContact NH1-OE1 2.82Å; R453-E554 PolarHBondContact NH1-OE1 2.97Å; R453-E554 IonicContact NH2-OE1 3.74Å; R453-E554 PolarHBondContact NH2-OE1 3.1Å; L503-E554 HydrophobicContact CD1-CB 3.99Å; L503-E554 HydrophobicContact CD2-CB 3.8Å; L552-E554 PolarHBondContact O-N 2.91Å; E554-L556 PolarHBondContact O-N 3.47Å; E554-L557 WeakPolarHBondContact O-CB 3.19Å; E554-L557 PolarHBondContact O-N 3.12Å; E554-E558 PolarHBondContact O-N 2.82Å; E554-E558 VanDerWaalsContact O-N 3.13Å
555	L	94.9	Very high	91.3	Very high	2 Å²	2	16 Å²	16	1%	0.01	8%	0.082	C	C	.	.	H	α-helix	trans	-62.7	-21.4	177	-70.6	171.6	0	0	0	113.3	L499 L502 L503 L547 L552 P553 E558 A559 L586	L499-L555 HydrophobicContact CB-CD1 4.38Å; L499-L555 HydrophobicContact CB-CD2 4.46Å; L499-L555 HydrophobicContact CD1-CD1 4.1Å; L499-L555 HydrophobicContact CD2-CD1 4.16Å; L499-L555 HydrophobicContact CD2-CD2 4.18Å; L499-L555 HydrophobicContact CG-CD1 4.45Å; L502-L555 HydrophobicContact CD2-CD2 4.34Å; L503-L555 HydrophobicContact CD2-CD2 3.67Å; L503-L555 HydrophobicContact CD2-CG 4.1Å; L503-L555 HydrophobicContact CG-CD2 4.45Å; L547-L555 HydrophobicContact CD2-CD1 3.47Å; L547-L555 VanDerWaalsContact CD2-CD1 3.47Å; L552-L555 HydrophobicContact CB-CD1 3.76Å; L552-L555 HydrophobicContact CB-CG 3.93Å; L552-L555 HydrophobicContact CD1-CD1 4.23Å; L552-L555 WeakPolarHBondContact O-CB 3.41Å; L552-L555 WeakPolarHBondContact O-CG 3.35Å; L552-L555 PolarHBondContact O-N 3Å; P553-L555 PolarHBondContact O-N 2.84Å; P553-L555 VanDerWaalsContact O-N 3.1Å; L555-E558 PolarHBondContact O-N 2.86Å; L555-A559 VanDerWaalsContact O-CB 3.28Å; L555-A559 WeakPolarHBondContact O-CB 3.37Å; L555-A559 PolarHBondContact O-N 3.1Å; L555-L586 HydrophobicContact CB-CD1 4.26Å; L555-L586 HydrophobicContact CB-CD2 4.27Å
556	L	91.4	Very high	90.9	Very high	24 Å²	24	16.3 Å²	16.3	13%	0.126	8%	0.084	C	C	.	.	H	α-helix	trans	-65.6	-44.3	171.3	-172.6	65.5	0	0	0	111.7	L456 L462 L465 P553 E554 E558 A559 E560 L586	L456-L556 HydrophobicContact CD1-CD2 4.16Å; L456-L556 HydrophobicContact CD1-CG 4.04Å; L456-L556 HydrophobicContact CD2-CD2 4.23Å; L462-L556 HydrophobicContact CD2-CD2 4.3Å; L465-L556 HydrophobicContact CD2-CB 3.71Å; L465-L556 HydrophobicContact CD2-CD2 4.16Å; L465-L556 HydrophobicContact CD2-CG 4.4Å; P553-L556 WeakPolarHBondContact O-CB 3.3Å; P553-L556 PolarHBondContact O-N 3.2Å; P553-L556 VanDerWaalsContact O-N 3.13Å; E554-L556 PolarHBondContact O-N 3.47Å; L556-E558 VanDerWaalsContact C-N 3.35Å; L556-A559 PolarHBondContact O-N 3.4Å; L556-E560 PolarHBondContact O-N 2.88Å; L556-E560 VanDerWaalsContact O-N 3.08Å; L556-L586 HydrophobicContact CD1-CB 4.31Å
557	L	91.7	Very high	89.8	Confident	8 Å²	8	18.4 Å²	18.4	4%	0.042	9%	0.094	C	C	.	.	H	α-helix	trans	-63.7	-42.5	175.7	-175.7	152.9	0	0	0	110.8	A449 V452 R453 L456 E554 E560 Y561	A449-L557 HydrophobicContact CB-CD2 4.36Å; A449-L557 WeakPolarHBondContact O-CD1 3.46Å; V452-L557 HydrophobicContact CB-CD1 4.09Å; V452-L557 HydrophobicContact CB-CG 4Å; V452-L557 HydrophobicContact CG1-CB 4.41Å; V452-L557 HydrophobicContact CG1-CD1 4.19Å; V452-L557 HydrophobicContact CG1-CG 3.74Å; R453-L557 HydrophobicContact CB-CD1 3.72Å; L456-L557 HydrophobicContact CD1-CB 4.38Å; E554-L557 WeakPolarHBondContact O-CB 3.19Å; E554-L557 PolarHBondContact O-N 3.12Å; L557-E560 PolarHBondContact O-N 3.09Å; L557-Y561 WeakPolarHBondContact O-CB 3.41Å; L557-Y561 PolarHBondContact O-N 2.92Å
558	E	93.9	Very high	88.5	Confident	8 Å²	8	21 Å²	21	4%	0.037	11%	0.111	C	C	.	.	H	α-helix	trans	-71.8	-29.9	178.1	-54.2	-45.8	150.9	0	0	113.2	R445 L502 L503 Q511 E554 L555 L556 M562	R445-E558 IonicContact CZ-OE1 2.66Å; R445-E558 VanDerWaalsContact CZ-OE1 3.29Å; R445-E558 IonicContact CZ-OE2 2.7Å; R445-E558 VanDerWaalsContact CZ-OE2 3.31Å; R445-E558 VanDerWaalsContact NH1-CD 3.33Å; R445-E558 IonicContact NH1-OE1 3.99Å; R445-E558 PolarHBondContact NH1-OE1 2.97Å; R445-E558 IonicContact NH1-OE2 3.33Å; R445-E558 PolarHBondContact NH1-OE2 3.48Å; R445-E558 IonicContact NH2-OE1 2.87Å; R445-E558 PolarHBondContact NH2-OE1 2.92Å; R445-E558 IonicContact NH2-OE2 3.21Å; R445-E558 PolarHBondContact NH2-OE2 3.35Å; L502-E558 HydrophobicContact CD2-CB 3.59Å; L502-E558 HydrophobicContact CD2-CG 3.92Å; L503-E558 HydrophobicContact CD2-CB 4.49Å; L503-E558 HydrophobicContact CD2-CG 3.48Å; L503-E558 VanDerWaalsContact CD2-CG 3.48Å; Q511-E558 PolarHBondContact NE2-OE2 3Å; E554-E558 PolarHBondContact O-N 2.82Å; E554-E558 VanDerWaalsContact O-N 3.13Å; L555-E558 PolarHBondContact O-N 2.86Å; L556-E558 VanDerWaalsContact C-N 3.35Å; E558-M562 HydrophobicContact CB-CE 4.28Å; E558-M562 WeakPolarHBondContact O-CB 3.38Å; E558-M562 VanDerWaalsContact O-CE 3.23Å; E558-M562 WeakPolarHBondContact O-CE 3.28Å; E558-M562 VanDerWaalsContact O-CG 3.24Å; E558-M562 WeakPolarHBondContact O-CG 3.28Å; E558-M562 PolarHBondContact O-N 3.05Å
559	A	90.6	Very high	87	Confident	4 Å²	4	23.4 Å²	23.4	3%	0.033	13%	0.128	C	C	.	.	H	α-helix	trans	-63.8	-48.2	172	0	0	0	0	0	110.8	L555 L556 S563 L582 L586	L555-A559 VanDerWaalsContact O-CB 3.28Å; L555-A559 WeakPolarHBondContact O-CB 3.37Å; L555-A559 PolarHBondContact O-N 3.1Å; L556-A559 PolarHBondContact O-N 3.4Å; A559-S563 WeakPolarHBondContact O-CB 3.48Å; A559-S563 PolarHBondContact O-N 3.2Å; A559-S563 PolarHBondContact O-OG 2.87Å; A559-L582 HydrophobicContact CB-CD2 4.26Å; A559-L582 HydrophobicContact CB-CG 4.49Å; A559-L586 HydrophobicContact CB-CD1 3.95Å
560	E	86.3	Confident	85.5	Confident	24 Å²	24	23.3 Å²	23.3	11%	0.112	13%	0.129	C	C	.	.	H	α-helix	trans	-61.6	-49.8	174.2	-67.8	-162.3	150.2	0	0	111	R455 L556 L557 M562 S563 E564 R616	R455-E560 IonicContact CZ-OE2 3.7Å; R455-E560 IonicContact NE-OE2 3.9Å; R455-E560 IonicContact NH2-OE2 3.91Å; R455-E560 PolarHBondContact NH2-OE2 2.87Å; L556-E560 PolarHBondContact O-N 2.88Å; L556-E560 VanDerWaalsContact O-N 3.08Å; L557-E560 PolarHBondContact O-N 3.09Å; E560-M562 PolarHBondContact O-N 3.15Å; E560-S563 PolarHBondContact O-N 2.66Å; E560-S563 VanDerWaalsContact O-N 3.09Å; E560-S563 PolarHBondContact O-OG 3.1Å; E560-E564 PolarHBondContact O-N 3.49Å; E560-R616 IonicContact OE1-NH1 3.15Å; E560-R616 PolarHBondContact OE1-NH1 2.81Å
561	Y	89.3	Confident	84	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59.6	-48	-179.8	-178	-90.2	0	0	0	113.4	L399 L448 Y506 Q511 L557 S563 L565	L399-Y561 HydrophobicContact CD1-CD2 4.05Å; L448-Y561 HydrophobicContact CB-CE2 4.26Å; L448-Y561 HydrophobicContact CD1-CE2 4.13Å; Y506-Y561 PolarHBondContact O-OH 3.43Å; Q511-Y561 VanDerWaalsContact OE1-CD1 3.23Å; L557-Y561 WeakPolarHBondContact O-CB 3.41Å; L557-Y561 PolarHBondContact O-N 2.92Å; Y561-S563 VanDerWaalsContact C-N 3.3Å; Y561-S563 PolarHBondContact O-N 3.22Å; Y561-L565 HydrophobicContact CD1-CD1 4.05Å; Y561-L565 HydrophobicContact CD2-CD1 3.61Å; Y561-L565 HydrophobicContact CE1-CD1 3.77Å; Y561-L565 HydrophobicContact CE2-CD1 3.29Å; Y561-L565 HydrophobicContact CG-CD1 3.98Å; Y561-L565 WeakPolarHBondContact O-CB 3.48Å; Y561-L565 PolarHBondContact O-N 3.07Å
562	M	90.1	Very high	82.1	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59.7	-43	173.1	-78	-175.6	-73.4	0	0	111	L502 P508 Q511 V512 L515 E558 E560 L566 L579 L582	L502-M562 HydrophobicContact CD1-CE 4.06Å; L502-M562 HydrophobicContact CD1-SD 4.34Å; L502-M562 HydrophobicContact CD2-CE 3.95Å; L502-M562 HydrophobicContact CD2-SD 4.32Å; L502-M562 HydrophobicContact CG-CE 4.49Å; P508-M562 HydrophobicContact CB-CG 4.44Å; Q511-M562 HydrophobicContact CB-CG 3.6Å; Q511-M562 HydrophobicContact CB-SD 3.46Å; Q511-M562 WeakPolarHBondContact CB-SD 2.84Å; Q511-M562 HydrophobicContact CG-CG 4.42Å; V512-M562 HydrophobicContact CG2-CB 4.48Å; V512-M562 HydrophobicContact CG2-CG 4.33Å; V512-M562 HydrophobicContact CG2-SD 3.68Å; L515-M562 HydrophobicContact CD2-CE 4.46Å; E558-M562 HydrophobicContact CB-CE 4.28Å; E558-M562 WeakPolarHBondContact O-CB 3.38Å; E558-M562 VanDerWaalsContact O-CE 3.23Å; E558-M562 WeakPolarHBondContact O-CE 3.28Å; E558-M562 VanDerWaalsContact O-CG 3.24Å; E558-M562 WeakPolarHBondContact O-CG 3.28Å; E558-M562 PolarHBondContact O-N 3.05Å; E560-M562 PolarHBondContact O-N 3.15Å; M562-L566 VanDerWaalsContact O-CB 3.3Å; M562-L566 WeakPolarHBondContact O-CB 3.45Å; M562-L566 VanDerWaalsContact O-CD1 3.3Å; M562-L566 WeakPolarHBondContact O-CD1 3.41Å; M562-L566 WeakPolarHBondContact O-CG 3.47Å; M562-L566 PolarHBondContact O-N 3.14Å; M562-L579 HydrophobicContact CB-CD1 3.86Å; M562-L579 HydrophobicContact CB-CD2 3.99Å; M562-L579 HydrophobicContact CE-CD1 3.64Å; M562-L579 HydrophobicContact SD-CD1 4.14Å; M562-L582 HydrophobicContact CE-CD2 3.81Å
563	S	80.6	Confident	80.6	Confident	8 Å²	8	23.5 Å²	23.5	6%	0.056	14%	0.142	C	C	.	.	H	α-helix	trans	-67.3	-61.2	-175.6	77.4	0	0	0	0	111.3	A559 E560 Y561 L565 L566 R617	A559-S563 WeakPolarHBondContact O-CB 3.48Å; A559-S563 PolarHBondContact O-N 3.2Å; A559-S563 PolarHBondContact O-OG 2.87Å; E560-S563 PolarHBondContact O-N 2.66Å; E560-S563 VanDerWaalsContact O-N 3.09Å; E560-S563 PolarHBondContact O-OG 3.1Å; Y561-S563 VanDerWaalsContact C-N 3.3Å; Y561-S563 PolarHBondContact O-N 3.22Å; S563-L565 VanDerWaalsContact C-N 3.29Å; S563-L565 PolarHBondContact O-N 2.93Å; S563-L566 PolarHBondContact O-N 3.42Å; S563-R617 PolarHBondContact O-NH1 3.36Å; S563-R617 PolarHBondContact O-NH2 2.94Å
564	E	82.2	Confident	79.6	Confident	27 Å²	27	26.4 Å²	26.4	13%	0.126	15%	0.153	C	C	.	.	H	α-helix	trans	-61	-36	-172.4	-66.6	-177.8	-131.9	0	0	112.2	L399 R403 R455 E560	L399-E564 HydrophobicContact CB-CB 3.6Å; L399-E564 HydrophobicContact CB-CG 4.38Å; L399-E564 WeakPolarHBondContact CB-OE2 3.42Å; L399-E564 HydrophobicContact CD1-CB 4.14Å; L399-E564 HydrophobicContact CG-CB 4.38Å; L399-E564 WeakPolarHBondContact CG-OE2 3.36Å; L399-E564 PolarHBondContact N-OE2 2.83Å; R403-E564 VanDerWaalsContact CD-O 3.26Å; R403-E564 WeakPolarHBondContact CD-O 3.31Å; R403-E564 PolarHBondContact NE-O 3.19Å; R403-E564 VanDerWaalsContact NE-O 3.07Å; R455-E564 IonicContact CZ-OE1 2.73Å; R455-E564 IonicContact NH1-OE1 2.82Å; R455-E564 IonicContact NH2-OE1 2.86Å; R455-E564 PolarHBondContact NH2-OE1 2.93Å; E560-E564 PolarHBondContact O-N 3.49Å
565	L	85.8	Confident	78.6	Confident	6 Å²	6	24 Å²	24	3%	0.031	14%	0.142	C	C	.	.	H	α-helix	trans	-85.4	-19.4	-177.3	-68.9	172.5	0	0	0	115.8	L399 I402 R403 L441 P508 Y561 S563	L399-L565 HydrophobicContact CB-CD2 3.82Å; L399-L565 HydrophobicContact CB-CG 3.89Å; L399-L565 HydrophobicContact CD1-CG 4.4Å; L399-L565 WeakPolarHBondContact O-CD2 3.26Å; I402-L565 HydrophobicContact CB-CD2 4.19Å; I402-L565 HydrophobicContact CG2-CD2 3.99Å; R403-L565 HydrophobicContact CB-CD2 4.48Å; R403-L565 WeakPolarHBondContact CD-O 3.37Å; R403-L565 WeakPolarHBondContact CG-O 3.5Å; L441-L565 HydrophobicContact CD1-CD1 4.17Å; L441-L565 HydrophobicContact CD2-CD1 3.99Å; L441-L565 HydrophobicContact CD2-CD2 4.19Å; P508-L565 HydrophobicContact CB-CB 4.48Å; P508-L565 HydrophobicContact CG-CB 4.01Å; Y561-L565 HydrophobicContact CD1-CD1 4.05Å; Y561-L565 HydrophobicContact CD2-CD1 3.61Å; Y561-L565 HydrophobicContact CE1-CD1 3.77Å; Y561-L565 HydrophobicContact CE2-CD1 3.29Å; Y561-L565 HydrophobicContact CG-CD1 3.98Å; Y561-L565 WeakPolarHBondContact O-CB 3.48Å; Y561-L565 PolarHBondContact O-N 3.07Å; S563-L565 VanDerWaalsContact C-N 3.29Å; S563-L565 PolarHBondContact O-N 2.93Å
566	L	82.5	Confident	77.5	Confident	8 Å²	8	23.9 Å²	23.9	4%	0.042	14%	0.142	C	C	.	.	S	Bend	trans	-74.7	137.2	178.6	-84.3	168.4	0	0	0	112.1	R403 P508 V512 M562 S563 L570 L571 L579	R403-L566 WeakPolarHBondContact CD-O 3.3Å; P508-L566 HydrophobicContact CB-CD2 4.35Å; P508-L566 HydrophobicContact CB-CG 4.03Å; P508-L566 HydrophobicContact CG-CD2 4.42Å; P508-L566 HydrophobicContact CG-CG 4.42Å; V512-L566 HydrophobicContact CG2-CD1 3.54Å; M562-L566 VanDerWaalsContact O-CB 3.3Å; M562-L566 WeakPolarHBondContact O-CB 3.45Å; M562-L566 VanDerWaalsContact O-CD1 3.3Å; M562-L566 WeakPolarHBondContact O-CD1 3.41Å; M562-L566 WeakPolarHBondContact O-CG 3.47Å; M562-L566 PolarHBondContact O-N 3.14Å; S563-L566 PolarHBondContact O-N 3.42Å; L566-L570 HydrophobicContact CD2-CD1 4.28Å; L566-L571 HydrophobicContact CB-CD1 3.79Å; L566-L571 HydrophobicContact CB-CD2 3.81Å; L566-L571 HydrophobicContact CB-CG 3.79Å; L566-L571 HydrophobicContact CD1-CD2 3.61Å; L566-L571 HydrophobicContact CD1-CG 4.46Å; L566-L571 HydrophobicContact CG-CD2 4.33Å; L566-L579 HydrophobicContact CD1-CD2 4.35Å
567	E	72.3	Confident	76.7	Confident	45 Å²	45	26.4 Å²	26.4	21%	0.21	15%	0.15	C	C	.	.			trans	-54.1	128.3	169.3	-79.3	-61.6	158.3	0	0	110.7	S407 S569 L570 L571	S407-E567 WeakPolarHBondContact CB-OE1 3.44Å; S407-E567 PolarHBondContact OG-OE1 2.83Å; E567-S569 PolarHBondContact O-N 2.59Å; E567-L570 HydrophobicContact CB-CB 4.46Å; E567-L570 HydrophobicContact CB-CD1 4.1Å; E567-L570 HydrophobicContact CB-CG 4.03Å; E567-L570 WeakPolarHBondContact O-CB 3.44Å; E567-L570 PolarHBondContact O-N 3.09Å; E567-L571 PolarHBondContact O-N 2.8Å
568	P	69.2	Low	76.3	Confident	57 Å²	57	26.4 Å²	26.4	37%	0.37	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-52.4	-34.2	-178.3	-30	36	0	0	0	113.8	L570 L571	P568-L570 VanDerWaalsContact C-N 3.34Å; P568-L570 PolarHBondContact O-N 2.77Å; P568-L571 PolarHBondContact O-N 3.44Å
