A0A061IF13_CRIGR Loading...

AP-3 complex subunit beta

Subunit of non-clathrin- and clathrin-associated adaptor protein complex 3 (AP-3) that plays a role in protein sorting in the late-Golgi/trans-Golgi network (TGN) and/or endosomes. The AP complexes mediate both the recruitment of clathrin to membranes and the recognition of sorting signals within the cytosolic tails of transmembrane cargo molecules. AP-3 appears to be involved in the sorting of a subset of transmembrane proteins targeted to lysosomes and lysosome-related organelles. In concert with the BLOC-1 complex, AP-3 is required to target cargos into vesicles assembled at cell bodies for delivery into neurites and nerve terminals.

AlphaFold DB , UniProt , Accession A0A061IF13, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Ap3b2, Length 1,081 aa.

						>A0A061IF13_CRIGR|A0A061IF13|Ap3b2
MSTAPAYSEDKGGSAGPGEPEYGHDPASGGIFSSDYKRHDDLKEMLDTNKDSLKLEAMKRIVAMIARGKNASDLFPAVVKNVACKNIEVKKLVYVYLVRYAEEQQDLALLSISTFQRGLKDPNQLIRASALRVLSSIRVPIIVPIMMLAIKEAASDMSPYVRKTAAHAIPKLYSLDSDQKDQLIEVIEKLLADKTTLVAGSVVMAFEEVCPERIDLIHKNYRKLCNLLIDVEEWGQVVIISMLTRYARTQFLSPTQNESLLEENPEKAFYGSEEDEAKGPGSEEAATAALPARKPYVMDPDHRLLLRNTKPLLQSRSAAVVMAVAQLYFHLAPKAEVGVIAKALVRLLRSHSEVQYVVLQNVATMSIKRRGMFEPYLKSFYIRSTDPTQIKILKLEVLTNLANETNIPTVLREFQTYIRSMDKDFVAATIQAIGRCATNIGRVRDTCLNGLVQLLSNRDELVVAESVVVIKKLLQMQPAQHGEIIKHLAKLTDNIQVPMARASILWLIGEYCEHVPKIAPDVLRKMAKSFTAEEDIVKLQVINLAAKLYLTNSKQTKLLTQYVLSLAKYDQNYDIRDRARFTRQLIVPSEQGGALSRHAKKLFLAPKPAPILESSFKDRDHFQLGSLSHLLNAKATGYQELPDWPEEAPDPSVRNVEVPEWTKCSNREKRKEKEKPFYSDSEGESGPTESADSEPESESESESKSSSESGSGESSSDSDNEDEDEEKGGGSESEQSEEEGGKKKTKKKVPEGHREGSSSEEGSDSSSSSSESEVTSESEEEQAEPASRRKKTPPSSKSAPVAKEISLLDLEDFTPPSVQPVSPPMVVSTSLAADLEGLTLTDSSLVPSLLSPVSSIGRQELLHRVAGEGLAVDYAFSRQPFSGDPHMVSIHIYFSNNSETPIKGLHVGTPKLPAGISIQEFPEIESLPPGESTTAVMGINFCDSTQAANFQLCTQTRQFYVSIQPPVGELMAPVFMSENEFKKEQGKLTGMNEITEKLTLPDTCRNDHMVVQKVTATANLGRVPCGTSDEYRFAGRTLTSGSLVLLTLDARPAGPAQLTVNSEKMVIGTMLVKDVIQALTQ
					

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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	29.4	Very low	28.5	Very low	236 Å²	236	137.5 Å²	137.5	100%	1.163	77%	0.768	S	S	*	*				0	140.5	0	-58.4	178.4	-168.7	0	0	107.3
2	S	28.2	Very low	28.2	Very low	97 Å²	97	132.9 Å²	132.9	68%	0.678	78%	0.775	S	S	*	*			cis	-165.8	169	-17.1	-81	0	0	0	0	107.7
3	T	27.2	Very low	28.2	Very low	140 Å²	140	129.1 Å²	129.1	86%	0.859	78%	0.781	S	S	*	*			trans	56.9	120.4	160.5	48.5	0	0	0	0	120.1
4	A	26.6	Very low	28	Very low	90 Å²	90	128.1 Å²	128.1	74%	0.744	78%	0.783	S	S	*	*			trans	-85.7	-175.7	149.4	0	0	0	0	0	109.3