569	S	62.1	Low	75.8	Confident	51 Å²	51	26.2 Å²	26.2	36%	0.357	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-65.9	-29.5	176.4	65.7	0	0	0	0	114.4	E567 L571 T572	E567-S569 PolarHBondContact O-N 2.59Å; S569-L571 VanDerWaalsContact C-N 3.31Å; S569-T572 PolarHBondContact O-OG1 2.99Å
570	L	62.9	Low	75.2	Confident	54 Å²	54	26.8 Å²	26.8	28%	0.283	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-79.6	-15.3	176.9	-63.4	-179	0	0	0	113	L566 E567 P568 T572	L566-L570 HydrophobicContact CD2-CD1 4.28Å; E567-L570 HydrophobicContact CB-CB 4.46Å; E567-L570 HydrophobicContact CB-CD1 4.1Å; E567-L570 HydrophobicContact CB-CG 4.03Å; E567-L570 WeakPolarHBondContact O-CB 3.44Å; E567-L570 PolarHBondContact O-N 3.09Å; P568-L570 VanDerWaalsContact C-N 3.34Å; P568-L570 PolarHBondContact O-N 2.77Å; L570-T572 VanDerWaalsContact C-N 3.29Å
571	L	62.8	Low	75	Confident	1 Å²	1	26 Å²	26	1%	0.005	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-88.4	1.1	176.8	-63.8	167.4	0	0	0	112.5	F229 L566 E567 P568 S569 G576 L579 R617	F229-L571 HydrophobicContact CD1-CB 3.46Å; F229-L571 VanDerWaalsContact CD1-CB 3.46Å; F229-L571 HydrophobicContact CD1-CD1 4.16Å; F229-L571 HydrophobicContact CD1-CG 4.43Å; F229-L571 HydrophobicContact CD2-CB 4Å; F229-L571 WeakPolarHBondContact CD2-O 3.36Å; F229-L571 HydrophobicContact CE1-CB 3.23Å; F229-L571 HydrophobicContact CE1-CD1 3.28Å; F229-L571 HydrophobicContact CE1-CG 3.8Å; F229-L571 HydrophobicContact CE2-CB 3.82Å; F229-L571 HydrophobicContact CG-CB 3.84Å; F229-L571 HydrophobicContact CZ-CB 3.43Å; F229-L571 VanDerWaalsContact CZ-CB 3.43Å; F229-L571 HydrophobicContact CZ-CD1 3.7Å; F229-L571 HydrophobicContact CZ-CD2 4.18Å; F229-L571 HydrophobicContact CZ-CG 3.96Å; L566-L571 HydrophobicContact CB-CD1 3.79Å; L566-L571 HydrophobicContact CB-CD2 3.81Å; L566-L571 HydrophobicContact CB-CG 3.79Å; L566-L571 HydrophobicContact CD1-CD2 3.61Å; L566-L571 HydrophobicContact CD1-CG 4.46Å; L566-L571 HydrophobicContact CG-CD2 4.33Å; E567-L571 PolarHBondContact O-N 2.8Å; P568-L571 PolarHBondContact O-N 3.44Å; S569-L571 VanDerWaalsContact C-N 3.31Å; L571-G576 WeakPolarHBondContact O-CA 3.4Å; L571-L579 HydrophobicContact CD2-CD2 3.74Å; L571-R617 VanDerWaalsContact CD1-NH2 3.34Å
572	T	54.5	Low	75	Confident	37 Å²	37	26.1 Å²	26.1	23%	0.227	15%	0.15	C	C	.	.	S	Bend	trans	-86.3	119.7	172.7	66.2	0	0	0	0	110.1	F229 L233 S569 L570	F229-T572 HydrophobicContact CB-CG2 3.9Å; L233-T572 WeakPolarHBondContact CD1-OG1 3.35Å; S569-T572 PolarHBondContact O-OG1 2.99Å; L570-T572 VanDerWaalsContact C-N 3.29Å
573	G	64.8	Low	74.8	Confident	44 Å²	44	27.1 Å²	27.1	45%	0.454	16%	0.157	S	C	.	.	S	Bend	trans	99.1	-156.1	-177.2	0	0	0	0	0	114.3	G575 G576 Y577	G573-G575 VanDerWaalsContact C-N 3.33Å; G573-G575 PolarHBondContact O-N 3.14Å; G573-G576 PolarHBondContact O-N 2.96Å; G573-Y577 PolarHBondContact O-N 2.78Å
574	E	71.6	Confident	74.7	Confident	91 Å²	91	26.9 Å²	26.9	43%	0.425	16%	0.155	S	C	.	.	H	α-helix	trans	-52.7	-42.6	-167.6	-170.3	-176.1	-173.4	0	0	114.3	F241 L516 G576 Y577 Y578	F241-E574 HydrophobicContact CE1-CB 4.25Å; F241-E574 WeakPolarHBondContact CE1-OE2 3.34Å; L516-E574 HydrophobicContact CD2-CG 3.85Å; L516-E574 HydrophobicContact CG-CG 4.33Å; E574-G576 PolarHBondContact O-N 2.87Å; E574-Y577 PolarHBondContact O-N 2.95Å; E574-Y578 HydrophobicContact CG-CD2 3.78Å; E574-Y578 HydrophobicContact CG-CE2 3.47Å; E574-Y578 VanDerWaalsContact CG-CE2 3.47Å; E574-Y578 VanDerWaalsContact O-CD2 3.3Å; E574-Y578 WeakPolarHBondContact O-CD2 3.45Å; E574-Y578 PolarHBondContact O-N 2.86Å; E574-Y578 VanDerWaalsContact O-N 3.11Å
575	G	71.6	Confident	74.9	Confident	4 Å²	4	25.6 Å²	25.6	4%	0.041	15%	0.149	C	C	.	.	H	α-helix	trans	-59.4	-43.9	177.5	0	0	0	0	0	113.5	G573 L579	G573-G575 VanDerWaalsContact C-N 3.33Å; G573-G575 PolarHBondContact O-N 3.14Å; G575-L579 WeakPolarHBondContact O-CB 3.24Å; G575-L579 PolarHBondContact O-N 2.93Å
576	G	71.2	Confident	75	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-74	-39.3	175.6	0	0	0	0	0	112.7	L571 G573 E574 Y578 L579 T580	L571-G576 WeakPolarHBondContact O-CA 3.4Å; G573-G576 PolarHBondContact O-N 2.96Å; E574-G576 PolarHBondContact O-N 2.87Å; G576-Y578 PolarHBondContact O-N 2.77Å; G576-L579 PolarHBondContact O-N 3.13Å; G576-T580 WeakPolarHBondContact O-CB 3.35Å; G576-T580 PolarHBondContact O-N 3.17Å; G576-T580 PolarHBondContact O-OG1 3.11Å
577	Y	75.2	Confident	75	Confident	78 Å²	78	26.2 Å²	26.2	31%	0.306	16%	0.156	S	C	.	.	H	α-helix	trans	-54.2	-52.2	176.7	172.8	-99.7	0	0	0	111.7	A536 G573 E574 L579 T580 S581	A536-Y577 VanDerWaalsContact CB-OH 3.26Å; A536-Y577 WeakPolarHBondContact CB-OH 3.37Å; G573-Y577 PolarHBondContact O-N 2.78Å; E574-Y577 PolarHBondContact O-N 2.95Å; Y577-L579 PolarHBondContact O-N 3.49Å; Y577-T580 WeakPolarHBondContact O-CB 3.24Å; Y577-T580 PolarHBondContact O-N 2.81Å; Y577-S581 PolarHBondContact O-N 2.91Å; Y577-S581 PolarHBondContact O-OG 3.28Å
578	Y	83.8	Confident	75.5	Confident	8 Å²	8	24.6 Å²	24.6	3%	0.031	15%	0.149	C	C	.	.	H	α-helix	trans	-70.7	-32	179.9	-70.1	-59.3	0	0	0	113.7	P211 L516 C519 Y523 F539 E574 G576 T580 S581 L582	P211-Y578 WeakPolarHBondContact CG-OH 3.45Å; L516-Y578 HydrophobicContact CD1-CD2 3.67Å; L516-Y578 HydrophobicContact CD1-CG 4.39Å; L516-Y578 HydrophobicContact CG-CD2 3.67Å; L516-Y578 HydrophobicContact CG-CE2 4.06Å; C519-Y578 HydrophobicContact CB-CD1 3.44Å; C519-Y578 VanDerWaalsContact CB-CD1 3.44Å; C519-Y578 HydrophobicContact CB-CD2 4.35Å; C519-Y578 HydrophobicContact CB-CE1 3.46Å; C519-Y578 VanDerWaalsContact CB-CE1 3.46Å; C519-Y578 HydrophobicContact CB-CE2 4.35Å; C519-Y578 HydrophobicContact CB-CG 3.9Å; C519-Y578 VanDerWaalsContact SG-CD1 3.51Å; Y523-Y578 HydrophobicContact CD2-CE1 4.18Å; Y523-Y578 AromaticContact CE2-CE1 3.93Å; Y523-Y578 HydrophobicContact CE2-CE1 3.93Å; F539-Y578 HydrophobicContact CE1-CD1 4.03Å; F539-Y578 AromaticContact CE1-CE1 3.99Å; F539-Y578 HydrophobicContact CE1-CE1 3.99Å; F539-Y578 HydrophobicContact CZ-CD1 4Å; F539-Y578 AromaticContact CZ-CE1 3.81Å; F539-Y578 HydrophobicContact CZ-CE1 3.81Å; E574-Y578 HydrophobicContact CG-CD2 3.78Å; E574-Y578 HydrophobicContact CG-CE2 3.47Å; E574-Y578 VanDerWaalsContact CG-CE2 3.47Å; E574-Y578 VanDerWaalsContact O-CD2 3.3Å; E574-Y578 WeakPolarHBondContact O-CD2 3.45Å; E574-Y578 PolarHBondContact O-N 2.86Å; E574-Y578 VanDerWaalsContact O-N 3.11Å; G576-Y578 PolarHBondContact O-N 2.77Å; Y578-T580 VanDerWaalsContact C-N 3.31Å; Y578-S581 PolarHBondContact O-N 2.8Å; Y578-L582 WeakPolarHBondContact O-CB 2.97Å; Y578-L582 PolarHBondContact O-N 2.74Å
579	L	83.3	Confident	76.4	Confident	3 Å²	3	21.9 Å²	21.9	2%	0.016	13%	0.131	C	C	.	.	H	α-helix	trans	-65.7	-36.8	172.5	-177.8	58.2	0	0	0	111.4	V512 L515 M562 L566 L571 G575 G576 Y577 L582 S583	V512-L579 HydrophobicContact CG2-CD2 4.46Å; L515-L579 HydrophobicContact CD2-CB 4.35Å; L515-L579 HydrophobicContact CD2-CD1 4.4Å; M562-L579 HydrophobicContact CB-CD1 3.86Å; M562-L579 HydrophobicContact CB-CD2 3.99Å; M562-L579 HydrophobicContact CE-CD1 3.64Å; M562-L579 HydrophobicContact SD-CD1 4.14Å; L566-L579 HydrophobicContact CD1-CD2 4.35Å; L571-L579 HydrophobicContact CD2-CD2 3.74Å; G575-L579 WeakPolarHBondContact O-CB 3.24Å; G575-L579 PolarHBondContact O-N 2.93Å; G576-L579 PolarHBondContact O-N 3.13Å; Y577-L579 PolarHBondContact O-N 3.49Å; L579-L582 HydrophobicContact CD1-CD2 4.49Å; L579-S583 WeakPolarHBondContact O-CB 3.47Å; L579-S583 PolarHBondContact O-N 3.46Å; L579-S583 PolarHBondContact O-OG 3.42Å
580	T	77.5	Confident	77.5	Confident	16 Å²	16	20.2 Å²	20.2	10%	0.098	12%	0.119	C	C	.	.	H	α-helix	trans	-64.2	-47.7	170.9	-61.7	0	0	0	0	111.2	N226 L228 G576 Y577 Y578 L582 S583 A584 L610	N226-T580 PolarHBondContact ND2-OG1 3.03Å; L228-T580 HydrophobicContact CD1-CG2 3.71Å; L228-T580 VanDerWaalsContact CD1-OG1 3.24Å; L228-T580 WeakPolarHBondContact CD1-OG1 3.41Å; G576-T580 WeakPolarHBondContact O-CB 3.35Å; G576-T580 PolarHBondContact O-N 3.17Å; G576-T580 PolarHBondContact O-OG1 3.11Å; Y577-T580 WeakPolarHBondContact O-CB 3.24Å; Y577-T580 PolarHBondContact O-N 2.81Å; Y578-T580 VanDerWaalsContact C-N 3.31Å; T580-L582 PolarHBondContact O-N 2.75Å; T580-S583 PolarHBondContact O-N 3.09Å; T580-A584 WeakPolarHBondContact O-CB 3.47Å; T580-A584 PolarHBondContact O-N 2.86Å; T580-L610 HydrophobicContact CG2-CD2 3.35Å
581	S	82.5	Confident	78.3	Confident	9 Å²	9	18.6 Å²	18.6	6%	0.063	12%	0.116	C	C	.	.	H	α-helix	trans	-59	-44.7	176.6	-52.5	0	0	0	0	112.1	L540 Y577 Y578 A584 S585	L540-S581 WeakPolarHBondContact CD1-O 3.4Å; Y577-S581 PolarHBondContact O-N 2.91Å; Y577-S581 PolarHBondContact O-OG 3.28Å; Y578-S581 PolarHBondContact O-N 2.8Å; S581-A584 PolarHBondContact O-N 3.19Å; S581-S585 WeakPolarHBondContact O-CB 3.22Å; S581-S585 PolarHBondContact O-N 2.96Å; S581-S585 PolarHBondContact O-OG 2.79Å
582	L	89.8	Confident	79.1	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-58.8	-50.7	174.2	174.8	64.6	0	0	0	111.4	L515 L547 A559 M562 Y578 L579 T580 A584 S585 L586	L515-L582 HydrophobicContact CD1-CB 4.29Å; L515-L582 HydrophobicContact CD1-CD2 3.97Å; L515-L582 HydrophobicContact CD2-CB 4.1Å; L515-L582 HydrophobicContact CD2-CD2 3.81Å; L547-L582 HydrophobicContact CD1-CD1 3.82Å; L547-L582 HydrophobicContact CD2-CD1 4.08Å; A559-L582 HydrophobicContact CB-CD2 4.26Å; A559-L582 HydrophobicContact CB-CG 4.49Å; M562-L582 HydrophobicContact CE-CD2 3.81Å; Y578-L582 WeakPolarHBondContact O-CB 2.97Å; Y578-L582 PolarHBondContact O-N 2.74Å; L579-L582 HydrophobicContact CD1-CD2 4.49Å; T580-L582 PolarHBondContact O-N 2.75Å; L582-A584 VanDerWaalsContact C-N 3.29Å; L582-A584 PolarHBondContact O-N 2.8Å; L582-S585 PolarHBondContact O-N 3.45Å; L582-L586 HydrophobicContact CD1-CD1 3.79Å; L582-L586 HydrophobicContact CD1-CG 4.12Å; L582-L586 HydrophobicContact CG-CD1 3.84Å; L582-L586 VanDerWaalsContact O-CG 3.27Å; L582-L586 WeakPolarHBondContact O-CG 3.46Å; L582-L586 PolarHBondContact O-N 2.86Å
583	S	83.9	Confident	79.6	Confident	22 Å²	22	20.9 Å²	20.9	15%	0.154	14%	0.136	C	C	.	.	H	α-helix	trans	-59.2	-42.2	-179.1	-56	0	0	0	0	111.4	L579 T580 A587	L579-S583 WeakPolarHBondContact O-CB 3.47Å; L579-S583 PolarHBondContact O-N 3.46Å; L579-S583 PolarHBondContact O-OG 3.42Å; T580-S583 PolarHBondContact O-N 3.09Å; S583-A587 WeakPolarHBondContact O-CB 3.46Å; S583-A587 PolarHBondContact O-N 3.44Å
584	A	78.8	Confident	79.6	Confident	2 Å²	2	22.3 Å²	22.3	2%	0.017	13%	0.131	C	C	.	.	H	α-helix	trans	-68.9	-42.2	177.2	0	0	0	0	0	112.9	L540 T580 S581 L582 L586 A587 L588 L606	L540-A584 HydrophobicContact CD1-CB 4.24Å; T580-A584 WeakPolarHBondContact O-CB 3.47Å; T580-A584 PolarHBondContact O-N 2.86Å; S581-A584 PolarHBondContact O-N 3.19Å; L582-A584 VanDerWaalsContact C-N 3.29Å; L582-A584 PolarHBondContact O-N 2.8Å; A584-L586 VanDerWaalsContact C-N 3.33Å; A584-L586 PolarHBondContact O-N 2.8Å; A584-A587 PolarHBondContact O-N 3.42Å; A584-L588 WeakPolarHBondContact O-CB 3.44Å; A584-L588 VanDerWaalsContact O-CG 3.26Å; A584-L588 WeakPolarHBondContact O-CG 3.38Å; A584-L588 PolarHBondContact O-N 3.34Å; A584-L606 HydrophobicContact CB-CD1 3.32Å
585	S	87.8	Confident	78.2	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.9	-41	175	-70.8	0	0	0	0	112.4	L540 L543 S544 S581 L582 L588 L589	L540-S585 WeakPolarHBondContact CD1-OG 3.33Å; L543-S585 WeakPolarHBondContact CG-OG 3.22Å; S544-S585 WeakPolarHBondContact OG-CA 3.32Å; S544-S585 VanDerWaalsContact OG-CB 3.3Å; S544-S585 WeakPolarHBondContact OG-CB 3.21Å; S544-S585 PolarHBondContact OG-OG 2.89Å; S581-S585 WeakPolarHBondContact O-CB 3.22Å; S581-S585 PolarHBondContact O-N 2.96Å; S581-S585 PolarHBondContact O-OG 2.79Å; L582-S585 PolarHBondContact O-N 3.45Å; S585-L588 PolarHBondContact O-N 2.98Å; S585-L589 WeakPolarHBondContact O-CB 3.44Å; S585-L589 WeakPolarHBondContact O-CD1 3.48Å; S585-L589 VanDerWaalsContact O-CG 3.27Å; S585-L589 WeakPolarHBondContact O-CG 3.47Å; S585-L589 PolarHBondContact O-N 3.29Å
586	L	88.2	Confident	76.7	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.016	19%	0.187	C	C	.	.	H	α-helix	trans	-67.3	-36.6	176.5	-66.9	167.1	0	0	0	112.2	L465 L547 L555 L556 A559 L582 A584 S590	L465-L586 HydrophobicContact CD1-CD2 4.13Å; L465-L586 HydrophobicContact CD2-CD2 4.01Å; L547-L586 HydrophobicContact CD1-CD2 4.49Å; L555-L586 HydrophobicContact CB-CD1 4.26Å; L555-L586 HydrophobicContact CB-CD2 4.27Å; L556-L586 HydrophobicContact CD1-CB 4.31Å; A559-L586 HydrophobicContact CB-CD1 3.95Å; L582-L586 HydrophobicContact CD1-CD1 3.79Å; L582-L586 HydrophobicContact CD1-CG 4.12Å; L582-L586 HydrophobicContact CG-CD1 3.84Å; L582-L586 VanDerWaalsContact O-CG 3.27Å; L582-L586 WeakPolarHBondContact O-CG 3.46Å; L582-L586 PolarHBondContact O-N 2.86Å; A584-L586 VanDerWaalsContact C-N 3.33Å; A584-L586 PolarHBondContact O-N 2.8Å; L586-S590 WeakPolarHBondContact O-CB 3.46Å; L586-S590 PolarHBondContact O-N 3.21Å; L586-S590 PolarHBondContact O-OG 3.17Å
587	A	81.2	Confident	75.1	Confident	24 Å²	24	35.4 Å²	35.4	20%	0.198	21%	0.212	C	C	.	.	H	α-helix	trans	-71.6	-40	174.7	0	0	0	0	0	112.4	S583 A584 L589 S590 G591 S609	S583-A587 WeakPolarHBondContact O-CB 3.46Å; S583-A587 PolarHBondContact O-N 3.44Å; A584-A587 PolarHBondContact O-N 3.42Å; A587-L589 PolarHBondContact O-N 3.37Å; A587-S590 CarbonylContact O-C 3.5Å; A587-S590 WeakPolarHBondContact O-CB 3.49Å; A587-S590 PolarHBondContact O-N 3.12Å; A587-S590 VanDerWaalsContact O-N 3.15Å; A587-G591 PolarHBondContact O-N 3.5Å; A587-S609 WeakPolarHBondContact CB-OG 3.26Å
588	L	83.4	Confident	73.6	Confident	12 Å²	12	37.7 Å²	37.7	6%	0.063	23%	0.229	C	C	.	.	H	α-helix	trans	-55.8	-50.3	171.6	-77.5	167.4	0	0	0	111.4	L540 A584 S585 S590 G591 L592 P602 E605	L540-L588 HydrophobicContact CD2-CD1 3.84Å; L540-L588 HydrophobicContact CG-CD1 4.08Å; A584-L588 WeakPolarHBondContact O-CB 3.44Å; A584-L588 VanDerWaalsContact O-CG 3.26Å; A584-L588 WeakPolarHBondContact O-CG 3.38Å; A584-L588 PolarHBondContact O-N 3.34Å; S585-L588 PolarHBondContact O-N 2.98Å; L588-S590 VanDerWaalsContact C-N 3.35Å; L588-S590 PolarHBondContact O-N 2.91Å; L588-G591 PolarHBondContact O-N 3.09Å; L588-L592 PolarHBondContact O-N 2.83Å; L588-P602 HydrophobicContact CD1-CB 4.29Å; L588-P602 HydrophobicContact CD2-CB 3.93Å; L588-E605 HydrophobicContact CD2-CB 3.83Å; L588-E605 HydrophobicContact CD2-CG 4.22Å
589	L	87.6	Confident	71.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-55.6	-49.5	173.5	-73.6	160.9	0	0	0	111	L465 G468 L469 A472 F480 L547 A548 S585 A587 G591 L592	L465-L589 HydrophobicContact CD1-CB 3.73Å; L465-L589 HydrophobicContact CD1-CD1 4.34Å; G468-L589 WeakPolarHBondContact CA-O 3.25Å; L469-L589 HydrophobicContact CD2-CD1 3.82Å; L469-L589 HydrophobicContact CD2-CD2 4.37Å; A472-L589 HydrophobicContact CB-CD2 3.56Å; F480-L589 HydrophobicContact CZ-CD2 3.85Å; F480-L589 HydrophobicContact CZ-CG 4.44Å; L547-L589 HydrophobicContact CB-CD1 3.96Å; A548-L589 HydrophobicContact CB-CD2 4.01Å; S585-L589 WeakPolarHBondContact O-CB 3.44Å; S585-L589 WeakPolarHBondContact O-CD1 3.48Å; S585-L589 VanDerWaalsContact O-CG 3.27Å; S585-L589 WeakPolarHBondContact O-CG 3.47Å; S585-L589 PolarHBondContact O-N 3.29Å; A587-L589 PolarHBondContact O-N 3.37Å; L589-G591 PolarHBondContact O-N 2.87Å; L589-G591 VanDerWaalsContact O-N 3.13Å; L589-L592 HydrophobicContact CD2-CD1 4.29Å; L589-L592 PolarHBondContact O-N 3.43Å; L589-L592 VanDerWaalsContact O-N 3.11Å
590	S	85.1	Confident	69.7	Low	15 Å²	15	47 Å²	47	11%	0.105	29%	0.286	C	S	.	.	H	α-helix	trans	-62.7	-17.8	177.7	-54.8	0	0	0	0	114.2	L586 A587 L588 Q594	L586-S590 WeakPolarHBondContact O-CB 3.46Å; L586-S590 PolarHBondContact O-N 3.21Å; L586-S590 PolarHBondContact O-OG 3.17Å; A587-S590 CarbonylContact O-C 3.5Å; A587-S590 WeakPolarHBondContact O-CB 3.49Å; A587-S590 PolarHBondContact O-N 3.12Å; A587-S590 VanDerWaalsContact O-N 3.15Å; L588-S590 VanDerWaalsContact C-N 3.35Å; L588-S590 PolarHBondContact O-N 2.91Å; S590-Q594 PolarHBondContact O-NE2 3.37Å
591	G	80	Confident	68.3	Low	21 Å²	21	48.4 Å²	48.4	22%	0.216	30%	0.296	C	S	.	.	H	α-helix	trans	-80.3	-29.4	174.6	0	0	0	0	0	114.1	A587 L588 L589 G593 Q594	A587-G591 PolarHBondContact O-N 3.5Å; L588-G591 PolarHBondContact O-N 3.09Å; L589-G591 PolarHBondContact O-N 2.87Å; L589-G591 VanDerWaalsContact O-N 3.13Å; G591-G593 VanDerWaalsContact C-N 3.26Å; G591-G593 PolarHBondContact O-N 3.35Å; G591-G593 VanDerWaalsContact O-N 3.13Å; G591-Q594 WeakPolarHBondContact O-CB 3.47Å; G591-Q594 PolarHBondContact O-N 3.26Å
592	L	79.9	Confident	66.3	Low	46 Å²	46	50 Å²	50	24%	0.241	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.5	-170.6	-65.9	175.7	0	0	0	114.3	L471 A472 A479 F480 L588 L589 Q594	L471-L592 HydrophobicContact CB-CB 4.44Å; L471-L592 HydrophobicContact CD1-CB 4.33Å; A472-L592 HydrophobicContact CB-CD1 3.72Å; A479-L592 HydrophobicContact CB-CD1 4.46Å; F480-L592 HydrophobicContact CE1-CD1 4.05Å; F480-L592 HydrophobicContact CE1-CD2 4.38Å; F480-L592 HydrophobicContact CZ-CD1 4.05Å; L588-L592 PolarHBondContact O-N 2.83Å; L589-L592 HydrophobicContact CD2-CD1 4.29Å; L589-L592 PolarHBondContact O-N 3.43Å; L589-L592 VanDerWaalsContact O-N 3.11Å; L592-Q594 VanDerWaalsContact C-N 3.33Å
593	G	64	Low	63.9	Low	40 Å²	40	52.3 Å²	52.3	41%	0.412	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-10.5	176.5	0	0	0	0	0	114.9	G591 A595	G591-G593 VanDerWaalsContact C-N 3.26Å; G591-G593 PolarHBondContact O-N 3.35Å; G591-G593 VanDerWaalsContact O-N 3.13Å; G593-A595 VanDerWaalsContact C-N 3.28Å; G593-A595 PolarHBondContact O-N 2.89Å
594	Q	65.6	Low	61.9	Low	74 Å²	74	55 Å²	55	35%	0.346	33%	0.333	S	S	.	.			trans	-89.7	54.5	-171	-61.9	177.3	56.1	0	0	112.1	S590 G591 L592 H596 T597	S590-Q594 PolarHBondContact O-NE2 3.37Å; G591-Q594 WeakPolarHBondContact O-CB 3.47Å; G591-Q594 PolarHBondContact O-N 3.26Å; L592-Q594 VanDerWaalsContact C-N 3.33Å; Q594-H596 PolarHBondContact O-N 3.21Å; Q594-T597 PolarHBondContact O-N 2.99Å; Q594-T597 PolarHBondContact O-OG1 3.09Å
595	A	41.3	Very low	60.3	Low	89 Å²	89	55.9 Å²	55.9	74%	0.736	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	6.2	-172.7	0	0	0	0	0	116.5	G593	G593-A595 VanDerWaalsContact C-N 3.28Å; G593-A595 PolarHBondContact O-N 2.89Å
596	H	40.9	Very low	58.3	Low	194 Å²	194	58 Å²	58	90%	0.898	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-6.2	179.7	-71.8	63.9	0	0	0	113.8	Q594	Q594-H596 PolarHBondContact O-N 3.21Å
597	T	38.4	Very low	56.1	Low	86 Å²	86	65 Å²	65	53%	0.528	37%	0.373	S	S	.	.	S	Bend	trans	-108	143.9	165.8	45.9	0	0	0	0	110.1	Q594	Q594-T597 PolarHBondContact O-N 2.99Å; Q594-T597 PolarHBondContact O-OG1 3.09Å
598	L	43.4	Very low	54.4	Low	127 Å²	127	68.6 Å²	68.6	67%	0.665	38%	0.382	S	S	*	.			trans	-45.7	136.4	174.8	-83.5	141.5	0	0	0	111	L600	L598-L600 PolarHBondContact O-N 3.3Å
599	P	40.4	Very low	52.5	Low	125 Å²	125	68.8 Å²	68.8	81%	0.812	38%	0.384	S	S	*	.			trans	-62.4	101	-179.6	25.2	-33.7	0	0	0	110.1	S601	P599-S601 PolarHBondContact O-N 2.97Å
600	L	44.7	Very low	50.6	Low	81 Å²	81	70.5 Å²	70.5	42%	0.424	39%	0.394	S	S	.	.			trans	-65.5	130	169.6	-67.2	171.1	0	0	0	107.4	L598 Q604 E605	L598-L600 PolarHBondContact O-N 3.3Å; L600-Q604 HydrophobicContact CB-CB 4.06Å; L600-Q604 HydrophobicContact CD2-CB 4.2Å; L600-E605 HydrophobicContact CB-CB 4.29Å; L600-E605 VanDerWaalsContact CD1-OE2 3.23Å; L600-E605 WeakPolarHBondContact CD1-OE2 3.45Å
601	S	46.8	Very low	48.6	Very low	46 Å²	46	71.9 Å²	71.9	32%	0.322	40%	0.403	S	S	.	.			trans	-57.9	155.4	174	63.4	0	0	0	0	110	P599 S603 Q604 E605	P599-S601 PolarHBondContact O-N 2.97Å; S601-S603 PolarHBondContact O-N 3.44Å; S601-S603 PolarHBondContact OG-OG 2.8Å; S601-S603 VanDerWaalsContact OG-OG 3.05Å; S601-Q604 WeakPolarHBondContact O-CA 3.49Å; S601-Q604 WeakPolarHBondContact O-CB 3.45Å; S601-Q604 PolarHBondContact O-N 2.81Å; S601-Q604 VanDerWaalsContact OG-CD 3.25Å; S601-Q604 WeakPolarHBondContact OG-CG 3.48Å; S601-Q604 PolarHBondContact OG-OE1 2.84Å; S601-E605 PolarHBondContact O-N 3.46Å; S601-E605 VanDerWaalsContact O-N 3.15Å
602	P	41.1	Very low	46.8	Very low	41 Å²	41	74.3 Å²	74.3	27%	0.266	41%	0.41	S	S	.	.	H	α-helix	trans	-53.7	-33.3	179.7	-29.8	36.2	0	0	0	113.4	L588 Q604 L606	L588-P602 HydrophobicContact CD1-CB 4.29Å; L588-P602 HydrophobicContact CD2-CB 3.93Å; P602-Q604 VanDerWaalsContact C-N 3.31Å; P602-Q604 PolarHBondContact O-N 2.84Å; P602-L606 WeakPolarHBondContact O-CB 3.32Å; P602-L606 PolarHBondContact O-N 2.97Å
603	S	38.9	Very low	45.1	Very low	51 Å²	51	73.7 Å²	73.7	36%	0.357	41%	0.405	S	S	.	.	H	α-helix	trans	-66.1	-24.9	174	81.3	0	0	0	0	114.9	S601 R607	S601-S603 PolarHBondContact O-N 3.44Å; S601-S603 PolarHBondContact OG-OG 2.8Å; S601-S603 VanDerWaalsContact OG-OG 3.05Å; S603-R607 WeakPolarHBondContact O-CG 3.35Å; S603-R607 PolarHBondContact O-N 3.45Å; S603-R607 PolarHBondContact O-NE 3.28Å; S603-R607 PolarHBondContact OG-NH2 3.46Å
604	Q	41.5	Very low	44.1	Very low	78 Å²	78	75.7 Å²	75.7	36%	0.364	40%	0.404	S	S	.	.	H	α-helix	trans	-90.6	-43.7	-177.6	-74.7	163.6	-32.1	0	0	111.4	L600 S601 P602 L606 R607 R608	L600-Q604 HydrophobicContact CB-CB 4.06Å; L600-Q604 HydrophobicContact CD2-CB 4.2Å; S601-Q604 WeakPolarHBondContact O-CA 3.49Å; S601-Q604 WeakPolarHBondContact O-CB 3.45Å; S601-Q604 PolarHBondContact O-N 2.81Å; S601-Q604 VanDerWaalsContact OG-CD 3.25Å; S601-Q604 WeakPolarHBondContact OG-CG 3.48Å; S601-Q604 PolarHBondContact OG-OE1 2.84Å; P602-Q604 VanDerWaalsContact C-N 3.31Å; P602-Q604 PolarHBondContact O-N 2.84Å; Q604-L606 VanDerWaalsContact C-N 3.32Å; Q604-R607 PolarHBondContact O-N 2.97Å; Q604-R607 VanDerWaalsContact O-N 3.14Å; Q604-R608 WeakPolarHBondContact O-CB 3.5Å; Q604-R608 PolarHBondContact O-N 3.4Å
605	E	46.7	Very low	42.9	Very low	21 Å²	21	78.2 Å²	78.2	10%	0.098	42%	0.415	C	S	.	.	H	α-helix	trans	-69.7	-32.1	172.6	-172.1	59.4	-145.7	0	0	110.8	L588 L600 S601 R608 S609	L588-E605 HydrophobicContact CD2-CB 3.83Å; L588-E605 HydrophobicContact CD2-CG 4.22Å; L600-E605 HydrophobicContact CB-CB 4.29Å; L600-E605 VanDerWaalsContact CD1-OE2 3.23Å; L600-E605 WeakPolarHBondContact CD1-OE2 3.45Å; S601-E605 PolarHBondContact O-N 3.46Å; S601-E605 VanDerWaalsContact O-N 3.15Å; E605-R608 PolarHBondContact O-N 2.96Å; E605-R608 WeakPolarHBondContact OE1-CD 3.36Å; E605-R608 IonicContact OE1-NH1 2.69Å; E605-R608 PolarHBondContact OE1-NH1 3.11Å; E605-R608 WeakPolarHBondContact OE2-CD 3.28Å; E605-R608 IonicContact OE2-CZ 3.51Å; E605-R608 IonicContact OE2-NE 3.39Å; E605-R608 IonicContact OE2-NH1 3.49Å; E605-R608 PolarHBondContact OE2-NH1 3.37Å; E605-S609 VanDerWaalsContact O-CB 3.23Å; E605-S609 WeakPolarHBondContact O-CB 3.23Å; E605-S609 PolarHBondContact O-N 3.33Å; E605-S609 PolarHBondContact O-OG 3.4Å
606	L	44.3	Very low	42.9	Very low	43 Å²	43	81.6 Å²	81.6	23%	0.225	41%	0.409	C	S	.	.	H	α-helix	trans	-51.3	-57.7	161.3	166.2	66.1	0	0	0	110.7	L540 A584 P602 Q604 R608 S609 L610	L540-L606 HydrophobicContact CD2-CB 4.36Å; L540-L606 HydrophobicContact CD2-CD1 4.25Å; L540-L606 HydrophobicContact CD2-CD2 3.99Å; L540-L606 HydrophobicContact CD2-CG 4.43Å; A584-L606 HydrophobicContact CB-CD1 3.32Å; P602-L606 WeakPolarHBondContact O-CB 3.32Å; P602-L606 PolarHBondContact O-N 2.97Å; Q604-L606 VanDerWaalsContact C-N 3.32Å; L606-R608 VanDerWaalsContact C-N 3.32Å; L606-R608 PolarHBondContact O-N 3.17Å; L606-S609 WeakPolarHBondContact O-CB 3.38Å; L606-S609 PolarHBondContact O-N 3.16Å; L606-S609 VanDerWaalsContact O-N 3.16Å; L606-L610 HydrophobicContact CD1-CD1 3.84Å; L606-L610 HydrophobicContact CD1-CD2 4.33Å; L606-L610 HydrophobicContact CD1-CG 3.95Å; L606-L610 HydrophobicContact CG-CD1 3.94Å; L606-L610 HydrophobicContact CG-CG 4.4Å; L606-L610 VanDerWaalsContact O-CG 3.23Å; L606-L610 WeakPolarHBondContact O-CG 3.47Å; L606-L610 PolarHBondContact O-N 2.95Å
607	R	43.3	Very low	43.1	Very low	150 Å²	150	74 Å²	74	57%	0.566	37%	0.373	S	S	*	.	H	α-helix	trans	-59.9	-38.3	-178.5	-84.6	176	-82	-173.9	-8	113.4	S603 Q604 S611	S603-R607 WeakPolarHBondContact O-CG 3.35Å; S603-R607 PolarHBondContact O-N 3.45Å; S603-R607 PolarHBondContact O-NE 3.28Å; S603-R607 PolarHBondContact OG-NH2 3.46Å; Q604-R607 PolarHBondContact O-N 2.97Å; Q604-R607 VanDerWaalsContact O-N 3.14Å; R607-S611 PolarHBondContact O-N 3.02Å; R607-S611 PolarHBondContact O-OG 3.08Å
608	R	44.5	Very low	42.9	Very low	100 Å²	100	75.8 Å²	75.8	38%	0.377	38%	0.378	S	S	.	.	H	α-helix	trans	-64.2	-48.3	173.8	-172	-167.4	-177.7	-162.7	0.3	111	Q604 E605 L606 L610 S611 L612	Q604-R608 WeakPolarHBondContact O-CB 3.5Å; Q604-R608 PolarHBondContact O-N 3.4Å; E605-R608 PolarHBondContact O-N 2.96Å; E605-R608 WeakPolarHBondContact OE1-CD 3.36Å; E605-R608 IonicContact OE1-NH1 2.69Å; E605-R608 PolarHBondContact OE1-NH1 3.11Å; E605-R608 WeakPolarHBondContact OE2-CD 3.28Å; E605-R608 IonicContact OE2-CZ 3.51Å; E605-R608 IonicContact OE2-NE 3.39Å; E605-R608 IonicContact OE2-NH1 3.49Å; E605-R608 PolarHBondContact OE2-NH1 3.37Å; L606-R608 VanDerWaalsContact C-N 3.32Å; L606-R608 PolarHBondContact O-N 3.17Å; R608-L610 VanDerWaalsContact C-N 3.33Å; R608-L610 PolarHBondContact O-N 2.81Å; R608-S611 PolarHBondContact O-N 3.15Å; R608-S611 VanDerWaalsContact O-N 3.13Å; R608-S611 PolarHBondContact O-OG 2.92Å; R608-L612 HydrophobicContact CG-CD1 4.14Å; R608-L612 WeakPolarHBondContact O-CG 3.32Å; R608-L612 PolarHBondContact O-N 3.46Å
609	S	44	Very low	42.5	Very low	16 Å²	16	74.7 Å²	74.7	11%	0.112	38%	0.379	C	S	.	.	H	α-helix	trans	-60.9	-41.3	177.6	-58	0	0	0	0	112	A587 E605 L606 W613	A587-S609 WeakPolarHBondContact CB-OG 3.26Å; E605-S609 VanDerWaalsContact O-CB 3.23Å; E605-S609 WeakPolarHBondContact O-CB 3.23Å; E605-S609 PolarHBondContact O-N 3.33Å; E605-S609 PolarHBondContact O-OG 3.4Å; L606-S609 WeakPolarHBondContact O-CB 3.38Å; L606-S609 PolarHBondContact O-N 3.16Å; L606-S609 VanDerWaalsContact O-N 3.16Å; S609-W613 WeakPolarHBondContact O-CB 3.18Å; S609-W613 PolarHBondContact O-N 3.09Å