5	P	50.3	Low	28.1	Very low	123 Å²	123	126.1 Å²	126.1	80%	0.799	79%	0.785	S	S	*	*			cis	-144.5	-177	5.9	43.5	-24.2	0	0	0	118
6	A	25.3	Very low	28.2	Very low	84 Å²	84	122.8 Å²	122.8	69%	0.694	78%	0.783	S	S	*	*			trans	96.7	150.5	136.6	0	0	0	0	0	123.9
7	Y	26.4	Very low	29	Very low	220 Å²	220	123.5 Å²	123.5	86%	0.863	79%	0.789	S	S	*	*			trans	89.7	122.6	156.3	-90.9	-77.8	0	0	0	124.4
8	S	24.1	Very low	28.9	Very low	79 Å²	79	120.8 Å²	120.8	55%	0.552	79%	0.787	S	S	*	*			trans	52.8	126.3	150	-82.5	0	0	0	0	124.8
9	E	26.2	Very low	28.7	Very low	166 Å²	166	124.5 Å²	124.5	78%	0.776	79%	0.793	S	S	*	*				57.3	147.7	124.5	-61.2	166.7	111.4	0	0	120.7
10	D	24.2	Very low	28.8	Very low	113 Å²	113	124.5 Å²	124.5	60%	0.604	79%	0.794	S	S	*	*			cis	-145.5	-176.6	10.7	-154.3	9.8	0	0	0	115
11	K	26	Very low	28.7	Very low	164 Å²	164	126.8 Å²	126.8	71%	0.713	79%	0.794	S	S	*	*			trans	-40.5	148.7	171.5	-53.5	148.1	-160.3	81.2	0	113.3
12	G	24.7	Very low	28.8	Very low	83 Å²	83	126.9 Å²	126.9	86%	0.856	78%	0.783	S	S	*	*				80.7	143	56.5	0	0	0	0	0	111.8
13	G	27.6	Very low	28.8	Very low	83 Å²	83	125.5 Å²	125.5	86%	0.856	78%	0.784	S	S	*	*			cis	154.6	139	0.6	0	0	0	0	0	111.4
14	S	25.5	Very low	28.9	Very low	115 Å²	115	127 Å²	127	80%	0.804	78%	0.781	S	S	*	*			trans	-174	134.1	171.7	-164.4	0	0	0	0	107.7
15	A	29.2	Very low	29	Very low	98 Å²	98	129.1 Å²	129.1	81%	0.81	78%	0.78	S	S	*	*			cis	75.9	132.6	38.8	0	0	0	0	0	113.4
16	G	30.9	Very low	28.1	Very low	73 Å²	73	129.2 Å²	129.2	75%	0.753	78%	0.78	S	S	*	*			cis	-159.1	-141.2	2.8	0	0	0	0	0	110
17	P	41.1	Very low	28.4	Very low	136 Å²	136	129.4 Å²	129.4	88%	0.883	78%	0.782	S	S	*	*			cis	-143.7	176.7	-1.8	44.2	-26	0	0	0	117.7
18	G	26.7	Very low	28.7	Very low	74 Å²	74	123.7 Å²	123.7	76%	0.763	78%	0.775	S	S	*	*			trans	87.7	141.8	156.3	0	0	0	0	0	117.7
19	E	26.6	Very low	29	Very low	192 Å²	192	123.1 Å²	123.1	90%	0.897	78%	0.781	S	S	*	*			cis	-136.5	-163.7	-10.6	-62.2	-165.4	129.3	0	0	109.7
20	P	30.9	Very low	29.5	Very low	124 Å²	124	119.1 Å²	119.1	81%	0.805	78%	0.784	S	S	*	*				-108.5	154.1	-95	35.6	-21.8	0	0	0	114.9
21	E	26.3	Very low	30.2	Very low	173 Å²	173	120.8 Å²	120.8	81%	0.808	79%	0.791	S	S	*	*			trans	-91.8	140	178.7	-176.1	177.5	-158.8	0	0	111.6
22	Y	30.7	Very low	30.7	Very low	238 Å²	238	123.2 Å²	123.2	93%	0.933	80%	0.803	S	S	*	*			trans	-111.2	132.7	164.6	-130.5	-88.6	0	0	0	109.5
23	G	28.3	Very low	30.9	Very low	68 Å²	68	124.1 Å²	124.1	70%	0.701	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-70	143.3	-149.4	0	0	0	0	0	117.6
24	H	30.1	Very low	31.6	Very low	172 Å²	172	125.7 Å²	125.7	80%	0.796	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-74.3	121.2	166.2	-130	-66.2	0	0	0	110.6