610	L	47.1	Very low	42.2	Very low	37 Å²	37	73.1 Å²	73.1	19%	0.194	38%	0.376	C	S	.	.	H	α-helix	trans	-57	-52.7	170.8	-68	171.5	0	0	0	110.4	L228 T580 L606 R608 L612 W613 E614	L228-L610 HydrophobicContact CD1-CD2 3.74Å; L228-L610 HydrophobicContact CD2-CB 4.3Å; L228-L610 HydrophobicContact CD2-CD2 3.98Å; L228-L610 HydrophobicContact CG-CD2 4.12Å; T580-L610 HydrophobicContact CG2-CD2 3.35Å; L606-L610 HydrophobicContact CD1-CD1 3.84Å; L606-L610 HydrophobicContact CD1-CD2 4.33Å; L606-L610 HydrophobicContact CD1-CG 3.95Å; L606-L610 HydrophobicContact CG-CD1 3.94Å; L606-L610 HydrophobicContact CG-CG 4.4Å; L606-L610 VanDerWaalsContact O-CG 3.23Å; L606-L610 WeakPolarHBondContact O-CG 3.47Å; L606-L610 PolarHBondContact O-N 2.95Å; R608-L610 VanDerWaalsContact C-N 3.33Å; R608-L610 PolarHBondContact O-N 2.81Å; L610-L612 PolarHBondContact O-N 3.46Å; L610-W613 CarbonylContact O-C 3.54Å; L610-W613 WeakPolarHBondContact O-CB 3.49Å; L610-W613 PolarHBondContact O-N 3.44Å; L610-W613 VanDerWaalsContact O-N 3.13Å; L610-E614 WeakPolarHBondContact O-CG 3.4Å; L610-E614 PolarHBondContact O-N 3.01Å
611	S	43.4	Very low	41.6	Very low	43 Å²	43	72.8 Å²	72.8	30%	0.301	38%	0.377	S	S	.	.	H	α-helix	trans	-64.7	-36	-179	63.5	0	0	0	0	114.4	R607 R608 W613 E614 Q615	R607-S611 PolarHBondContact O-N 3.02Å; R607-S611 PolarHBondContact O-OG 3.08Å; R608-S611 PolarHBondContact O-N 3.15Å; R608-S611 VanDerWaalsContact O-N 3.13Å; R608-S611 PolarHBondContact O-OG 2.92Å; S611-W613 VanDerWaalsContact C-N 3.31Å; S611-E614 PolarHBondContact O-N 3.44Å; S611-Q615 VanDerWaalsContact O-CG 3.26Å; S611-Q615 WeakPolarHBondContact O-CG 3.4Å; S611-Q615 PolarHBondContact O-N 3.17Å
612	L	43.6	Very low	41.2	Very low	72 Å²	72	78 Å²	78	38%	0.377	40%	0.397	S	S	.	.	H	α-helix	trans	-68.8	-34	174.3	-71.1	169.7	0	0	0	111.5	R608 L610 R616	R608-L612 HydrophobicContact CG-CD1 4.14Å; R608-L612 WeakPolarHBondContact O-CG 3.32Å; R608-L612 PolarHBondContact O-N 3.46Å; L610-L612 PolarHBondContact O-N 3.46Å; L612-R616 VanDerWaalsContact O-CG 3.28Å; L612-R616 WeakPolarHBondContact O-CG 3.41Å; L612-R616 PolarHBondContact O-N 2.96Å
613	W	43.2	Very low	41.1	Very low	34 Å²	34	78.1 Å²	78.1	13%	0.129	40%	0.398	C	S	.	.	H	α-helix	trans	-72.6	-37.1	174.9	-177.2	109.9	0	0	0	111.1	L228 F229 S609 L610 S611 R616 R617	L228-W613 HydrophobicContact CB-CE3 4.23Å; L228-W613 HydrophobicContact CB-CH2 4.17Å; L228-W613 HydrophobicContact CB-CZ3 3.64Å; L228-W613 HydrophobicContact CD1-CD2 4.23Å; L228-W613 HydrophobicContact CD1-CE3 3.83Å; L228-W613 HydrophobicContact CD1-CH2 4.29Å; L228-W613 HydrophobicContact CD1-CZ3 3.91Å; L228-W613 HydrophobicContact CD2-CE3 3.65Å; L228-W613 HydrophobicContact CD2-CZ3 3.93Å; L228-W613 HydrophobicContact CG-CE3 4.11Å; L228-W613 HydrophobicContact CG-CZ3 4.04Å; F229-W613 HydrophobicContact CD1-CH2 4.37Å; F229-W613 AromaticContact CE1-CH2 3.36Å; F229-W613 HydrophobicContact CE1-CH2 3.36Å; F229-W613 HydrophobicContact CE1-CZ2 4.04Å; F229-W613 HydrophobicContact CE1-CZ3 4.32Å; F229-W613 HydrophobicContact CE2-CH2 4.05Å; F229-W613 HydrophobicContact CE2-CZ2 4.41Å; F229-W613 AromaticContact CZ-CH2 3.16Å; F229-W613 HydrophobicContact CZ-CH2 3.16Å; F229-W613 AromaticContact CZ-CZ2 3.5Å; F229-W613 HydrophobicContact CZ-CZ2 3.5Å; F229-W613 VanDerWaalsContact CZ-CZ2 3.5Å; F229-W613 HydrophobicContact CZ-CZ3 4.18Å; S609-W613 WeakPolarHBondContact O-CB 3.18Å; S609-W613 PolarHBondContact O-N 3.09Å; L610-W613 CarbonylContact O-C 3.54Å; L610-W613 WeakPolarHBondContact O-CB 3.49Å; L610-W613 PolarHBondContact O-N 3.44Å; L610-W613 VanDerWaalsContact O-N 3.13Å; S611-W613 VanDerWaalsContact C-N 3.31Å; W613-R616 PolarHBondContact O-N 2.85Å; W613-R617 HydrophobicContact CE3-CG 4.18Å; W613-R617 HydrophobicContact CH2-CG 3.92Å; W613-R617 VanDerWaalsContact CH2-NE 3.26Å; W613-R617 HydrophobicContact CZ2-CG 4.49Å; W613-R617 HydrophobicContact CZ3-CG 3.77Å; W613-R617 WeakPolarHBondContact O-CG 3.43Å
614	E	43.9	Very low	41.3	Very low	82 Å²	82	81.7 Å²	81.7	38%	0.383	41%	0.407	S	S	.	.	H	α-helix	trans	-61.9	-45.6	172.6	-72.2	171.7	157.7	0	0	110.6	L228 L610 S611 R616 R617	L228-E614 HydrophobicContact CD2-CG 3.32Å; L610-E614 WeakPolarHBondContact O-CG 3.4Å; L610-E614 PolarHBondContact O-N 3.01Å; S611-E614 PolarHBondContact O-N 3.44Å; E614-R616 VanDerWaalsContact C-N 3.25Å; E614-R616 PolarHBondContact O-N 2.88Å; E614-R617 WeakPolarHBondContact O-CB 3.42Å; E614-R617 PolarHBondContact O-N 3.22Å
615	Q	38.5	Very low	41.6	Very low	126 Å²	126	84.4 Å²	84.4	59%	0.589	42%	0.42	S	S	*	.	H	α-helix	trans	-61.9	-30.3	178.2	-74	168.3	-6.8	0	0	113.3	S611 R617	S611-Q615 VanDerWaalsContact O-CG 3.26Å; S611-Q615 WeakPolarHBondContact O-CG 3.4Å; S611-Q615 PolarHBondContact O-N 3.17Å; Q615-R617 PolarHBondContact O-N 2.93Å
616	R	41.2	Very low	41.8	Very low	160 Å²	160	85.8 Å²	85.8	60%	0.604	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	4.7	175.1	-68.5	169.2	-175.2	-157.2	0.5	113.6	E560 L612 W613 E614	E560-R616 IonicContact OE1-NH1 3.15Å; E560-R616 PolarHBondContact OE1-NH1 2.81Å; L612-R616 VanDerWaalsContact O-CG 3.28Å; L612-R616 WeakPolarHBondContact O-CG 3.41Å; L612-R616 PolarHBondContact O-N 2.96Å; W613-R616 PolarHBondContact O-N 2.85Å; E614-R616 VanDerWaalsContact C-N 3.25Å; E614-R616 PolarHBondContact O-N 2.88Å
617	R	47.2	Very low	42.4	Very low	36 Å²	36	85.2 Å²	85.2	14%	0.136	42%	0.423	C	S	.	.	S	Bend	trans	-126.1	86.7	-176.5	-66.2	-78	-147.9	167.7	7.3	111	S563 L571 W613 E614 Q615	S563-R617 PolarHBondContact O-NH1 3.36Å; S563-R617 PolarHBondContact O-NH2 2.94Å; L571-R617 VanDerWaalsContact CD1-NH2 3.34Å; W613-R617 HydrophobicContact CE3-CG 4.18Å; W613-R617 HydrophobicContact CH2-CG 3.92Å; W613-R617 VanDerWaalsContact CH2-NE 3.26Å; W613-R617 HydrophobicContact CZ2-CG 4.49Å; W613-R617 HydrophobicContact CZ3-CG 3.77Å; W613-R617 WeakPolarHBondContact O-CG 3.43Å; E614-R617 WeakPolarHBondContact O-CB 3.42Å; E614-R617 PolarHBondContact O-N 3.22Å; Q615-R617 PolarHBondContact O-N 2.93Å
618	L	33.7	Very low	43.1	Very low	122 Å²	122	79.7 Å²	79.7	64%	0.639	41%	0.405	S	S	*	.			trans	-46.7	145.9	176.1	-63.7	166.1	0	0	0	114.2
619	P	33.5	Very low	43.7	Very low	105 Å²	105	82.7 Å²	82.7	68%	0.682	42%	0.416	S	S	*	.				-95.5	-166.9	-65.4	39	-30.6	0	0	0	109.7	T621	P619-T621 PolarHBondContact O-N 2.87Å
620	A	34.3	Very low	44.8	Very low	91 Å²	91	81.9 Å²	81.9	75%	0.752	41%	0.411	S	S	*	.			trans	-65.9	89.6	174.9	0	0	0	0	0	112.5
621	T	32.6	Very low	45.7	Very low	74 Å²	74	81 Å²	81	45%	0.454	41%	0.408	S	S	.	.			trans	-64.5	134.4	172.2	54.2	0	0	0	0	110.5	P619 C623	P619-T621 PolarHBondContact O-N 2.87Å; T621-C623 PolarHBondContact O-N 2.72Å
622	H	37.8	Very low	47	Very low	156 Å²	156	80.1 Å²	80.1	72%	0.722	40%	0.398	S	S	*	.	S	Bend	trans	-68.9	21.4	-170	-66.2	-93.3	0	0	0	115.8	F624 Q625	H622-F624 PolarHBondContact O-N 3.47Å; H622-Q625 WeakPolarHBondContact O-CG 3.42Å; H622-Q625 PolarHBondContact O-N 2.63Å
623	C	40.3	Very low	48.3	Very low	44 Å²	44	79.8 Å²	79.8	30%	0.297	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-70.7	4.3	-170.7	-57.9	0	0	0	0	115.5	P230 T621 Q625	P230-C623 HydrophobicContact CB-CB 3.64Å; T621-C623 PolarHBondContact O-N 2.72Å; C623-Q625 PolarHBondContact O-N 3.36Å
624	F	42	Very low	49.4	Very low	125 Å²	125	79.8 Å²	79.8	55%	0.548	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-69.8	-17	168.5	-67.6	-72.3	0	0	0	113	P230 H622 H626 L627	P230-F624 HydrophobicContact CG-CE2 4.42Å; P230-F624 HydrophobicContact CG-CZ 4.32Å; H622-F624 PolarHBondContact O-N 3.47Å; F624-H626 PolarHBondContact O-N 3.39Å; F624-L627 HydrophobicContact CD1-CD1 4.13Å; F624-L627 PolarHBondContact O-N 3.02Å
625	Q	47.8	Very low	50	Low	136 Å²	136	80.2 Å²	80.2	64%	0.636	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-59	-6	177.4	-71.4	-178.2	-1.1	0	0	115.4	H622 C623 H691	H622-Q625 WeakPolarHBondContact O-CG 3.42Å; H622-Q625 PolarHBondContact O-N 2.63Å; C623-Q625 PolarHBondContact O-N 3.36Å; Q625-H691 PolarHBondContact O-CE1 2.9Å; Q625-H691 PolarHBondContact O-ND1 2.95Å; Q625-H691 VanDerWaalsContact O-ND1 3.13Å
626	H	52.3	Low	50.4	Low	49 Å²	49	79.4 Å²	79.4	23%	0.227	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-116.1	8.5	178.7	-53.3	-27.9	0	0	0	113	F624 V646	F624-H626 PolarHBondContact O-N 3.39Å; H626-V646 PolarHBondContact O-N 3.47Å
627	L	56.6	Low	50.7	Low	31 Å²	31	75.7 Å²	75.7	16%	0.162	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	107	-171.5	-55.3	-176	0	0	0	111.4	F225 F624 T643 L644 A645	F225-L627 HydrophobicContact CD1-CD1 3.7Å; F225-L627 HydrophobicContact CD2-CD1 4.49Å; F225-L627 HydrophobicContact CE1-CD1 3.5Å; F225-L627 HydrophobicContact CE1-CD2 3.79Å; F225-L627 HydrophobicContact CE1-CG 4.33Å; F225-L627 HydrophobicContact CE2-CD1 4.32Å; F225-L627 HydrophobicContact CE2-CD2 3.75Å; F225-L627 HydrophobicContact CG-CD1 4.21Å; F225-L627 HydrophobicContact CZ-CD1 3.84Å; F225-L627 HydrophobicContact CZ-CD2 3.28Å; F225-L627 HydrophobicContact CZ-CG 4.23Å; F624-L627 HydrophobicContact CD1-CD1 4.13Å; F624-L627 PolarHBondContact O-N 3.02Å; L627-T643 HydrophobicContact CB-CG2 4.3Å; L627-L644 WeakPolarHBondContact CA-O 3.24Å; L627-A645 HydrophobicContact CD2-CB 4.08Å
628	L	58.1	Low	51.1	Low	34 Å²	34	75.8 Å²	75.8	18%	0.178	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.8	177.4	-63.6	-178.6	0	0	0	110.6	L644 V646 L655 A690 L699	L628-L644 PolarHBondContact N-O 3.36Å; L628-L644 PolarHBondContact O-N 3.35Å; L628-V646 HydrophobicContact CB-CG2 4.1Å; L628-V646 HydrophobicContact CD1-CG1 4.48Å; L628-V646 HydrophobicContact CD1-CG2 4.16Å; L628-V646 HydrophobicContact CG-CG2 4.18Å; L628-L655 HydrophobicContact CD1-CD2 3.77Å; L628-A690 HydrophobicContact CD1-CB 3.84Å; L628-L699 HydrophobicContact CB-CD1 4.1Å; L628-L699 HydrophobicContact CD1-CD1 4.06Å; L628-L699 HydrophobicContact CD2-CD1 4.38Å; L628-L699 HydrophobicContact CG-CD1 4.42Å
629	R	57.3	Low	51.9	Low	163 Å²	163	74.6 Å²	74.6	62%	0.615	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	115.9	171.8	-173.4	-180	177.1	-154.9	-2.2	109.2	S641	R629-S641 PolarHBondContact NE-OG 2.77Å; R629-S641 PolarHBondContact NH2-OG 2.82Å
630	V	65.9	Low	52.8	Low	0 Å²	0	72.5 Å²	72.5	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	128.8	177.8	179.4	0	0	0	0	109.2	S641 K642 L644 F663 L673 L699	V630-S641 CarbonylContact O-C 3.6Å; V630-S641 WeakPolarHBondContact O-CA 3.25Å; V630-K642 PolarHBondContact N-O 3.14Å; V630-K642 PolarHBondContact O-N 3.34Å; V630-L644 HydrophobicContact CB-CD1 3.92Å; V630-L644 HydrophobicContact CG2-CD1 3.64Å; V630-L644 HydrophobicContact CG2-CG 4.35Å; V630-F663 HydrophobicContact CG1-CE2 4.24Å; V630-L673 HydrophobicContact CG1-CD2 3.81Å; V630-L673 HydrophobicContact CG2-CD2 4.28Å; V630-L699 CarbonylContact C-O 3.56Å; V630-L699 WeakPolarHBondContact CA-O 3.42Å; V630-L699 HydrophobicContact CB-CB 4.5Å; V630-L699 HydrophobicContact CG2-CB 3.98Å; V630-L699 HydrophobicContact CG2-CD1 4.25Å
631	A	66.3	Low	53.6	Low	17 Å²	17	70.4 Å²	70.4	14%	0.14	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	144.1	164.6	0	0	0	0	0	109.9	T640 L699 V700 Y701	A631-T640 CarbonylContact C-O 3.59Å; A631-T640 VanDerWaalsContact CA-O 3.24Å; A631-T640 WeakPolarHBondContact CA-O 3.29Å; A631-L699 PolarHBondContact N-O 3.08Å; A631-V700 HydrophobicContact CB-CG2 4.35Å; A631-V700 CarbonylContact O-C 3.57Å; A631-V700 WeakPolarHBondContact O-CA 3.37Å; A631-Y701 PolarHBondContact O-N 3.3Å
632	Y	71.9	Confident	54.4	Low	25 Å²	25	69.1 Å²	69.1	10%	0.098	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	126.1	168.4	170.3	-116.3	0	0	0	108.6	D634 C639 T640 F663 V665 F671 Y701	Y632-D634 HydrophobicContact CD1-CB 4.33Å; Y632-D634 HydrophobicContact CE1-CB 3.7Å; Y632-C639 WeakPolarHBondContact O-CA 3.22Å; Y632-T640 PolarHBondContact N-O 2.94Å; Y632-T640 PolarHBondContact O-N 2.8Å; Y632-F663 HydrophobicContact CD1-CB 4.13Å; Y632-F663 AromaticContact CD1-CD1 3.72Å; Y632-F663 HydrophobicContact CD1-CD1 3.72Å; Y632-F663 HydrophobicContact CD1-CE1 4.41Å; Y632-F663 HydrophobicContact CD1-CG 4.1Å; Y632-F663 HydrophobicContact CD2-CB 4.18Å; Y632-F663 HydrophobicContact CD2-CD1 4.45Å; Y632-F663 HydrophobicContact CD2-CD2 4.5Å; Y632-F663 HydrophobicContact CD2-CG 4.15Å; Y632-F663 HydrophobicContact CE1-CB 4.43Å; Y632-F663 HydrophobicContact CE2-CB 4.46Å; Y632-F663 HydrophobicContact CG-CB 4Å; Y632-F663 AromaticContact CG-CD1 3.56Å; Y632-F663 HydrophobicContact CG-CD1 3.56Å; Y632-F663 HydrophobicContact CG-CD2 4.29Å; Y632-F663 HydrophobicContact CG-CE1 4.05Å; Y632-F663 AromaticContact CG-CG 3.7Å; Y632-F663 HydrophobicContact CG-CG 3.7Å; Y632-V665 HydrophobicContact CD2-CG2 4.38Å; Y632-V665 HydrophobicContact CE2-CG2 3.55Å; Y632-F671 HydrophobicContact CD2-CE1 4.48Å; Y632-F671 AromaticContact CE2-CD1 3.81Å; Y632-F671 HydrophobicContact CE2-CD1 3.81Å; Y632-F671 AromaticContact CE2-CE1 3.52Å; Y632-F671 HydrophobicContact CE2-CE1 3.52Å; Y632-F671 HydrophobicContact CE2-CZ 4.34Å; Y632-Y701 WeakPolarHBondContact CA-O 3.34Å; Y632-Y701 AromaticContact CD2-CD1 3.76Å; Y632-Y701 HydrophobicContact CD2-CD1 3.76Å; Y632-Y701 HydrophobicContact CD2-CG 4.5Å; Y632-Y701 WeakPolarHBondContact CD2-O 3.19Å; Y632-Y701 HydrophobicContact CE2-CD1 4.23Å
633	Q	69.1	Low	55.1	Low	66 Å²	66	64 Å²	64	31%	0.308	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	101.8	177.9	-169.8	176.2	13.3	0	0	108.3	V700 Y701 R702	Q633-V700 HydrophobicContact CB-CG1 4.1Å; Q633-Y701 PolarHBondContact N-O 2.94Å; Q633-R702 HydrophobicContact CB-CB 3.98Å
634	D	66.6	Low	55.9	Low	33 Å²	33	62 Å²	62	18%	0.176	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	124.7	172.9	-174.3	-24.1	0	0	0	108.8	Y632 S636 S637 G638	Y632-D634 HydrophobicContact CD1-CB 4.33Å; Y632-D634 HydrophobicContact CE1-CB 3.7Å; D634-S636 PolarHBondContact O-N 2.84Å; D634-S636 WeakPolarHBondContact OD1-CB 3.45Å; D634-S636 PolarHBondContact OD1-N 2.87Å; D634-S636 PolarHBondContact OD1-OG 2.85Å; D634-S636 PolarHBondContact OD2-OG 2.84Å; D634-S637 VanDerWaalsContact CB-OG 3.26Å; D634-S637 WeakPolarHBondContact CB-OG 3.42Å; D634-S637 PolarHBondContact OD1-N 2.92Å; D634-S637 WeakPolarHBondContact OD2-CB 3.35Å; D634-S637 PolarHBondContact OD2-OG 2.61Å; D634-G638 PolarHBondContact N-O 2.8Å; D634-G638 PolarHBondContact O-N 2.92Å; D634-G638 VanDerWaalsContact O-N 3.15Å
635	P	57.4	Low	56.7	Low	91 Å²	91	58.3 Å²	58.3	59%	0.591	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-18.5	173.9	-25.6	35.3	0	0	0	115
636	S	47.2	Very low	57.4	Low	109 Å²	109	52 Å²	52	76%	0.762	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-28.7	-175.2	69.8	0	0	0	0	115.3	D634	D634-S636 PolarHBondContact O-N 2.84Å; D634-S636 WeakPolarHBondContact OD1-CB 3.45Å; D634-S636 PolarHBondContact OD1-N 2.87Å; D634-S636 PolarHBondContact OD1-OG 2.85Å; D634-S636 PolarHBondContact OD2-OG 2.84Å
637	S	46.9	Very low	57.8	Low	82 Å²	82	53 Å²	53	57%	0.573	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	1.8	-174.7	75	0	0	0	0	115.4	D634	D634-S637 VanDerWaalsContact CB-OG 3.26Å; D634-S637 WeakPolarHBondContact CB-OG 3.42Å; D634-S637 PolarHBondContact OD1-N 2.92Å; D634-S637 WeakPolarHBondContact OD2-CB 3.35Å; D634-S637 PolarHBondContact OD2-OG 2.61Å
638	G	55.8	Low	57.8	Low	38 Å²	38	55.3 Å²	55.3	39%	0.392	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	88.6	-145.9	174.4	0	0	0	0	0	113.9	D634	D634-G638 PolarHBondContact N-O 2.8Å; D634-G638 PolarHBondContact O-N 2.92Å; D634-G638 VanDerWaalsContact O-N 3.15Å
639	C	49.8	Very low	58.2	Low	97 Å²	97	61.6 Å²	61.6	66%	0.655	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	119.6	-172.5	-169.9	0	0	0	0	111.9	Y632	Y632-C639 WeakPolarHBondContact O-CA 3.22Å
640	T	52	Low	59.1	Low	62 Å²	62	54.3 Å²	54.3	38%	0.38	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	167.4	169.6	64.8	0	0	0	0	109.9	A631 Y632	A631-T640 CarbonylContact C-O 3.59Å; A631-T640 VanDerWaalsContact CA-O 3.24Å; A631-T640 WeakPolarHBondContact CA-O 3.29Å; Y632-T640 PolarHBondContact N-O 2.94Å; Y632-T640 PolarHBondContact O-N 2.8Å
641	S	50.9	Low	60	Low	47 Å²	47	55.6 Å²	55.6	33%	0.329	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	146.4	175.3	75.5	0	0	0	0	112.7	R629 V630	R629-S641 PolarHBondContact NE-OG 2.77Å; R629-S641 PolarHBondContact NH2-OG 2.82Å; V630-S641 CarbonylContact O-C 3.6Å; V630-S641 WeakPolarHBondContact O-CA 3.25Å
642	K	50.2	Low	60.8	Low	47 Å²	47	54.8 Å²	54.8	20%	0.204	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	134.9	178.3	-60.2	-175.3	-175.2	-169.4	0	109.8	L222 V630 L644 K662 F663	L222-K642 HydrophobicContact CD1-CD 4.23Å; L222-K642 HydrophobicContact CD1-CG 4.07Å; L222-K642 HydrophobicContact CD2-CB 3.81Å; L222-K642 HydrophobicContact CD2-CD 4.31Å; L222-K642 HydrophobicContact CD2-CG 3.78Å; L222-K642 HydrophobicContact CG-CB 4.44Å; L222-K642 HydrophobicContact CG-CD 3.98Å; L222-K642 HydrophobicContact CG-CG 3.94Å; V630-K642 PolarHBondContact N-O 3.14Å; V630-K642 PolarHBondContact O-N 3.34Å; K642-L644 HydrophobicContact CB-CD2 4.06Å; K642-K662 PolarHBondContact NZ-O 3.43Å; K642-F663 HydrophobicContact CB-CE1 4.03Å; K642-F663 HydrophobicContact CB-CZ 3.7Å; K642-F663 HydrophobicContact CD-CD1 3.71Å; K642-F663 HydrophobicContact CD-CE1 3.41Å; K642-F663 VanDerWaalsContact CD-CE1 3.41Å; K642-F663 HydrophobicContact CD-CG 4.41Å; K642-F663 HydrophobicContact CD-CZ 3.86Å; K642-F663 HydrophobicContact CG-CD1 4.23Å; K642-F663 HydrophobicContact CG-CE1 3.4Å; K642-F663 VanDerWaalsContact CG-CE1 3.4Å; K642-F663 HydrophobicContact CG-CZ 3.65Å
643	T	53.5	Low	61.3	Low	49 Å²	49	55.9 Å²	55.9	30%	0.301	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	124.9	168.1	-54	0	0	0	0	108.7	F225 L627	F225-T643 HydrophobicContact CD2-CG2 3.93Å; F225-T643 HydrophobicContact CE2-CG2 4.35Å; L627-T643 HydrophobicContact CB-CG2 4.3Å
644	L	55.7	Low	61.9	Low	0 Å²	0	55.6 Å²	55.6	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.7	-175.7	-53.7	-177.1	0	0	0	108.6	L627 L628 V630 K642 V646 L655 L658 C659 K662	L627-L644 WeakPolarHBondContact CA-O 3.24Å; L628-L644 PolarHBondContact N-O 3.36Å; L628-L644 PolarHBondContact O-N 3.35Å; V630-L644 HydrophobicContact CB-CD1 3.92Å; V630-L644 HydrophobicContact CG2-CD1 3.64Å; V630-L644 HydrophobicContact CG2-CG 4.35Å; K642-L644 HydrophobicContact CB-CD2 4.06Å; L644-V646 HydrophobicContact CB-CG2 4.08Å; L644-L655 HydrophobicContact CD1-CD1 4.04Å; L644-L658 HydrophobicContact CB-CD2 3.9Å; L644-L658 HydrophobicContact CD1-CD2 3.76Å; L644-L658 HydrophobicContact CD2-CD2 3.94Å; L644-L658 HydrophobicContact CG-CD2 4.07Å; L644-C659 WeakPolarHBondContact CD1-SG 3.35Å; L644-K662 HydrophobicContact CD2-CB 4.08Å; L644-K662 HydrophobicContact CD2-CD 3.96Å; L644-K662 HydrophobicContact CD2-CG 3.8Å
645	A	59	Low	62.5	Low	48 Å²	48	54.1 Å²	54.1	40%	0.397	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	124	164.5	0	0	0	0	0	108	L627	L627-A645 HydrophobicContact CD2-CB 4.08Å
646	V	62.9	Low	63.8	Low	3 Å²	3	51.2 Å²	51.2	2%	0.018	33%	0.332	C	S	.	.			trans	-123.6	115.3	-169.5	-178.9	0	0	0	0	107.4	H626 L628 L644 A650 L655 A690 H691	H626-V646 PolarHBondContact O-N 3.47Å; L628-V646 HydrophobicContact CB-CG2 4.1Å; L628-V646 HydrophobicContact CD1-CG1 4.48Å; L628-V646 HydrophobicContact CD1-CG2 4.16Å; L628-V646 HydrophobicContact CG-CG2 4.18Å; L644-V646 HydrophobicContact CB-CG2 4.08Å; V646-A650 HydrophobicContact CG1-CB 3.81Å; V646-L655 HydrophobicContact CB-CD1 4.49Å; V646-L655 HydrophobicContact CG1-CD1 4.21Å; V646-L655 HydrophobicContact CG2-CD1 3.45Å; V646-L655 VanDerWaalsContact CG2-CD1 3.45Å; V646-A690 HydrophobicContact CG1-CB 3.78Å; V646-H691 PolarHBondContact O-CE1 3.45Å; V646-H691 VanDerWaalsContact O-CE1 3.28Å; V646-H691 PolarHBondContact O-NE2 2.87Å
647	P	59.8	Low	65.3	Low	71 Å²	71	52.6 Å²	52.6	46%	0.461	33%	0.326	S	S	.	.			trans	-55	150.8	-176.5	-25.6	33.6	0	0	0	112.4	E649 A650 H691	P647-E649 PolarHBondContact O-N 2.74Å; P647-A650 HydrophobicContact CB-CB 4.3Å; P647-A650 WeakPolarHBondContact O-CB 3.24Å; P647-A650 PolarHBondContact O-N 3.22Å; P647-A650 VanDerWaalsContact O-N 3.15Å; P647-H691 PolarHBondContact O-NE2 2.92Å
648	P	57.5	Low	66.7	Low	80 Å²	80	50.7 Å²	50.7	52%	0.519	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.2	141.2	166.8	-26.3	34.9	0	0	0	110.8	A650	P648-A650 PolarHBondContact O-N 3.33Å
649	E	65.7	Low	67.7	Low	165 Å²	165	48.9 Å²	48.9	77%	0.771	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	10.2	-180	-51.6	-176.1	161.1	0	0	116.4	P647 S651 L689	P647-E649 PolarHBondContact O-N 2.74Å; E649-S651 PolarHBondContact O-N 3.39Å; E649-L689 WeakPolarHBondContact O-CD2 3.37Å
650	A	76.3	Confident	69.1	Low	10 Å²	10	44.7 Å²	44.7	8%	0.083	26%	0.264	C	S	.	.			trans	-63.3	136.7	176.1	0	0	0	0	0	112.2	V646 P647 P648 T654 A690	V646-A650 HydrophobicContact CG1-CB 3.81Å; P647-A650 HydrophobicContact CB-CB 4.3Å; P647-A650 WeakPolarHBondContact O-CB 3.24Å; P647-A650 PolarHBondContact O-N 3.22Å; P647-A650 VanDerWaalsContact O-N 3.15Å; P648-A650 PolarHBondContact O-N 3.33Å; A650-T654 HydrophobicContact CB-CG2 4.31Å; A650-A690 WeakPolarHBondContact O-CB 3.48Å; A650-A690 PolarHBondContact O-N 2.98Å
651	S	85.4	Confident	70	Confident	28 Å²	28	45.7 Å²	45.7	20%	0.196	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-82.9	164.7	180	69.4	0	0	0	0	112.8	E649 A653 T654 L655 A688	E649-S651 PolarHBondContact O-N 3.39Å; S651-A653 PolarHBondContact O-N 2.9Å; S651-A653 PolarHBondContact OG-N 2.85Å; S651-T654 WeakPolarHBondContact O-CB 3.42Å; S651-T654 PolarHBondContact O-N 3.03Å; S651-T654 VanDerWaalsContact O-N 3.12Å; S651-T654 PolarHBondContact OG-N 3.49Å; S651-T654 PolarHBondContact OG-OG1 3.45Å; S651-T654 VanDerWaalsContact OG-OG1 3.1Å; S651-L655 PolarHBondContact O-N 2.97Å; S651-A688 CarbonylContact C-O 3.56Å; S651-A688 VanDerWaalsContact CA-O 3.22Å; S651-A688 WeakPolarHBondContact CA-O 3.48Å
652	I	83.8	Confident	70.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-30.2	171.7	-59.8	-53.1	0	0	0	111.6	L655 N656 L673 L684 P685 P686 A688 A690 L693	I652-L655 HydrophobicContact CD1-CD2 4.48Å; I652-L655 PolarHBondContact O-N 3.4Å; I652-N656 WeakPolarHBondContact O-CB 3.33Å; I652-N656 PolarHBondContact O-N 2.96Å; I652-N656 PolarHBondContact O-ND2 2.94Å; I652-L673 HydrophobicContact CG2-CB 4.21Å; I652-L673 HydrophobicContact CG2-CD1 4.17Å; I652-L684 HydrophobicContact CD1-CD1 4.26Å; I652-L684 HydrophobicContact CG1-CB 4.23Å; I652-L684 HydrophobicContact CG2-CB 3.8Å; I652-P685 WeakPolarHBondContact CB-O 3.31Å; I652-P686 PolarHBondContact N-O 3.17Å; I652-A688 HydrophobicContact CG1-CB 3.89Å; I652-A688 WeakPolarHBondContact CG1-O 3.44Å; I652-A688 PolarHBondContact N-O 2.93Å; I652-A690 HydrophobicContact CD1-CB 4.2Å; I652-L693 HydrophobicContact CD1-CD1 3.8Å; I652-L693 HydrophobicContact CD1-CD2 4.04Å; I652-L693 HydrophobicContact CD1-CG 4.22Å
653	A	82.3	Confident	71.7	Confident	47 Å²	47	43.9 Å²	43.9	39%	0.388	26%	0.256	S	S	.	.	H	α-helix	trans	-61.6	-47.9	170.1	0	0	0	0	0	111.7	S651 L655 N656 Q657 P686	S651-A653 PolarHBondContact O-N 2.9Å; S651-A653 PolarHBondContact OG-N 2.85Å; A653-L655 VanDerWaalsContact C-N 3.31Å; A653-L655 PolarHBondContact O-N 3.49Å; A653-N656 PolarHBondContact O-N 3.38Å; A653-Q657 PolarHBondContact O-N 2.96Å; A653-Q657 VanDerWaalsContact O-N 3.09Å; A653-P686 HydrophobicContact CB-CB 4.06Å; A653-P686 PolarHBondContact N-O 2.86Å
654	T	80.3	Confident	72.5	Confident	60 Å²	60	49.5 Å²	49.5	37%	0.368	27%	0.271	S	S	.	.	H	α-helix	trans	-60.5	-41.3	174.3	-51.8	0	0	0	0	111.4	A650 S651 Q657 L658	A650-T654 HydrophobicContact CB-CG2 4.31Å; S651-T654 WeakPolarHBondContact O-CB 3.42Å; S651-T654 PolarHBondContact O-N 3.03Å; S651-T654 VanDerWaalsContact O-N 3.12Å; S651-T654 PolarHBondContact OG-N 3.49Å; S651-T654 PolarHBondContact OG-OG1 3.45Å; S651-T654 VanDerWaalsContact OG-OG1 3.1Å; T654-Q657 PolarHBondContact O-N 3.17Å; T654-L658 VanDerWaalsContact O-CB 3.3Å; T654-L658 WeakPolarHBondContact O-CB 3.44Å; T654-L658 PolarHBondContact O-N 3.06Å
655	L	80.1	Confident	73.5	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-68	-37.3	178.2	-167.8	57.7	0	0	0	112.3	L628 L644 V646 S651 I652 A653 L658 C659 L673 A690	L628-L655 HydrophobicContact CD1-CD2 3.77Å; L644-L655 HydrophobicContact CD1-CD1 4.04Å; V646-L655 HydrophobicContact CB-CD1 4.49Å; V646-L655 HydrophobicContact CG1-CD1 4.21Å; V646-L655 HydrophobicContact CG2-CD1 3.45Å; V646-L655 VanDerWaalsContact CG2-CD1 3.45Å; S651-L655 PolarHBondContact O-N 2.97Å; I652-L655 HydrophobicContact CD1-CD2 4.48Å; I652-L655 PolarHBondContact O-N 3.4Å; A653-L655 VanDerWaalsContact C-N 3.31Å; A653-L655 PolarHBondContact O-N 3.49Å; L655-L658 PolarHBondContact O-N 2.98Å; L655-C659 WeakPolarHBondContact O-CB 3.42Å; L655-C659 PolarHBondContact O-N 2.65Å; L655-C659 PolarHBondContact O-SG 3.2Å; L655-L673 HydrophobicContact CB-CD1 3.7Å; L655-L673 HydrophobicContact CD2-CD1 3.86Å; L655-L673 HydrophobicContact CG-CD1 3.56Å; L655-A690 HydrophobicContact CD2-CB 4.01Å
656	N	84.7	Confident	74.1	Confident	30 Å²	30	54.5 Å²	54.5	16%	0.16	30%	0.297	C	S	.	.	H	α-helix	trans	-61.1	-47.9	173.3	-84.1	-60.1	0	0	0	111.4	I652 A653 L658 C659 A660 G672 L673 Y701	I652-N656 WeakPolarHBondContact O-CB 3.33Å; I652-N656 PolarHBondContact O-N 2.96Å; I652-N656 PolarHBondContact O-ND2 2.94Å; A653-N656 PolarHBondContact O-N 3.38Å; N656-L658 VanDerWaalsContact C-N 3.29Å; N656-L658 PolarHBondContact O-N 3.01Å; N656-C659 WeakPolarHBondContact O-CB 3.27Å; N656-C659 PolarHBondContact O-N 3.38Å; N656-A660 PolarHBondContact O-N 3.29Å; N656-G672 WeakPolarHBondContact OD1-CA 3.3Å; N656-L673 HydrophobicContact CB-CD1 4.35Å; N656-L673 WeakPolarHBondContact OD1-CG 3.49Å; N656-L673 PolarHBondContact OD1-N 3.35Å; N656-Y701 WeakPolarHBondContact OD1-CE2 3.49Å
657	Q	79.6	Confident	74.7	Confident	138 Å²	138	60.2 Å²	60.2	65%	0.645	32%	0.324	S	S	*	.	H	α-helix	trans	-62.8	-38.2	177.3	-170.2	-177.1	15.9	0	0	111.7	A653 T654 T661	A653-Q657 PolarHBondContact O-N 2.96Å; A653-Q657 VanDerWaalsContact O-N 3.09Å; T654-Q657 PolarHBondContact O-N 3.17Å; Q657-T661 WeakPolarHBondContact O-CB 3.28Å; Q657-T661 PolarHBondContact O-N 3.13Å; Q657-T661 VanDerWaalsContact O-N 3.09Å; Q657-T661 PolarHBondContact O-OG1 2.82Å
658	L	74.9	Confident	75.3	Confident	42 Å²	42	59.6 Å²	59.6	22%	0.22	32%	0.32	C	S	.	.	H	α-helix	trans	-66.8	-41.4	174.9	-166.7	150.3	0	0	0	110.8	L644 T654 L655 N656 T661 K662	L644-L658 HydrophobicContact CB-CD2 3.9Å; L644-L658 HydrophobicContact CD1-CD2 3.76Å; L644-L658 HydrophobicContact CD2-CD2 3.94Å; L644-L658 HydrophobicContact CG-CD2 4.07Å; T654-L658 VanDerWaalsContact O-CB 3.3Å; T654-L658 WeakPolarHBondContact O-CB 3.44Å; T654-L658 PolarHBondContact O-N 3.06Å; L655-L658 PolarHBondContact O-N 2.98Å; N656-L658 VanDerWaalsContact C-N 3.29Å; N656-L658 PolarHBondContact O-N 3.01Å; L658-T661 PolarHBondContact O-N 3.29Å; L658-K662 HydrophobicContact CD2-CG 3.85Å; L658-K662 HydrophobicContact CG-CG 4.48Å; L658-K662 WeakPolarHBondContact O-CB 3.45Å; L658-K662 WeakPolarHBondContact O-CG 3.29Å; L658-K662 PolarHBondContact O-N 2.92Å