25	D	27.3	Very low	31.9	Very low	134 Å²	134	125.4 Å²	125.4	72%	0.717	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-90.1	131.2	176.2	-164.9	49.4	0	0	0	111.3	A27	D25-A27 PolarHBondContact O-N 3.32Å
26	P	31.8	Very low	32.3	Very low	124 Å²	124	131.5 Å²	131.5	81%	0.805	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	56.4	-159.6	36.7	-37	0	0	0	114
27	A	31.1	Very low	33.1	Very low	88 Å²	88	135.7 Å²	135.7	73%	0.727	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	-7.7	178.7	0	0	0	0	0	114.9	D25 G29	D25-A27 PolarHBondContact O-N 3.32Å; A27-G29 PolarHBondContact O-N 3.22Å
28	S	33.6	Very low	33.9	Very low	101 Å²	101	139.4 Å²	139.4	71%	0.706	78%	0.781	S	S	*	*			trans	-82.3	72.4	-176.5	61.2	0	0	0	0	113.2	G30	S28-G30 PolarHBondContact O-N 3.29Å
29	G	29.8	Very low	35.9	Very low	66 Å²	66	137.5 Å²	137.5	68%	0.68	75%	0.752	S	S	*	*			trans	-62.9	114.5	168.8	0	0	0	0	0	111.4	A27 I31	A27-G29 PolarHBondContact O-N 3.22Å; G29-I31 PolarHBondContact O-N 3.15Å
30	G	36.8	Very low	38.2	Very low	82 Å²	82	132 Å²	132	85%	0.845	73%	0.728	S	S	*	*			trans	-71.5	98.7	-172	0	0	0	0	0	114.2	S28	S28-G30 PolarHBondContact O-N 3.29Å
31	I	39.8	Very low	40.7	Very low	148 Å²	148	129.4 Å²	129.4	76%	0.759	71%	0.708	S	S	*	*			trans	-137.6	76.6	169.6	-48.1	179	0	0	0	109.9	G29	G29-I31 PolarHBondContact O-N 3.15Å
32	F	35.7	Very low	43.5	Very low	216 Å²	216	121.5 Å²	121.5	95%	0.947	67%	0.671	S	S	*	*			trans	-142.9	88.8	169.1	-78.1	-70.2	0	0	0	111.4
33	S	29.8	Very low	46.1	Very low	102 Å²	102	113.6 Å²	113.6	71%	0.713	64%	0.642	S	S	*	*			trans	-98.6	127.3	155.5	-157.8	0	0	0	0	107.8	D35	S33-D35 VanDerWaalsContact C-N 3.29Å; S33-D35 VanDerWaalsContact CB-OD2 3.29Å; S33-D35 WeakPolarHBondContact CB-OD2 3.41Å; S33-D35 PolarHBondContact O-N 2.96Å; S33-D35 VanDerWaalsContact O-N 3.09Å; S33-D35 PolarHBondContact OG-OD2 3.3Å
34	S	41.7	Very low	48.9	Very low	116 Å²	116	117.1 Å²	117.1	81%	0.811	64%	0.64	S	S	*	*			trans	-89.2	47.8	-165.2	51.9	0	0	0	0	114.2
35	D	31.7	Very low	51.5	Low	108 Å²	108	110.1 Å²	110.1	58%	0.578	61%	0.608	S	S	*	*			trans	-103.1	94.6	-167.1	-59.8	-71	0	0	0	114.1	S33 K37	S33-D35 VanDerWaalsContact C-N 3.29Å; S33-D35 VanDerWaalsContact CB-OD2 3.29Å; S33-D35 WeakPolarHBondContact CB-OD2 3.41Å; S33-D35 PolarHBondContact O-N 2.96Å; S33-D35 VanDerWaalsContact O-N 3.09Å; S33-D35 PolarHBondContact OG-OD2 3.3Å; D35-K37 PolarHBondContact O-N 3.43Å
36	Y	37.2	Very low	54.3	Low	226 Å²	226	103.8 Å²	103.8	89%	0.886	57%	0.574	S	S	*	*	S	Bend	trans	49.2	-9.2	154.6	-78.7	-88	0	0	0	122.4	R38	Y36-R38 PolarHBondContact O-N 3.19Å