659	C	77.1	Confident	76.3	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-60.2	-52.9	172.6	-72.4	0	0	0	0	111.9	L644 L655 N656 T661 K662 F663 Y701	L644-C659 WeakPolarHBondContact CD1-SG 3.35Å; L655-C659 WeakPolarHBondContact O-CB 3.42Å; L655-C659 PolarHBondContact O-N 2.65Å; L655-C659 PolarHBondContact O-SG 3.2Å; N656-C659 WeakPolarHBondContact O-CB 3.27Å; N656-C659 PolarHBondContact O-N 3.38Å; C659-T661 VanDerWaalsContact C-N 3.29Å; C659-T661 PolarHBondContact O-N 3.42Å; C659-K662 PolarHBondContact O-N 2.74Å; C659-F663 HydrophobicContact CB-CD2 4.18Å; C659-F663 HydrophobicContact CB-CE2 4.44Å; C659-F663 WeakPolarHBondContact O-CB 3.27Å; C659-F663 VanDerWaalsContact O-CD2 3.24Å; C659-F663 WeakPolarHBondContact O-CD2 3.21Å; C659-F663 PolarHBondContact O-N 3.08Å; C659-Y701 HydrophobicContact CB-CD1 3.6Å; C659-Y701 HydrophobicContact CB-CD2 3.94Å; C659-Y701 HydrophobicContact CB-CE1 3.74Å; C659-Y701 HydrophobicContact CB-CE2 4.1Å; C659-Y701 HydrophobicContact CB-CG 3.71Å
660	A	79.5	Confident	76.9	Confident	10 Å²	10	58 Å²	58	8%	0.083	31%	0.314	C	S	.	.	H	α-helix	trans	-48.7	-51.7	175.3	0	0	0	0	0	112.1	N656 K662 F663 R664 V665 P668 Y701	N656-A660 PolarHBondContact O-N 3.29Å; A660-K662 VanDerWaalsContact C-N 3.34Å; A660-K662 PolarHBondContact O-N 2.76Å; A660-F663 PolarHBondContact O-N 3Å; A660-R664 WeakPolarHBondContact O-CA 3.45Å; A660-R664 PolarHBondContact O-N 3.46Å; A660-V665 PolarHBondContact O-N 2.82Å; A660-V665 VanDerWaalsContact O-N 3.13Å; A660-P668 HydrophobicContact CB-CB 3.66Å; A660-Y701 WeakPolarHBondContact CB-OH 3.48Å
661	T	71.4	Confident	77.1	Confident	83 Å²	83	58.8 Å²	58.8	51%	0.509	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-39.9	178.9	-51.5	0	0	0	0	112.1	Q657 L658 C659	Q657-T661 WeakPolarHBondContact O-CB 3.28Å; Q657-T661 PolarHBondContact O-N 3.13Å; Q657-T661 VanDerWaalsContact O-N 3.09Å; Q657-T661 PolarHBondContact O-OG1 2.82Å; L658-T661 PolarHBondContact O-N 3.29Å; C659-T661 VanDerWaalsContact C-N 3.29Å; C659-T661 PolarHBondContact O-N 3.42Å
662	K	67.2	Low	77.1	Confident	37 Å²	37	57.6 Å²	57.6	16%	0.161	31%	0.308	C	S	.	.	H	α-helix	trans	-77.6	-30.8	-176.9	-74.9	-85	-179	174.7	0	113.8	A220 A221 K642 L644 L658 C659 A660	A220-K662 WeakPolarHBondContact O-CD 3.3Å; A220-K662 WeakPolarHBondContact O-CE 3.44Å; A220-K662 PolarHBondContact O-NZ 3.09Å; A221-K662 PolarHBondContact O-NZ 3.04Å; K642-K662 PolarHBondContact NZ-O 3.43Å; L644-K662 HydrophobicContact CD2-CB 4.08Å; L644-K662 HydrophobicContact CD2-CD 3.96Å; L644-K662 HydrophobicContact CD2-CG 3.8Å; L658-K662 HydrophobicContact CD2-CG 3.85Å; L658-K662 HydrophobicContact CG-CG 4.48Å; L658-K662 WeakPolarHBondContact O-CB 3.45Å; L658-K662 WeakPolarHBondContact O-CG 3.29Å; L658-K662 PolarHBondContact O-N 2.92Å; C659-K662 PolarHBondContact O-N 2.74Å; A660-K662 VanDerWaalsContact C-N 3.34Å; A660-K662 PolarHBondContact O-N 2.76Å
663	F	69.1	Low	77.2	Confident	18 Å²	18	57.6 Å²	57.6	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-96.1	-4.6	178.2	-68.8	-73.3	0	0	0	113	V630 Y632 K642 C659 A660 V665 Y701	V630-F663 HydrophobicContact CG1-CE2 4.24Å; Y632-F663 HydrophobicContact CD1-CB 4.13Å; Y632-F663 AromaticContact CD1-CD1 3.72Å; Y632-F663 HydrophobicContact CD1-CD1 3.72Å; Y632-F663 HydrophobicContact CD1-CE1 4.41Å; Y632-F663 HydrophobicContact CD1-CG 4.1Å; Y632-F663 HydrophobicContact CD2-CB 4.18Å; Y632-F663 HydrophobicContact CD2-CD1 4.45Å; Y632-F663 HydrophobicContact CD2-CD2 4.5Å; Y632-F663 HydrophobicContact CD2-CG 4.15Å; Y632-F663 HydrophobicContact CE1-CB 4.43Å; Y632-F663 HydrophobicContact CE2-CB 4.46Å; Y632-F663 HydrophobicContact CG-CB 4Å; Y632-F663 AromaticContact CG-CD1 3.56Å; Y632-F663 HydrophobicContact CG-CD1 3.56Å; Y632-F663 HydrophobicContact CG-CD2 4.29Å; Y632-F663 HydrophobicContact CG-CE1 4.05Å; Y632-F663 AromaticContact CG-CG 3.7Å; Y632-F663 HydrophobicContact CG-CG 3.7Å; K642-F663 HydrophobicContact CB-CE1 4.03Å; K642-F663 HydrophobicContact CB-CZ 3.7Å; K642-F663 HydrophobicContact CD-CD1 3.71Å; K642-F663 HydrophobicContact CD-CE1 3.41Å; K642-F663 VanDerWaalsContact CD-CE1 3.41Å; K642-F663 HydrophobicContact CD-CG 4.41Å; K642-F663 HydrophobicContact CD-CZ 3.86Å; K642-F663 HydrophobicContact CG-CD1 4.23Å; K642-F663 HydrophobicContact CG-CE1 3.4Å; K642-F663 VanDerWaalsContact CG-CE1 3.4Å; K642-F663 HydrophobicContact CG-CZ 3.65Å; C659-F663 HydrophobicContact CB-CD2 4.18Å; C659-F663 HydrophobicContact CB-CE2 4.44Å; C659-F663 WeakPolarHBondContact O-CB 3.27Å; C659-F663 VanDerWaalsContact O-CD2 3.24Å; C659-F663 WeakPolarHBondContact O-CD2 3.21Å; C659-F663 PolarHBondContact O-N 3.08Å; A660-F663 PolarHBondContact O-N 3Å; F663-V665 VanDerWaalsContact C-N 3.3Å; F663-V665 HydrophobicContact CB-CG2 3.91Å; F663-Y701 HydrophobicContact CD2-CD1 4.07Å
664	R	70.8	Confident	77.2	Confident	167 Å²	167	56.4 Å²	56.4	63%	0.63	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	38.2	-178	-56.6	-176.9	177.3	-159.2	-1	112.9	D215 A660 T666	D215-R664 IonicContact OD1-CZ 3.73Å; D215-R664 IonicContact OD1-NH2 2.8Å; D215-R664 PolarHBondContact OD1-NH2 3.42Å; D215-R664 IonicContact OD2-CZ 2.7Å; D215-R664 IonicContact OD2-NH2 3.92Å; D215-R664 PolarHBondContact OD2-NH2 3.46Å; A660-R664 WeakPolarHBondContact O-CA 3.45Å; A660-R664 PolarHBondContact O-N 3.46Å; R664-T666 PolarHBondContact O-N 3.4Å
665	V	75.8	Confident	77.2	Confident	16 Å²	16	54.1 Å²	54.1	10%	0.097	28%	0.28	C	S	.	.			trans	-69.6	123.4	-178.6	-179.8	0	0	0	0	110	Y632 A660 F663 Q667 F671 Y701	Y632-V665 HydrophobicContact CD2-CG2 4.38Å; Y632-V665 HydrophobicContact CE2-CG2 3.55Å; A660-V665 PolarHBondContact O-N 2.82Å; A660-V665 VanDerWaalsContact O-N 3.13Å; F663-V665 VanDerWaalsContact C-N 3.3Å; F663-V665 HydrophobicContact CB-CG2 3.91Å; V665-Q667 VanDerWaalsContact C-N 3.34Å; V665-Q667 PolarHBondContact O-N 3.44Å; V665-F671 HydrophobicContact CG1-CD2 3.51Å; V665-F671 HydrophobicContact CG1-CE2 3.7Å; V665-F671 HydrophobicContact CG1-CG 3.99Å; V665-F671 HydrophobicContact CG1-CZ 4.3Å; V665-Y701 HydrophobicContact CG2-CD1 4.46Å; V665-Y701 HydrophobicContact CG2-CE1 3.81Å
666	T	72	Confident	76.8	Confident	137 Å²	137	57.7 Å²	57.7	84%	0.84	29%	0.294	S	S	*	.	S	Bend	trans	-68.9	-29.4	-175.8	48.9	0	0	0	0	113.7	R664	R664-T666 PolarHBondContact O-N 3.4Å
667	Q	74.5	Confident	76.2	Confident	124 Å²	124	59.7 Å²	59.7	58%	0.579	30%	0.301	S	S	*	.			trans	-124.4	76.4	178.6	-67.6	-175.1	-11	0	0	110.1	V665 N669 T670	V665-Q667 VanDerWaalsContact C-N 3.34Å; V665-Q667 PolarHBondContact O-N 3.44Å; Q667-N669 PolarHBondContact O-N 2.69Å; Q667-N669 VanDerWaalsContact O-N 3.13Å; Q667-T670 HydrophobicContact CB-CG2 4.18Å; Q667-T670 PolarHBondContact O-N 3.06Å; Q667-T670 VanDerWaalsContact O-N 3.12Å; Q667-T670 PolarHBondContact O-OG1 3.22Å
668	P	74.2	Confident	75.4	Confident	58 Å²	58	59 Å²	59	38%	0.377	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-56.9	-33.4	-173.6	22.4	-34.8	0	0	0	113.6	A660 T670 F671	A660-P668 HydrophobicContact CB-CB 3.66Å; P668-T670 PolarHBondContact O-N 2.79Å; P668-F671 PolarHBondContact O-N 2.96Å
669	N	77.3	Confident	74.8	Confident	159 Å²	159	65.2 Å²	65.2	85%	0.85	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-69.2	-17.9	-176.9	-59.7	0.5	0	0	0	113.4	Q667	Q667-N669 PolarHBondContact O-N 2.69Å; Q667-N669 VanDerWaalsContact O-N 3.13Å
670	T	78.5	Confident	74.2	Confident	52 Å²	52	66.4 Å²	66.4	32%	0.319	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-90.4	-3.8	177.4	65	0	0	0	0	112.8	Q667 P668 R703 A704	Q667-T670 HydrophobicContact CB-CG2 4.18Å; Q667-T670 PolarHBondContact O-N 3.06Å; Q667-T670 VanDerWaalsContact O-N 3.12Å; Q667-T670 PolarHBondContact O-OG1 3.22Å; P668-T670 PolarHBondContact O-N 2.79Å; T670-R703 CarbonylContact O-C 3.57Å; T670-R703 WeakPolarHBondContact O-CA 3.3Å; T670-R703 VanDerWaalsContact O-CG 3.31Å; T670-R703 WeakPolarHBondContact O-CG 3.42Å; T670-A704 PolarHBondContact O-N 3.15Å
671	F	81.4	Confident	74	Confident	26 Å²	26	70.2 Å²	70.2	11%	0.114	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	145.3	-179	-75.8	-109.4	0	0	0	111.9	Y632 V665 P668 Y701 R702 R703	Y632-F671 HydrophobicContact CD2-CE1 4.48Å; Y632-F671 AromaticContact CE2-CD1 3.81Å; Y632-F671 HydrophobicContact CE2-CD1 3.81Å; Y632-F671 AromaticContact CE2-CE1 3.52Å; Y632-F671 HydrophobicContact CE2-CE1 3.52Å; Y632-F671 HydrophobicContact CE2-CZ 4.34Å; V665-F671 HydrophobicContact CG1-CD2 3.51Å; V665-F671 HydrophobicContact CG1-CE2 3.7Å; V665-F671 HydrophobicContact CG1-CG 3.99Å; V665-F671 HydrophobicContact CG1-CZ 4.3Å; P668-F671 PolarHBondContact O-N 2.96Å; F671-Y701 HydrophobicContact CB-CD2 4.33Å; F671-Y701 HydrophobicContact CB-CE1 3.96Å; F671-Y701 HydrophobicContact CB-CE2 3.64Å; F671-Y701 VanDerWaalsContact CB-CZ 3.41Å; F671-Y701 WeakPolarHBondContact CB-OH 3.32Å; F671-Y701 HydrophobicContact CG-CE1 4.5Å; F671-R702 CarbonylContact C-O 3.54Å; F671-R702 WeakPolarHBondContact CA-O 3.31Å; F671-R703 HydrophobicContact CD1-CB 4.39Å; F671-R703 HydrophobicContact CE1-CB 4.09Å; F671-R703 HydrophobicContact CE2-CB 4.27Å; F671-R703 HydrophobicContact CE2-CG 4.32Å; F671-R703 HydrophobicContact CZ-CB 4.04Å
672	G	85.4	Confident	74.4	Confident	4 Å²	4	71.4 Å²	71.4	4%	0.041	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	157.8	178.2	0	0	0	0	0	112.3	N656 F674 Y701 R702	N656-G672 WeakPolarHBondContact OD1-CA 3.3Å; G672-F674 WeakPolarHBondContact O-CD2 3.22Å; G672-F674 WeakPolarHBondContact O-CE2 3.23Å; G672-Y701 WeakPolarHBondContact O-CA 3.25Å; G672-Y701 WeakPolarHBondContact O-CD2 3.31Å; G672-R702 PolarHBondContact N-O 2.7Å; G672-R702 PolarHBondContact O-N 2.83Å; G672-R702 VanDerWaalsContact O-N 3.08Å
673	L	85.8	Confident	75.1	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	128.3	169	-81	159.5	0	0	0	110.5	V630 I652 L655 N656 L684 Y701	V630-L673 HydrophobicContact CG1-CD2 3.81Å; V630-L673 HydrophobicContact CG2-CD2 4.28Å; I652-L673 HydrophobicContact CG2-CB 4.21Å; I652-L673 HydrophobicContact CG2-CD1 4.17Å; L655-L673 HydrophobicContact CB-CD1 3.7Å; L655-L673 HydrophobicContact CD2-CD1 3.86Å; L655-L673 HydrophobicContact CG-CD1 3.56Å; N656-L673 HydrophobicContact CB-CD1 4.35Å; N656-L673 WeakPolarHBondContact OD1-CG 3.49Å; N656-L673 PolarHBondContact OD1-N 3.35Å; L673-L684 HydrophobicContact CB-CD1 4.45Å; L673-L684 PolarHBondContact O-N 3.29Å; L673-Y701 HydrophobicContact CD2-CD2 4.46Å; L673-Y701 HydrophobicContact CG-CD2 4.07Å
674	F	81.8	Confident	75.8	Confident	22 Å²	22	78 Å²	78	10%	0.096	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	144.7	173.8	-61.5	-106.5	0	0	0	108.7	G672 Y681 H682 R683 V700 R702 A704	G672-F674 WeakPolarHBondContact O-CD2 3.22Å; G672-F674 WeakPolarHBondContact O-CE2 3.23Å; F674-Y681 HydrophobicContact CB-CD1 4.15Å; F674-H682 CarbonylContact C-O 3.6Å; F674-H682 VanDerWaalsContact CA-O 3.22Å; F674-H682 WeakPolarHBondContact CA-O 3.31Å; F674-R683 HydrophobicContact CD1-CB 3.82Å; F674-R683 HydrophobicContact CD1-CG 4.41Å; F674-R683 HydrophobicContact CE1-CB 3.64Å; F674-R683 HydrophobicContact CE1-CG 4.04Å; F674-R683 HydrophobicContact CZ-CB 4.32Å; F674-R683 HydrophobicContact CZ-CG 4.22Å; F674-V700 PolarHBondContact N-O 3.22Å; F674-V700 PolarHBondContact O-N 3.21Å; F674-R702 HydrophobicContact CD2-CG 3.42Å; F674-R702 VanDerWaalsContact CD2-CG 3.42Å; F674-R702 HydrophobicContact CE2-CG 3.51Å; F674-R702 HydrophobicContact CG-CG 4.21Å; F674-R702 HydrophobicContact CZ-CG 4.34Å; F674-A704 HydrophobicContact CZ-CB 4.34Å
675	L	80.6	Confident	76.2	Confident	12 Å²	12	73.8 Å²	73.8	6%	0.063	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	117.1	163.1	-175.3	68.8	0	0	0	107.8	K677 H682 L684 P694 L699	L675-K677 HydrophobicContact CG-CB 4.47Å; L675-H682 PolarHBondContact N-O 3.12Å; L675-H682 PolarHBondContact O-N 3.13Å; L675-L684 HydrophobicContact CB-CD1 4.34Å; L675-L684 HydrophobicContact CB-CD2 3.98Å; L675-L684 HydrophobicContact CB-CG 4.22Å; L675-P694 HydrophobicContact CD2-CB 4.23Å; L675-P694 HydrophobicContact CD2-CG 3.9Å; L675-L699 HydrophobicContact CD1-CD2 3.9Å
676	Y	72.1	Confident	76.2	Confident	77 Å²	77	77 Å²	77	30%	0.302	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	112.2	169.7	-175.9	-103	0	0	0	109.2	Q679 G680 Y681 G697 Y698	Y676-Q679 VanDerWaalsContact CE2-O 3.31Å; Y676-Q679 WeakPolarHBondContact CE2-O 3.5Å; Y676-G680 WeakPolarHBondContact CA-O 3.21Å; Y676-G680 WeakPolarHBondContact CD2-O 3.5Å; Y676-Y681 HydrophobicContact CD2-CD1 4Å; Y676-Y681 AromaticContact CD2-CD2 3.94Å; Y676-Y681 HydrophobicContact CD2-CD2 3.94Å; Y676-Y681 AromaticContact CD2-CE1 3.81Å; Y676-Y681 HydrophobicContact CD2-CE1 3.81Å; Y676-Y681 AromaticContact CD2-CE2 3.74Å; Y676-Y681 HydrophobicContact CD2-CE2 3.74Å; Y676-Y681 HydrophobicContact CD2-CG 4.06Å; Y676-Y681 AromaticContact CD2-CZ 3.66Å; Y676-Y681 HydrophobicContact CE2-CD2 4.22Å; Y676-Y681 AromaticContact CE2-CE2 3.83Å; Y676-Y681 HydrophobicContact CE2-CE2 3.83Å; Y676-Y681 HydrophobicContact CG-CE1 4.38Å; Y676-G697 CarbonylContact O-C 3.49Å; Y676-G697 VanDerWaalsContact O-CA 3.24Å; Y676-G697 WeakPolarHBondContact O-CA 3.19Å; Y676-Y698 HydrophobicContact CD1-CD2 4.27Å; Y676-Y698 PolarHBondContact N-O 2.8Å; Y676-Y698 PolarHBondContact O-N 3.02Å