37	K	48.4	Very low	56.9	Low	162 Å²	162	101.4 Å²	101.4	70%	0.704	55%	0.554	S	S	*	*			trans	-97.7	45.7	177	-63.8	-174.8	177.6	-178.3	0	112.7	D35 H39 D40	D35-K37 PolarHBondContact O-N 3.43Å; K37-H39 PolarHBondContact O-N 3.48Å; K37-D40 PolarHBondContact O-N 3.03Å
38	R	58.2	Low	59.6	Low	214 Å²	214	99.5 Å²	99.5	81%	0.808	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-21.7	-149.2	-90.5	-176.8	174.9	163.1	1.6	118.7	Y36	Y36-R38 PolarHBondContact O-N 3.19Å
39	H	67.4	Low	62	Low	34 Å²	34	102 Å²	102	16%	0.157	54%	0.539	C	S	.	.	T	Hydrogen-bonded Turn	trans	-144	17.7	179.5	-53	-60.7	0	0	0	115.1	K37 D41 L42 K43 M64 L74	K37-H39 PolarHBondContact O-N 3.48Å; H39-D41 VanDerWaalsContact C-N 3.31Å; H39-D41 PolarHBondContact O-N 3.48Å; H39-L42 HydrophobicContact CB-CD1 4.3Å; H39-L42 PolarHBondContact O-N 3.37Å; H39-K43 WeakPolarHBondContact O-CG 3.31Å; H39-K43 PolarHBondContact O-N 2.89Å; H39-K43 VanDerWaalsContact O-N 3.14Å; H39-M64 VanDerWaalsContact CE1-SD 3.55Å; H39-L74 HydrophobicContact CB-CD1 4.03Å; H39-L74 HydrophobicContact CB-CD2 3.82Å; H39-L74 HydrophobicContact CB-CG 4.13Å
40	D	75.2	Confident	64.8	Low	75 Å²	75	105.2 Å²	105.2	40%	0.401	53%	0.534	S	S	.	.	H	α-helix	trans	-71.5	-28.1	-174.7	-65.5	-32.9	0	0	0	112.8	K37 K43 E44	K37-D40 PolarHBondContact O-N 3.03Å; D40-K43 PolarHBondContact O-N 3.48Å; D40-K43 WeakPolarHBondContact OD1-CE 3.49Å; D40-K43 IonicContact OD1-NZ 3.48Å; D40-K43 PolarHBondContact OD1-NZ 3.13Å; D40-E44 PolarHBondContact O-N 2.95Å
41	D	83.7	Confident	67.2	Low	71 Å²	71	104.1 Å²	104.1	38%	0.38	51%	0.509	S	S	.	.	H	α-helix	trans	-59.6	-44.3	168.5	68.5	-47.5	0	0	0	111.6	H39 K43 E44 M45 R60	H39-D41 VanDerWaalsContact C-N 3.31Å; H39-D41 PolarHBondContact O-N 3.48Å; D41-K43 VanDerWaalsContact C-N 3.34Å; D41-K43 PolarHBondContact O-N 3.07Å; D41-E44 PolarHBondContact O-N 3.25Å; D41-M45 WeakPolarHBondContact O-CB 3.44Å; D41-M45 VanDerWaalsContact O-CG 3.28Å; D41-M45 WeakPolarHBondContact O-CG 3.24Å; D41-M45 PolarHBondContact O-N 3.14Å; D41-R60 IonicContact OD2-NH1 3.09Å; D41-R60 PolarHBondContact OD2-NH1 3Å
42	L	85.2	Confident	69.5	Low	6 Å²	6	100.9 Å²	100.9	3%	0.031	50%	0.5	C	S	.	.	H	α-helix	trans	-67.7	-34.7	179	-61.3	175.9	0	0	0	111.6	H39 L46 A57 R60 I61 M64 L74	H39-L42 HydrophobicContact CB-CD1 4.3Å; H39-L42 PolarHBondContact O-N 3.37Å; L42-L46 WeakPolarHBondContact O-CB 3.17Å; L42-L46 VanDerWaalsContact O-CG 3.22Å; L42-L46 WeakPolarHBondContact O-CG 3.45Å; L42-L46 PolarHBondContact O-N 3.17Å; L42-A57 HydrophobicContact CD2-CB 4.24Å; L42-R60 HydrophobicContact CD2-CB 3.94Å; L42-R60 HydrophobicContact CD2-CG 4.43Å; L42-I61 HydrophobicContact CD1-CG1 4.06Å; L42-M64 HydrophobicContact CD1-CE 3.41Å; L42-M64 VanDerWaalsContact CD1-CE 3.41Å; L42-M64 HydrophobicContact CD1-SD 4.43Å; L42-L74 HydrophobicContact CB-CD1 4.33Å; L42-L74 HydrophobicContact CB-CD2 4.49Å; L42-L74 HydrophobicContact CD1-CD1 4.1Å
43	K	85.2	Confident	72.1	Confident	73 Å²	73	93 Å²	93	32%	0.317	47%	0.467	S	S	.	.	H	α-helix	trans	-63.1	-48.8	172.6	-64	170.9	-165	162.8	0	110.6	H39 D40 D41 M45 L46 D47 L74	H39-K43 WeakPolarHBondContact O-CG 3.31Å; H39-K43 PolarHBondContact O-N 2.89Å; H39-K43 VanDerWaalsContact O-N 3.14Å; D40-K43 PolarHBondContact O-N 3.48Å; D40-K43 WeakPolarHBondContact OD1-CE 3.49Å; D40-K43 IonicContact OD1-NZ 3.48Å; D40-K43 PolarHBondContact OD1-NZ 3.13Å; D41-K43 VanDerWaalsContact C-N 3.34Å; D41-K43 PolarHBondContact O-N 3.07Å; K43-M45 PolarHBondContact O-N 3.21Å; K43-L46 PolarHBondContact O-N 2.94Å; K43-D47 PolarHBondContact O-N 2.97Å; K43-L74 HydrophobicContact CD-CD2 4.31Å; K43-L74 HydrophobicContact CG-CD2 3.45Å; K43-L74 VanDerWaalsContact CG-CD2 3.45Å
44	E	86.1	Confident	74.9	Confident	142 Å²	142	89.2 Å²	89.2	66%	0.664	44%	0.438	S	S	*	.	H	α-helix	trans	-62.2	-41.5	178.9	-171.7	175.1	-175.6	0	0	112.2	D40 D41 L46 D47 T48	D40-E44 PolarHBondContact O-N 2.95Å; D41-E44 PolarHBondContact O-N 3.25Å; E44-L46 PolarHBondContact O-N 3.27Å; E44-D47 PolarHBondContact O-N 3.08Å; E44-T48 WeakPolarHBondContact O-CB 3.34Å; E44-T48 PolarHBondContact O-N 2.67Å; E44-T48 PolarHBondContact O-OG1 3.15Å
45	M	85.7	Confident	77.3	Confident	25 Å²	25	85 Å²	85	12%	0.123	41%	0.406	C	S	.	.	H	α-helix	trans	-64.8	-34.7	174.2	-70.1	175.5	73.8	0	0	113.1	D41 K43 L53 E56 A57	D41-M45 WeakPolarHBondContact O-CB 3.44Å; D41-M45 VanDerWaalsContact O-CG 3.28Å; D41-M45 WeakPolarHBondContact O-CG 3.24Å; D41-M45 PolarHBondContact O-N 3.14Å; K43-M45 PolarHBondContact O-N 3.21Å; M45-L53 HydrophobicContact CB-CB 4.44Å; M45-L53 HydrophobicContact CE-CD2 4.21Å; M45-E56 HydrophobicContact CE-CB 3.87Å; M45-E56 HydrophobicContact CE-CG 4.05Å; M45-A57 HydrophobicContact CB-CB 3.74Å; M45-A57 HydrophobicContact CE-CB 4.38Å
46	L	86.3	Confident	80.1	Confident	0 Å²	0	83.7 Å²	83.7	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-75	-33.3	175.9	-76.3	175.9	0	0	0	113.4	L42 K43 E44 K54 A57 M58 I61 A77 V78 N81	L42-L46 WeakPolarHBondContact O-CB 3.17Å; L42-L46 VanDerWaalsContact O-CG 3.22Å; L42-L46 WeakPolarHBondContact O-CG 3.45Å; L42-L46 PolarHBondContact O-N 3.17Å; K43-L46 PolarHBondContact O-N 2.94Å; E44-L46 PolarHBondContact O-N 3.27Å; L46-K54 VanDerWaalsContact O-CE 3.25Å; L46-K54 WeakPolarHBondContact O-CE 3.37Å; L46-A57 