677	K	71.9	Confident	76.4	Confident	71 Å²	71	73.6 Å²	73.6	31%	0.309	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	150	-179	-163.3	-165	173.1	-113.4	0	108.1	L675 Q679 G680 T696	L675-K677 HydrophobicContact CG-CB 4.47Å; K677-Q679 PolarHBondContact O-N 3.44Å; K677-G680 PolarHBondContact N-O 3.37Å; K677-G680 PolarHBondContact O-N 2.89Å; K677-G680 VanDerWaalsContact O-O 3.13Å; K677-T696 WeakPolarHBondContact CD-O 3.37Å; K677-T696 WeakPolarHBondContact CE-OG1 3.31Å; K677-T696 WeakPolarHBondContact CG-O 3.31Å
678	D	61.9	Low	76.6	Confident	125 Å²	125	69.3 Å²	69.3	67%	0.668	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	35.8	173.1	-48.6	-30.9	0	0	0	113.7	G680	D678-G680 PolarHBondContact O-N 3.29Å
679	Q	61.7	Low	76.9	Confident	171 Å²	171	69 Å²	69	80%	0.799	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	-3.9	-173.3	-51.2	-173.2	24.6	0	0	116.8	Y676 K677	Y676-Q679 VanDerWaalsContact CE2-O 3.31Å; Y676-Q679 WeakPolarHBondContact CE2-O 3.5Å; K677-Q679 PolarHBondContact O-N 3.44Å
680	G	64.5	Low	76.5	Confident	25 Å²	25	61.5 Å²	61.5	26%	0.258	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	164.3	177.2	0	0	0	0	0	115.1	Y676 K677 D678	Y676-G680 WeakPolarHBondContact CA-O 3.21Å; Y676-G680 WeakPolarHBondContact CD2-O 3.5Å; K677-G680 PolarHBondContact N-O 3.37Å; K677-G680 PolarHBondContact O-N 2.89Å; K677-G680 VanDerWaalsContact O-O 3.13Å; D678-G680 PolarHBondContact O-N 3.29Å
681	Y	76.4	Confident	75.9	Confident	91 Å²	91	62.1 Å²	62.1	36%	0.357	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	104.4	172.7	-74.3	-89.6	0	0	0	110.5	F674 Y676 V700	F674-Y681 HydrophobicContact CB-CD1 4.15Å; Y676-Y681 HydrophobicContact CD2-CD1 4Å; Y676-Y681 AromaticContact CD2-CD2 3.94Å; Y676-Y681 HydrophobicContact CD2-CD2 3.94Å; Y676-Y681 AromaticContact CD2-CE1 3.81Å; Y676-Y681 HydrophobicContact CD2-CE1 3.81Å; Y676-Y681 AromaticContact CD2-CE2 3.74Å; Y676-Y681 HydrophobicContact CD2-CE2 3.74Å; Y676-Y681 HydrophobicContact CD2-CG 4.06Å; Y676-Y681 AromaticContact CD2-CZ 3.66Å; Y676-Y681 HydrophobicContact CE2-CD2 4.22Å; Y676-Y681 AromaticContact CE2-CE2 3.83Å; Y676-Y681 HydrophobicContact CE2-CE2 3.83Å; Y676-Y681 HydrophobicContact CG-CE1 4.38Å; Y681-V700 HydrophobicContact CE1-CB 4.12Å; Y681-V700 HydrophobicContact CE1-CG1 4.13Å; Y681-V700 HydrophobicContact CE1-CG2 4.08Å
682	H	79.4	Confident	75.2	Confident	108 Å²	108	70.9 Å²	70.9	50%	0.5	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	114.3	-179.5	-59	-83.7	0	0	0	110.6	F674 L675 L684	F674-H682 CarbonylContact C-O 3.6Å; F674-H682 VanDerWaalsContact CA-O 3.22Å; F674-H682 WeakPolarHBondContact CA-O 3.31Å; L675-H682 PolarHBondContact N-O 3.12Å; L675-H682 PolarHBondContact O-N 3.13Å; H682-L684 PolarHBondContact O-N 3.17Å
683	R	82.2	Confident	74.2	Confident	173 Å²	173	72.1 Å²	72.1	65%	0.653	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64	125.9	179.2	-170.2	178.9	-178.7	177.2	2.4	110.1	F674	F674-R683 HydrophobicContact CD1-CB 3.82Å; F674-R683 HydrophobicContact CD1-CG 4.41Å; F674-R683 HydrophobicContact CE1-CB 3.64Å; F674-R683 HydrophobicContact CE1-CG 4.04Å; F674-R683 HydrophobicContact CZ-CB 4.32Å; F674-R683 HydrophobicContact CZ-CG 4.22Å
684	L	82.8	Confident	72.9	Confident	19 Å²	19	75.5 Å²	75.5	10%	0.099	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-81.5	130.1	-179	-68.8	175.1	0	0	0	110.8	I652 L673 L675 H682 L693 L699	I652-L684 HydrophobicContact CD1-CD1 4.26Å; I652-L684 HydrophobicContact CG1-CB 4.23Å; I652-L684 HydrophobicContact CG2-CB 3.8Å; L673-L684 HydrophobicContact CB-CD1 4.45Å; L673-L684 PolarHBondContact O-N 3.29Å; L675-L684 HydrophobicContact CB-CD1 4.34Å; L675-L684 HydrophobicContact CB-CD2 3.98Å; L675-L684 HydrophobicContact CB-CG 4.22Å; H682-L684 PolarHBondContact O-N 3.17Å; L684-L693 HydrophobicContact CD1-CD1 3.97Å; L684-L693 HydrophobicContact CD1-CD2 3.79Å; L684-L693 HydrophobicContact CD2-CD2 3.65Å; L684-L693 HydrophobicContact CG-CD2 4.31Å; L684-L699 HydrophobicContact CD1-CD2 3.6Å
685	P	80.2	Confident	71.3	Confident	79 Å²	79	81.5 Å²	81.5	51%	0.513	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-70.5	138.6	-176.7	27.5	-33.4	0	0	0	110.8	I652 G687 A688	I652-P685 WeakPolarHBondContact CB-O 3.31Å; P685-G687 VanDerWaalsContact C-N 3.26Å; P685-G687 PolarHBondContact O-N 3.21Å; P685-G687 VanDerWaalsContact O-N 3.14Å; P685-A688 HydrophobicContact CG-CB 4.02Å; P685-A688 PolarHBondContact O-N 2.91Å; P685-A688 VanDerWaalsContact O-N 3.09Å
686	P	75.3	Confident	69.8	Low	84 Å²	84	84.7 Å²	84.7	55%	0.545	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-28.4	-167.8	22.7	-33.6	0	0	0	114.3	I652 A653	I652-P686 PolarHBondContact N-O 3.17Å; A653-P686 HydrophobicContact CB-CB 4.06Å; A653-P686 PolarHBondContact N-O 2.86Å
687	G	75.8	Confident	68.9	Low	66 Å²	66	82.7 Å²	82.7	68%	0.68	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-7.1	178.9	0	0	0	0	0	115.7	P685	P685-G687 VanDerWaalsContact C-N 3.26Å; P685-G687 PolarHBondContact O-N 3.21Å; P685-G687 VanDerWaalsContact O-N 3.14Å
688	A	80.2	Confident	68.6	Low	33 Å²	33	87.3 Å²	87.3	27%	0.273	47%	0.465	S	S	.	.	S	Bend	trans	-67.5	152.8	176	0	0	0	0	0	111.4	S651 I652 P685	S651-A688 CarbonylContact C-O 3.56Å; S651-A688 VanDerWaalsContact CA-O 3.22Å; S651-A688 WeakPolarHBondContact CA-O 3.48Å; I652-A688 HydrophobicContact CG1-CB 3.89Å; I652-A688 WeakPolarHBondContact CG1-O 3.44Å; I652-A688 PolarHBondContact N-O 2.93Å; P685-A688 HydrophobicContact CG-CB 4.02Å; P685-A688 PolarHBondContact O-N 2.91Å; P685-A688 VanDerWaalsContact O-N 3.09Å
689	L	79.4	Confident	69.2	Low	53 Å²	53	82.2 Å²	82.2	28%	0.277	44%	0.437	S	S	.	.	B	Isolated β-bridge	trans	-84	129.2	174.8	-58.9	-178.4	0	0	0	109.9	E649 H691 R692	E649-L689 WeakPolarHBondContact O-CD2 3.37Å; L689-H691 PolarHBondContact O-N 2.84Å; L689-H691 VanDerWaalsContact O-N 3.12Å; L689-R692 HydrophobicContact CB-CB 4.29Å; L689-R692 HydrophobicContact CB-CG 4.19Å; L689-R692 HydrophobicContact CD1-CG 4.4Å; L689-R692 PolarHBondContact O-N 3.44Å
690	A	69	Low	69.9	Low	1 Å²	1	74.6 Å²	74.6	1%	0.008	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-58.9	-27.7	-177.9	0	0	0	0	0	113.5	L628 V646 A650 I652 L655 L693	L628-A690 HydrophobicContact CD1-CB 3.84Å; V646-A690 HydrophobicContact CG1-CB 3.78Å; A650-A690 WeakPolarHBondContact O-CB 3.48Å; A650-A690 PolarHBondContact O-N 2.98Å; I652-A690 HydrophobicContact CD1-CB 4.2Å; L655-A690 HydrophobicContact CD2-CB 4.01Å; A690-L693 WeakPolarHBondContact O-CD1 3.33Å; A690-L693 VanDerWaalsContact O-CG 3.3Å; A690-L693 WeakPolarHBondContact O-CG 3.47Å
691	H	67.2	Low	70.7	Confident	64 Å²	64	73.5 Å²	73.5	30%	0.296	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-91	-0	179.2	-52.4	-54.8	0	0	0	114.3	Q625 V646 P647 L689	Q625-H691 PolarHBondContact O-CE1 2.9Å; Q625-H691 PolarHBondContact O-ND1 2.95Å; Q625-H691 VanDerWaalsContact O-ND1 3.13Å; V646-H691 PolarHBondContact O-CE1 3.45Å; V646-H691 VanDerWaalsContact O-CE1 3.28Å; V646-H691 PolarHBondContact O-NE2 2.87Å; P647-H691 PolarHBondContact O-NE2 2.92Å; L689-H691 PolarHBondContact O-N 2.84Å; L689-H691 VanDerWaalsContact O-N 3.12Å
692	R	65	Low	71	Confident	210 Å²	210	71.2 Å²	71.2	79%	0.792	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-106.6	18	170.6	-65.6	-169.7	-178.7	166.8	2.1	112.3	L689	L689-R692 HydrophobicContact CB-CB 4.29Å; L689-R692 HydrophobicContact CB-CG 4.19Å; L689-R692 HydrophobicContact CD1-CG 4.4Å; L689-R692 PolarHBondContact O-N 3.44Å
693	L	65.3	Low	71.1	Confident	31 Å²	31	71.9 Å²	71.9	16%	0.162	38%	0.379	C	S	.	.	S	Bend	trans	-75.2	149.4	174.1	-65.8	175.7	0	0	0	110.8	I652 L684 A690 T695 L699	I652-L693 HydrophobicContact CD1-CD1 3.8Å; I652-L693 HydrophobicContact CD1-CD2 4.04Å; I652-L693 HydrophobicContact CD1-CG 4.22Å; L684-L693 HydrophobicContact CD1-CD1 3.97Å; L684-L693 HydrophobicContact CD1-CD2 3.79Å; L684-L693 HydrophobicContact CD2-CD2 3.65Å; L684-L693 HydrophobicContact CG-CD2 4.31Å; A690-L693 WeakPolarHBondContact O-CD1 3.33Å; A690-L693 VanDerWaalsContact O-CG 3.3Å; A690-L693 WeakPolarHBondContact O-CG 3.47Å; L693-T695 PolarHBondContact O-N 2.62Å; L693-L699 HydrophobicContact CD1-CD1 4.1Å; L693-L699 HydrophobicContact CD1-CD2 3.77Å
694	P	57.5	Low	70.6	Confident	71 Å²	71	64.6 Å²	64.6	46%	0.461	36%	0.356	S	S	.	.			trans	-56.3	137	173.7	-24.1	33.8	0	0	0	111.9	L675 T696	L675-P694 HydrophobicContact CD2-CB 4.23Å; L675-P694 HydrophobicContact CD2-CG 3.9Å; P694-T696 PolarHBondContact O-N 3.36Å
695	T	49.4	Very low	69.5	Low	147 Å²	147	69.4 Å²	69.4	90%	0.902	38%	0.378	S	S	*	.	S	Bend	trans	-67.2	-16.5	172.6	48.1	0	0	0	0	112.8	L693	L693-T695 PolarHBondContact O-N 2.62Å
696	T	48.2	Very low	67.6	Low	79 Å²	79	76.7 Å²	76.7	49%	0.485	40%	0.396	S	S	.	.	S	Bend	trans	-96.7	95.8	178.1	50	0	0	0	0	111.6	K677 P694	K677-T696 WeakPolarHBondContact CD-O 3.37Å; K677-T696 WeakPolarHBondContact CE-OG1 3.31Å; K677-T696 WeakPolarHBondContact CG-O 3.31Å; P694-T696 PolarHBondContact O-N 3.36Å
697	G	54	Low	65.7	Low	36 Å²	36	78.6 Å²	78.6	37%	0.371	41%	0.408	S	S	.	.	S	Bend	trans	153.4	175.3	170.4	0	0	0	0	0	113.6	Y676	Y676-G697 CarbonylContact O-C 3.49Å; Y676-G697 VanDerWaalsContact O-CA 3.24Å; Y676-G697 WeakPolarHBondContact O-CA 3.19Å
698	Y	65.1	Low	63.4	Low	168 Å²	168	84 Å²	84	66%	0.659	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.4	131.7	175.2	-62.5	-89.6	0	0	0	110.3	Y676	Y676-Y698 HydrophobicContact CD1-CD2 4.27Å; Y676-Y698 PolarHBondContact N-O 2.8Å; Y676-Y698 PolarHBondContact O-N 3.02Å
699	L	74.7	Confident	61	Low	17 Å²	17	88.1 Å²	88.1	9%	0.089	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	121.6	174.4	-63.4	172.9	0	0	0	109.9	L628 V630 A631 L675 L684 L693	L628-L699 HydrophobicContact CB-CD1 4.1Å; L628-L699 HydrophobicContact CD1-CD1 4.06Å; L628-L699 HydrophobicContact CD2-CD1 4.38Å; L628-L699 HydrophobicContact CG-CD1 4.42Å; V630-L699 CarbonylContact C-O 3.56Å; V630-L699 WeakPolarHBondContact CA-O 3.42Å; V630-L699 HydrophobicContact CB-CB 4.5Å; V630-L699 HydrophobicContact CG2-CB 3.98Å; V630-L699 HydrophobicContact CG2-CD1 4.25Å; A631-L699 PolarHBondContact N-O 3.08Å; L675-L699 HydrophobicContact CD1-CD2 3.9Å; L684-L699 HydrophobicContact CD1-CD2 3.6Å; L693-L699 HydrophobicContact CD1-CD1 4.1Å; L693-L699 HydrophobicContact CD1-CD2 3.77Å
700	V	76.8	Confident	58.6	Low	11 Å²	11	95.2 Å²	95.2	7%	0.067	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118.5	-178.9	-170.4	0	0	0	0	109.6	A631 Q633 F674 Y681 R702	A631-V700 HydrophobicContact CB-CG2 4.35Å; A631-V700 CarbonylContact O-C 3.57Å; A631-V700 WeakPolarHBondContact O-CA 3.37Å; Q633-V700 HydrophobicContact CB-CG1 4.1Å; F674-V700 PolarHBondContact N-O 3.22Å; F674-V700 PolarHBondContact O-N 3.21Å; Y681-V700 HydrophobicContact CE1-CB 4.12Å; Y681-V700 HydrophobicContact CE1-CG1 4.13Å; Y681-V700 HydrophobicContact CE1-CG2 4.08Å; V700-R702 HydrophobicContact CG1-CB 4.33Å
701	Y	82	Confident	56.8	Low	2 Å²	2	104.1 Å²	104.1	1%	0.008	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	108.3	168.3	-169	-128.5	0	0	0	108	A631 Y632 Q633 N656 C659 A660 F663 V665 F671 G672 L673	A631-Y701 PolarHBondContact O-N 3.3Å; Y632-Y701 WeakPolarHBondContact CA-O 3.34Å; Y632-Y701 AromaticContact CD2-CD1 3.76Å; Y632-Y701 HydrophobicContact CD2-CD1 3.76Å; Y632-Y701 HydrophobicContact CD2-CG 4.5Å; Y632-Y701 WeakPolarHBondContact CD2-O 3.19Å; Y632-Y701 HydrophobicContact CE2-CD1 4.23Å; Q633-Y701 PolarHBondContact N-O 2.94Å; N656-Y701 WeakPolarHBondContact OD1-CE2 3.49Å; C659-Y701 HydrophobicContact CB-CD1 3.6Å; C659-Y701 HydrophobicContact CB-CD2 3.94Å; C659-Y701 HydrophobicContact CB-CE1 3.74Å; C659-Y701 HydrophobicContact CB-CE2 4.1Å; C659-Y701 HydrophobicContact CB-CG 3.71Å; A660-Y701 WeakPolarHBondContact CB-OH 3.48Å; F663-Y701 HydrophobicContact CD2-CD1 4.07Å; V665-Y701 HydrophobicContact CG2-CD1 4.46Å; V665-Y701 HydrophobicContact CG2-CE1 3.81Å; F671-Y701 HydrophobicContact CB-CD2 4.33Å; F671-Y701 HydrophobicContact CB-CE1 3.96Å; F671-Y701 HydrophobicContact CB-CE2 3.64Å; F671-Y701 VanDerWaalsContact CB-CZ 3.41Å; F671-Y701 WeakPolarHBondContact CB-OH 3.32Å; F671-Y701 HydrophobicContact CG-CE1 4.5Å; G672-Y701 WeakPolarHBondContact O-CA 3.25Å; G672-Y701 WeakPolarHBondContact O-CD2 3.31Å; L673-Y701 HydrophobicContact CD2-CD2 4.46Å; L673-Y701 HydrophobicContact CG-CD2 4.07Å
702	R	82.3	Confident	55	Low	44 Å²	44	105.7 Å²	105.7	17%	0.166	54%	0.535	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	165.9	-178.9	63.9	169.4	-75.8	-177.7	-0.1	110.8	Q633 F671 G672 F674 V700 A704 E705	Q633-R702 HydrophobicContact CB-CB 3.98Å; F671-R702 CarbonylContact C-O 3.54Å; F671-R702 WeakPolarHBondContact CA-O 3.31Å; G672-R702 PolarHBondContact N-O 2.7Å; G672-R702 PolarHBondContact O-N 2.83Å; G672-R702 VanDerWaalsContact O-N 3.08Å; F674-R702 HydrophobicContact CD2-CG 3.42Å; F674-R702 VanDerWaalsContact CD2-CG 3.42Å; F674-R702 HydrophobicContact CE2-CG 3.51Å; F674-R702 HydrophobicContact CG-CG 4.21Å; F674-R702 HydrophobicContact CZ-CG 4.34Å; V700-R702 HydrophobicContact CG1-CB 4.33Å; R702-A704 PolarHBondContact O-N 2.75Å; R702-E705 IonicContact CZ-OE1 3.64Å; R702-E705 IonicContact CZ-OE2 3.84Å; R702-E705 IonicContact NH2-OE1 2.69Å; R702-E705 PolarHBondContact NH2-OE1 3.44Å; R702-E705 IonicContact NH2-OE2 2.75Å; R702-E705 PolarHBondContact NH2-OE2 2.75Å