HydrophobicContact CD2-CB 3.99Å; L46-A57 HydrophobicContact CG-CB 3.96Å; L46-M58 HydrophobicContact CD2-CG 3.86Å; L46-M58 HydrophobicContact CD2-SD 3.71Å; L46-I61 HydrophobicContact CD1-CD1 3.73Å; L46-I61 HydrophobicContact CG-CD1 4.44Å; L46-A77 HydrophobicContact CB-CB 4.39Å; L46-A77 HydrophobicContact CD1-CB 3.91Å; L46-V78 HydrophobicContact CD1-CG2 3.79Å; L46-N81 PolarHBondContact O-ND2 3.07Å
47	D	86.5	Confident	82.7	Confident	75 Å²	75	73 Å²	73	40%	0.401	35%	0.354	S	S	.	.	H	α-helix	trans	-80.9	-23.4	178.5	-88.7	-27.1	0	0	0	113.2	K43 E44 K80	K43-D47 PolarHBondContact O-N 2.97Å; E44-D47 PolarHBondContact O-N 3.08Å; D47-K80 VanDerWaalsContact OD1-CD 3.31Å; D47-K80 WeakPolarHBondContact OD1-CD 3.33Å; D47-K80 VanDerWaalsContact OD1-CE 3.29Å; D47-K80 WeakPolarHBondContact OD1-CE 3.49Å; D47-K80 IonicContact OD1-NZ 2.62Å; D47-K80 PolarHBondContact OD1-NZ 3.14Å; D47-K80 IonicContact OD2-NZ 3.07Å
48	T	87.9	Confident	84.8	Confident	47 Å²	47	65.2 Å²	65.2	29%	0.288	32%	0.321	S	S	.	.	S	Bend	trans	-64	132.4	177.3	-65.3	0	0	0	0	112.1	E44 K50 L53 K54	E44-T48 WeakPolarHBondContact O-CB 3.34Å; E44-T48 PolarHBondContact O-N 2.67Å; E44-T48 PolarHBondContact O-OG1 3.15Å; T48-K50 HydrophobicContact CG2-CB 4.15Å; T48-K50 HydrophobicContact CG2-CD 4.4Å; T48-K50 HydrophobicContact CG2-CG 4.13Å; T48-K50 PolarHBondContact O-N 3.5Å; T48-L53 HydrophobicContact CG2-CD1 3.82Å; T48-K54 WeakPolarHBondContact O-CE 3.48Å
49	N	83.2	Confident	86.4	Confident	155 Å²	155	60.4 Å²	60.4	83%	0.829	31%	0.305	S	S	*	.	S	Bend	trans	-64.2	10.3	-179.2	-80	-27.7	0	0	0	116.6
50	K	89	Confident	87.5	Confident	133 Å²	133	63.8 Å²	63.8	58%	0.578	32%	0.317	S	S	*	.			trans	-101	108	178.9	-65.4	178.7	-179.2	174.6	0	110	T48 S52 L53 K54	T48-K50 HydrophobicContact CG2-CB 4.15Å; T48-K50 HydrophobicContact CG2-CD 4.4Å; T48-K50 HydrophobicContact CG2-CG 4.13Å; T48-K50 PolarHBondContact O-N 3.5Å; K50-S52 PolarHBondContact O-N 3.21Å; K50-L53 HydrophobicContact CB-CD1 4.21Å; K50-L53 HydrophobicContact CB-CG 4.31Å; K50-L53 HydrophobicContact CD-CD1 3.99Å; K50-L53 PolarHBondContact O-N 3.04Å; K50-K54 PolarHBondContact O-N 3.01Å
51	D	86.9	Confident	88.2	Confident	59 Å²	59	60.2 Å²	60.2	32%	0.316	30%	0.298	S	S	.	.	H	α-helix	trans	-57.8	-22	-178.9	-75.8	-12.5	0	0	0	113.8	L55 C84 N86	D51-L55 WeakPolarHBondContact O-CB 3.48Å; D51-L55 PolarHBondContact O-N 3.35Å; D51-C84 PolarHBondContact OD1-SG 3.02Å; D51-C84 VanDerWaalsContact OD1-SG 3.36Å; D51-N86 HydrophobicContact CB-CB 4.22Å
52	S	88.6	Confident	88.5	Confident	80 Å²	80	58.8 Å²	58.8	56%	0.559	29%	0.291	S	S	*	.	H	α-helix	trans	-68.2	-41.7	173	52.6	0	0	0	0	113.6	K50 L55 E56	K50-S52 PolarHBondContact O-N 3.21Å; S52-L55 WeakPolarHBondContact O-CB 3.24Å; S52-L55 PolarHBondContact O-N 2.93Å; S52-E56 PolarHBondContact O-N 3.35Å
53	L	89.3	Confident	88.7	Confident	51 Å²	51	60.6 Å²	60.6	27%	0.267	31%	0.308	S	S	.	.	H	α-helix	trans	-70.2	-36.2	176	-66.1	174.7	0	0	0	110.8	M45 T48 K50 E56 A57	M45-L53 HydrophobicContact CB-CB 4.44Å; M45-L53 HydrophobicContact CE-CD2 4.21Å; T48-L53 HydrophobicContact CG2-CD1 3.82Å; K50-L53 HydrophobicContact CB-CD1 4.21Å; K50-L53 HydrophobicContact CB-CG 4.31Å; K50-L53 HydrophobicContact CD-CD1 3.99Å; K50-L53 PolarHBondContact O-N 3.04Å; L53-E56 PolarHBondContact O-N 3.28Å; L53-A57 WeakPolarHBondContact O-CB 3.31Å; L53-A57 PolarHBondContact O-N 2.94Å
54	K	90.4	Very high	88.9	Confident	21 Å²	21	58.8 Å²	58.8	9%	0.091	30%	0.3	C	S	.	.	H	α-helix	trans	-61.9	-43	171.6	-59	-173.7	179.4	-162.4	0	111.9	L46 T48 K50 M58 N81 V89	L46-K54 VanDerWaalsContact O-CE 3.25Å; L46-K54 WeakPolarHBondContact O-CE 3.37Å; T48-K54 WeakPolarHBondContact O-CE 3.48Å; K50-K54 PolarHBondContact O-N 3.01Å; K54-M58 WeakPolarHBondContact O-CB 3.4Å; K54-M58 VanDerWaalsContact O-CG 3.29Å; K54-M58 WeakPolarHBondContact O-CG 3.48Å; K54-M58 PolarHBondContact O-N 3.3Å; K54-N81 WeakPolarHBondContact CD-OD1 3.15Å; K54-N81 WeakPolarHBondContact CE-OD1 3.26Å; K54-N81 PolarHBondContact NZ-OD1 3.44Å; K54-V89 HydrophobicContact CB-CG1 4.18Å; K54-V89 HydrophobicContact CB-CG2 4.31Å
55	L	90.9	Very high	89	Confident	27 Å²	27	54.1 Å²	54.1	14%	0.141	28%	0.28	C	S	.	.	H	α-helix	trans	-60.7	-46.6	176	-173.5	77	0	0	0	111.2	D51 S52 M58 K59 E88 V89 L92	D51-L55 WeakPolarHBondContact O-CB 3.48Å; D51-L55 PolarHBondContact O-N 3.35Å; S52-L55 WeakPolarHBondContact O-CB 3.24Å; S52-L55 PolarHBondContact O-N 2.93Å; L55-M58 PolarHBondContact O-N 2.84Å; L55-K59 HydrophobicContact CG-CD 4.29Å; L55-K59 WeakPolarHBondContact O-CB 3.43Å; L55-K59 VanDerWaalsContact O-CG 3.31Å; L55-K59 WeakPolarHBondContact O-CG 3.36Å; L55-K59 PolarHBondContact O-N 2.96Å; L55-E88 HydrophobicContact CD1-CB 3.51Å; L55-E88 WeakPolarHBondContact CD1-OE2 3.11Å; L55-V89 HydrophobicContact CB-CG2 3.98Å; L55-V89 HydrophobicContact CD1-CG2 3.99Å; L55-L92 HydrophobicContact CD1-CD1 4.07Å
56	E	90.2	Very high	89.3	Confident	82 Å²	82	57 Å²	57	38%	0.383	31%	0.308	S	S	.	.	H	α-helix	trans	-64.4	-47	178.8	-166	-171	163.9	0	0	111.7	M45 S52 L53 M58 K59 R60	M45-E56 HydrophobicContact CE-CB 3.87Å; M45-E56 HydrophobicContact CE-CG 4.05Å; S52-E56 PolarHBondContact O-N 3.35Å; L53-E56 PolarHBondContact O-N 3.28Å; E56-M58 PolarHBondContact O-N 3.37Å; E56-K59 PolarHBondContact O-N 3.15Å; E56-R60 WeakPolarHBondContact O-CG 3.44Å; E56-R60 PolarHBondContact O-N 3.06Å; E56-R60 IonicContact OE1-CZ 3.33Å; E56-R60 IonicContact OE1-NE 3.2Å; E56-R60 PolarHBondContact OE1-NE 3.16Å; E56-R60 IonicContact OE1-NH2 2.68Å; E56-R60 PolarHBondContact OE1-NH2 3.26Å