703	R	80.8	Confident	53.2	Low	121 Å²	121	100.3 Å²	100.3	46%	0.457	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	135.2	171.7	-163.2	173.9	65.1	-175.9	1.5	108.8	T670 F671 E705	T670-R703 CarbonylContact O-C 3.57Å; T670-R703 WeakPolarHBondContact O-CA 3.3Å; T670-R703 VanDerWaalsContact O-CG 3.31Å; T670-R703 WeakPolarHBondContact O-CG 3.42Å; F671-R703 HydrophobicContact CD1-CB 4.39Å; F671-R703 HydrophobicContact CE1-CB 4.09Å; F671-R703 HydrophobicContact CE2-CB 4.27Å; F671-R703 HydrophobicContact CE2-CG 4.32Å; F671-R703 HydrophobicContact CZ-CB 4.04Å; R703-E705 PolarHBondContact O-N 3.09Å
704	A	72.4	Confident	51.4	Low	21 Å²	21	105 Å²	105	17%	0.174	57%	0.565	C	S	.	*			trans	-81.5	108	169.4	0	0	0	0	0	107.7	T670 F674 R702	T670-A704 PolarHBondContact O-N 3.15Å; F674-A704 HydrophobicContact CZ-CB 4.34Å; R702-A704 PolarHBondContact O-N 2.75Å
705	E	60.1	Low	50.1	Low	119 Å²	119	110.5 Å²	110.5	56%	0.556	59%	0.585	S	S	*	*			trans	-64.6	134.2	160.3	-75.7	106.3	-113.4	0	0	108.8	R702 R703	R702-E705 IonicContact CZ-OE1 3.64Å; R702-E705 IonicContact CZ-OE2 3.84Å; R702-E705 IonicContact NH2-OE1 2.69Å; R702-E705 PolarHBondContact NH2-OE1 3.44Å; R702-E705 IonicContact NH2-OE2 2.75Å; R702-E705 PolarHBondContact NH2-OE2 2.75Å; R703-E705 PolarHBondContact O-N 3.09Å
706	W	38.5	Very low	49	Very low	232 Å²	232	113.1 Å²	113.1	88%	0.879	59%	0.587	S	S	*	*			trans	-72.6	136.7	166.1	-68.2	95.2	0	0	0	108.2	E708	W706-E708 PolarHBondContact O-N 2.71Å
707	P	35.6	Very low	48.1	Very low	124 Å²	124	118.6 Å²	118.6	81%	0.805	61%	0.607	S	S	*	*			trans	-68.9	103.9	170.3	-16	30.7	0	0	0	109.5
708	E	28.4	Very low	46.8	Very low	181 Å²	181	120.6 Å²	120.6	85%	0.846	63%	0.628	S	S	*	*			trans	-76.1	119.2	161.2	-70.6	-177.8	163.5	0	0	108.1	W706	W706-E708 PolarHBondContact O-N 2.71Å
709	T	30.1	Very low	44.9	Very low	119 Å²	119	125.1 Å²	125.1	73%	0.73	64%	0.644	S	S	*	*			trans	62.2	94.4	163.9	-44.5	0	0	0	0	117.8
710	Q	28.8	Very low	42.6	Very low	201 Å²	201	127.4 Å²	127.4	94%	0.939	67%	0.671	S	S	*	*			trans	-128.8	55.3	148.9	-83.1	-160.1	-50.5	0	0	111.5
711	E	31.2	Very low	40.3	Very low	188 Å²	188	136.1 Å²	136.1	88%	0.879	71%	0.711	S	S	*	*			trans	-121.9	82	163.9	-73.7	-171.8	153.7	0	0	109.2
712	A	29.1	Very low	37.7	Very low	97 Å²	97	140.5 Å²	140.5	80%	0.802	74%	0.742	S	S	*	*			trans	-169.7	71.4	172.7	0	0	0	0	0	112.4
713	A	27.8	Very low	35	Very low	98 Å²	98	146.7 Å²	146.7	81%	0.81	77%	0.773	S	S	*	*	S	Bend	trans	-158.1	-0.5	169.8	0	0	0	0	0	116.7
714	T	27.5	Very low	32.3	Very low	129 Å²	129	145.5 Å²	145.5	79%	0.791	79%	0.789	S	S	*	*	S	Bend	trans	-162.9	128.7	177.5	25.5	0	0	0	0	106.5
715	E	29.2	Very low	30.2	Very low	187 Å²	187	155.9 Å²	155.9	87%	0.874	82%	0.823	S	S	*	*			cis	-133.8	148.2	2.5	-72.7	152.5	161.6	0	0	109.7
716	E	26.6	Very low	28.6	Very low	201 Å²	201	155 Å²	155	94%	0.939	83%	0.831	S	S	*	*			trans	-124.9	79.3	161.9	-163.2	-172.8	-149.3	0	0	110
717	E	29.1	Very low	28.1	Very low	195 Å²	195	154.9 Å²	154.9	91%	0.911	83%	0.83	S	S	*	*			trans	-131	152	159.8	-80.6	-161.1	145.6	0	0	109.4
718	G	26.8	Very low	27.7	Very low	78 Å²	78	152 Å²	152	80%	0.804	82%	0.822	S	S	*	*			trans	96.7	63.2	172.7	0	0	0	0	0	116.6	G720	G718-G720 PolarHBondContact O-N 3.06Å
719	R	26.1	Very low	27.7	Very low	263 Å²	263	150.6 Å²	150.6	99%	0.992	82%	0.816	S	S	*	*			trans	-64.1	119.7	157.3	-84.8	-177.9	167.4	-123.9	-0.1	110.4
720	G	26.1	Very low	27.6	Very low	65 Å²	65	152 Å²	152	67%	0.67	81%	0.814	S	S	*	*			trans	172.7	106.8	165.5	0	0	0	0	0	116.7	G718	G718-G720 PolarHBondContact O-N 3.06Å
721	Q	28.6	Very low	27.6	Very low	194 Å²	194	150.6 Å²	150.6	91%	0.907	81%	0.807	S	S	*	*			trans	26.7	138.1	133.1	-57.7	174.8	18.5	0	0	119.3
722	S	26.3	Very low	27.3	Very low	93 Å²	93	145.1 Å²	145.1	65%	0.65	80%	0.802	S	S	*	*			cis	-164	169.9	7.3	-138.8	0	0	0	0	113.2
723	E	25.4	Very low	27.2	Very low	175 Å²	175	146.3 Å²	146.3	82%	0.818	80%	0.803	S	S	*	*			trans	52.5	103.2	145.7	-73.6	166.6	-176.2	0	0	123
724	A	25.7	Very low	27.2	Very low	95 Å²	95	151.1 Å²	151.1	79%	0.785	81%	0.809	S	S	*	*				58.1	101.2	112.4	0	0	0	0	0	122.5
725	R	26.6	Very low	27.2	Very low	240 Å²	240	148.5 Å²	148.5	91%	0.906	81%	0.807	S	S	*	*				-177.2	123.6	126.2	-103.1	167.4	167.9	-180	-3.4	108.4
726	S	26.6	Very low	27.1	Very low	101 Å²	101	147.2 Å²	147.2	71%	0.706	80%	0.801	S	S	*	*			cis	92.7	116.2	27.8	85.5	0	0	0	0	115.2
727	R	28.2	Very low	27.1	Very low	229 Å²	229	145.5 Å²	145.5	86%	0.864	79%	0.793	S	S	*	*			trans	68.4	146.8	176.7	-64.7	-177.8	167.5	-171.2	-8.6	116.4
728	G	27	Very low	27.1	Very low	62 Å²	62	143.1 Å²	143.1	64%	0.639	79%	0.786	S	S	*	*			cis	-174.3	-179.2	-2.7	0	0	0	0	0	113.5
729	E	28.9	Very low	27.2	Very low	153 Å²	153	143.7 Å²	143.7	72%	0.715	78%	0.783	S	S	*	*				34	140.3	121.6	-66.7	155.6	176.2	0	0	119.4
730	E	27.8	Very low	27.2	Very low	147 Å²	147	134.6 Å²	134.6	69%	0.687	77%	0.771	S	S	*	*			cis	-173.8	159.3	-15.5	-133.6	-159.4	134.6	0	0	109.5
731	Q	28.5	Very low	27.4	Very low	172 Å²	172	137.4 Å²	137.4	80%	0.804	78%	0.775	S	S	*	*			trans	58.3	171.2	156.6	-60.6	177.1	23.9	0	0	119.9
732	G	25.9	Very low	27.3	Very low	74 Å²	74	137.6 Å²	137.6	76%	0.763	77%	0.773	S	S	*	*			trans	138.1	119.7	169.8	0	0	0	0	0	114.8
733	C	25.8	Very low	27.3	Very low	122 Å²	122	137.7 Å²	137.7	82%	0.824	78%	0.779	S	S	*	*			trans	-135.6	167.4	-178.5	-65.1	0	0	0	0	112.5
734	Q	27.7	Very low	27.7	Very low	199 Å²	199	135 Å²	135	93%	0.93	78%	0.78	S	S	*	*			trans	78.4	158.3	160	-63.2	172.3	-14.7	0	0	119.7
735	G	27.5	Very low	28.5	Very low	74 Å²	74	136.8 Å²	136.8	76%	0.763	78%	0.784	S	S	*	*			trans	89.9	101.3	-179.7	0	0	0	0	0	113.5
736	H	27.8	Very low	28.8	Very low	160 Å²	160	135.5 Å²	135.5	74%	0.741	78%	0.779	S	S	*	*			cis	88.4	117.9	26.3	-141.6	-88.8	0	0	0	114.9
737	E	27.2	Very low	29.1	Very low	164 Å²	164	136.1 Å²	136.1	77%	0.766	77%	0.774	S	S	*	*			trans	65.3	154.5	162.4	-90.4	157.4	178.9	0	0	118.8
738	D	28.3	Very low	29.2	Very low	146 Å²	146	132.5 Å²	132.5	78%	0.781	78%	0.778	S	S	*	*			cis	-155.2	173.2	-4.1	-172.7	26.7	0	0	0	111.6
739	A	29.5	Very low	29.3	Very low	89 Å²	89	139 Å²	139	74%	0.736	78%	0.783	S	S	*	*			trans	72.1	158.3	152.5	0	0	0	0	0	120.2
740	G	26.3	Very low	29.2	Very low	72 Å²	72	140.2 Å²	140.2	74%	0.742	79%	0.789	S	S	*	*			trans	165.1	-7.3	168.3	0	0	0	0	0	123.2
741	V	29.1	Very low	29.4	Very low	124 Å²	124	139.2 Å²	139.2	75%	0.752	78%	0.784	S	S	*	*			trans	34	114.5	158.7	-178.9	0	0	0	0	120.2
742	K	27.2	Very low	29.6	Very low	199 Å²	199	135.1 Å²	135.1	87%	0.865	77%	0.774	S	S	*	*			trans	53.5	131.6	152.5	-60.9	171.2	-176.9	175.5	0	118.1
743	A	27.3	Very low	30	Very low	94 Å²	94	139.6 Å²	139.6	78%	0.777	78%	0.775	S	S	*	*				-172.6	167.3	73.6	0	0	0	0	0	113.4
744	S	32.8	Very low	30.2	Very low	119 Å²	119	139.7 Å²	139.7	83%	0.832	77%	0.772	S	S	*	*			trans	-119.2	150.9	158.6	-50.8	0	0	0	0	109.2
745	P	43.6	Very low	30.2	Very low	133 Å²	133	135.9 Å²	135.9	86%	0.864	76%	0.763	S	S	*	*			trans	-123.2	-175.7	139.7	36.2	-27.3	0	0	0	111.6
746	R	32.3	Very low	30.6	Very low	212 Å²	212	136.7 Å²	136.7	80%	0.8	76%	0.762	S	S	*	*			trans	-125	161	-164.9	-121.6	179.1	170.9	-125.4	13.3	111.2
747	D	32.2	Very low	30.9	Very low	115 Å²	115	138.1 Å²	138.1	62%	0.615	77%	0.769	S	S	*	*			trans	51.8	129.9	146.7	-50.9	-24.7	0	0	0	120.6
748	T	30	Very low	30.9	Very low	153 Å²	153	134.1 Å²	134.1	94%	0.939	77%	0.772	S	S	*	*			trans	-145.3	161.2	148.8	-19	0	0	0	0	108.8
749	R	29.6	Very low	31	Very low	199 Å²	199	130.9 Å²	130.9	75%	0.751	77%	0.773	S	S	*	*			trans	-146.3	142.6	-155.6	152.1	-171.8	166.8	-169.7	-2.7	111.2	E751	R749-E751 IonicContact CZ-OE1 2.93Å; R749-E751 IonicContact NE-OE1 2.79Å; R749-E751 PolarHBondContact NE-OE1 3.29Å; R749-E751 IonicContact NH2-OE1 3.63Å; R749-E751 PolarHBondContact NH2-OE1 3.34Å
750	E	27.7	Very low	31.2	Very low	178 Å²	178	136.7 Å²	136.7	83%	0.832	79%	0.785	S	S	*	*			trans	-174.2	135	148.7	-97.7	147.5	-154.5	0	0	105.8
751	E	30.5	Very low	31.4	Very low	126 Å²	126	136.4 Å²	136.4	59%	0.589	78%	0.783	S	S	*	*			cis	79.8	137.5	49.9	-66.6	-177.2	-147.6	0	0	113.3	R749	R749-E751 IonicContact CZ-OE1 2.93Å; R749-E751 IonicContact NE-OE1 2.79Å; R749-E751 PolarHBondContact NE-OE1 3.29Å; R749-E751 IonicContact NH2-OE1 3.63Å; R749-E751 PolarHBondContact NH2-OE1 3.34Å
752	S	34.3	Very low	31.5	Very low	86 Å²	86	142.8 Å²	142.8	60%	0.601	79%	0.793	S	S	*	*			cis	-162.9	161.3	-8	-103.5	0	0	0	0	112.4
753	E	33.2	Very low	31.6	Very low	168 Å²	168	137.5 Å²	137.5	79%	0.785	79%	0.787	S	S	*	*			trans	42.6	132.8	151.3	-57.3	179.5	130.8	0	0	121
754	T	29.9	Very low	31.8	Very low	123 Å²	123	143.1 Å²	143.1	76%	0.755	79%	0.788	S	S	*	*				173.4	165.8	84.9	37.4	0	0	0	0	109.5
755	T	29	Very low	31.6	Very low	119 Å²	119	144.6 Å²	144.6	73%	0.73	78%	0.782	S	S	*	*			cis	-166.5	137.2	-31.8	30.3	0	0	0	0	109.2
756	A	35.4	Very low	30.9	Very low	92 Å²	92	141.8 Å²	141.8	76%	0.76	78%	0.776	S	S	*	*			trans	58.3	153.9	137.7	0	0	0	0	0	121.6
757	E	33.4	Very low	31.9	Very low	190 Å²	190	138.1 Å²	138.1	89%	0.888	78%	0.78	S	S	*	*			cis	-162.9	168.2	-8.9	-129	-169.1	140.3	0	0	112.9
758	G	28.7	Very low	31.8	Very low	79 Å²	79	137.6 Å²	137.6	81%	0.814	79%	0.792	S	S	*	*			trans	82	150.4	157	0	0	0	0	0	118
759	G	29.2	Very low	31.9	Very low	79 Å²	79	139.2 Å²	139.2	81%	0.814	79%	0.789	S	S	*	*			cis	-172	159.6	-3	0	0	0	0	0	113
760	Q	33.8	Very low	32.8	Very low	210 Å²	210	135.8 Å²	135.8	98%	0.981	79%	0.792	S	S	*	*			trans	-74.6	166.3	-177.1	-57.1	161.4	20.8	0	0	112.2
761	G	29.7	Very low	32.8	Very low	67 Å²	67	130.9 Å²	130.9	69%	0.691	79%	0.789	S	S	*	*			cis	154.3	179.4	1.1	0	0	0	0	0	111.6
762	R	31.2	Very low	32.9	Very low	258 Å²	258	133.9 Å²	133.9	97%	0.974	80%	0.803	S	S	*	*			trans	67.9	171.5	178.5	-57.8	-179.8	175.1	-169.8	-1.3	116.5
763	A	30.7	Very low	33.7	Very low	88 Å²	88	135.5 Å²	135.5	73%	0.727	81%	0.812	S	S	*	*				177.6	137.2	-53.2	0	0	0	0	0	110.2
764	R	30.4	Very low	33.6	Very low	211 Å²	211	136.5 Å²	136.5	80%	0.796	82%	0.816	S	S	*	*			trans	178.8	147.3	144.8	-109.3	179.6	152.1	-171.1	-25.9	117.6
765	E	29.5	Very low	33.8	Very low	151 Å²	151	135.2 Å²	135.2	71%	0.706	82%	0.818	S	S	*	*			trans	24.5	145.5	138	-67.2	157.1	-156.1	0	0	123.8
766	G	28.1	Very low	34	Very low	73 Å²	73	139.2 Å²	139.2	75%	0.753	83%	0.829	S	S	*	*			trans	136.2	118.6	136.9	0	0	0	0	0	117.8
767	P	53.5	Low	33.8	Very low	135 Å²	135	138 Å²	138	88%	0.877	83%	0.826	S	S	*	*			trans	-113.2	156.9	177.7	39.6	-31.3	0	0	0	115.1
768	A	29.3	Very low	33.7	Very low	104 Å²	104	133.9 Å²	133.9	86%	0.86	82%	0.818	S	S	*	*			trans	-157.9	134.2	160.2	0	0	0	0	0	114.1
769	Q	33.8	Very low	34	Very low	188 Å²	188	141.7 Å²	141.7	88%	0.879	82%	0.823	S	S	*	*			trans	-103.3	174.7	146.4	-109.1	-174	-6.8	0	0	106.6
770	P	47.8	Very low	34.3	Very low	127 Å²	127	142.2 Å²	142.2	83%	0.825	82%	0.819	S	S	*	*			cis	-145.2	-162.6	29.6	43.7	-22.9	0	0	0	115.2
771	G	27.4	Very low	34.5	Very low	75 Å²	75	136.3 Å²	136.3	77%	0.773	81%	0.806	S	S	*	*			trans	139.9	107.9	148.9	0	0	0	0	0	117.5
772	E	33	Very low	34.9	Very low	188 Å²	188	142.1 Å²	142.1	88%	0.879	82%	0.815	S	S	*	*			trans	-92.8	170.1	149.8	-58.3	-177.9	129.5	0	0	108.7
773	P	50.7	Low	35.3	Very low	121 Å²	121	143 Å²	143	79%	0.786	83%	0.83	S	S	*	*				-149.1	167.7	87.8	39.3	-21.4	0	0	0	117.9
774	E	32	Very low	35.6	Very low	188 Å²	188	145.7 Å²	145.7	88%	0.879	84%	0.835	S	S	*	*			trans	-27	144	165.2	-54.5	168.3	126.2	0	0	121.4
775	A	33.6	Very low	35.8	Very low	96 Å²	96	142.3 Å²	142.3	79%	0.793	84%	0.837	S	S	*	*			trans	175.3	111.8	135	0	0	0	0	0	108
776	E	32	Very low	36.2	Very low	203 Å²	203	141.8 Å²	141.8	95%	0.949	85%	0.845	S	S	*	*				75.9	127.2	62.7	-161.9	175.7	-128.3	0	0	114.9
777	G	31.5	Very low	36.7	Very low	68 Å²	68	145.8 Å²	145.8	70%	0.701	85%	0.85	S	S	*	*			trans	123	82.6	179.6	0	0	0	0	0	113.7
778	S	32.2	Very low	35.6	Very low	102 Å²	102	146.5 Å²	146.5	71%	0.713	85%	0.848	S	S	*	*				78.3	105.5	67.8	-70	0	0	0	0	116.8
779	R	34.4	Very low	36	Very low	244 Å²	244	149.3 Å²	149.3	92%	0.921	85%	0.848	S	S	*	*			trans	67.7	167.1	148.7	-58.6	178.1	-173.4	-174.7	2.2	117.4
780	A	35.6	Very low	36.2	Very low	90 Å²	90	146.6 Å²	146.6	74%	0.744	85%	0.845	S	S	*	*			cis	-170.8	166	-38.1	0	0	0	0	0	109.5
781	A	37.7	Very low	35.3	Very low	85 Å²	85	148.1 Å²	148.1	70%	0.702	85%	0.847	S	S	*	*			trans	75.3	131.6	160.1	0	0	0	0	0	120.7
782	E	38	Very low	35.9	Very low	190 Å²	190	154.2 Å²	154.2	89%	0.888	85%	0.853	S	S	*	*			trans	55.3	102	133.8	-61.6	173.4	153.8	0	0	121.1
783	E	40.5	Very low	36.2	Very low	275 Å²	275	151.1 Å²	151.1	100%	1.285	85%	0.851	S	S	*	*				-140.2	0	99.8	-109.7	-172.2	162.4	0	0	110.3

Retrieved 783 of 783 residues in 251.8 ms (Link to these results)

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