57	A	91.6	Very high	89.5	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-59.2	-45.9	175.8	0	0	0	0	0	111.8	L42 M45 L46 L53 K59 R60 I61	L42-A57 HydrophobicContact CD2-CB 4.24Å; M45-A57 HydrophobicContact CB-CB 3.74Å; M45-A57 HydrophobicContact CE-CB 4.38Å; L46-A57 HydrophobicContact CD2-CB 3.99Å; L46-A57 HydrophobicContact CG-CB 3.96Å; L53-A57 WeakPolarHBondContact O-CB 3.31Å; L53-A57 PolarHBondContact O-N 2.94Å; A57-K59 PolarHBondContact O-N 3.4Å; A57-R60 PolarHBondContact O-N 3.24Å; A57-I61 WeakPolarHBondContact O-CB 3.38Å; A57-I61 WeakPolarHBondContact O-CD1 3.34Å; A57-I61 WeakPolarHBondContact O-CG1 3.43Å; A57-I61 PolarHBondContact O-N 3.17Å
58	M	92.4	Very high	89.6	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-63.8	-37.1	175.9	-73.6	-53.6	-51	0	0	112.8	L46 K54 L55 E56 I61 V62 V78 V89 L92 V93	L46-M58 HydrophobicContact CD2-CG 3.86Å; L46-M58 HydrophobicContact CD2-SD 3.71Å; K54-M58 WeakPolarHBondContact O-CB 3.4Å; K54-M58 VanDerWaalsContact O-CG 3.29Å; K54-M58 WeakPolarHBondContact O-CG 3.48Å; K54-M58 PolarHBondContact O-N 3.3Å; L55-M58 PolarHBondContact O-N 2.84Å; E56-M58 PolarHBondContact O-N 3.37Å; M58-I61 PolarHBondContact O-N 3.03Å; M58-I61 HydrophobicContact SD-CD1 4.19Å; M58-V62 WeakPolarHBondContact O-CG2 3.48Å; M58-V62 PolarHBondContact O-N 2.79Å; M58-V78 HydrophobicContact CE-CG1 3.94Å; M58-V78 HydrophobicContact CE-CG2 4.49Å; M58-V78 HydrophobicContact SD-CG1 3.94Å; M58-V78 HydrophobicContact SD-CG2 3.93Å; M58-V89 HydrophobicContact CG-CG1 4.42Å; M58-L92 HydrophobicContact CB-CB 3.83Å; M58-L92 HydrophobicContact CB-CD1 3.72Å; M58-L92 HydrophobicContact CB-CG 4.43Å; M58-L92 HydrophobicContact CE-CB 4.09Å; M58-L92 HydrophobicContact CG-CB 4.42Å; M58-V93 HydrophobicContact CE-CG2 4.1Å; M58-V93 HydrophobicContact CG-CG2 4.26Å; M58-V93 HydrophobicContact SD-CG2 3.99Å
59	K	92.5	Very high	89.5	Confident	112 Å²	112	70 Å²	70	49%	0.487	37%	0.37	S	S	.	.	H	α-helix	trans	-63.7	-44.7	172.9	-76.5	176	179.3	179.4	0	111.2	L55 E56 A57 I61 V62 A63 L92	L55-K59 HydrophobicContact CG-CD 4.29Å; L55-K59 WeakPolarHBondContact O-CB 3.43Å; L55-K59 VanDerWaalsContact O-CG 3.31Å; L55-K59 WeakPolarHBondContact O-CG 3.36Å; L55-K59 PolarHBondContact O-N 2.96Å; E56-K59 PolarHBondContact O-N 3.15Å; A57-K59 PolarHBondContact O-N 3.4Å; K59-I61 PolarHBondContact O-N 3.39Å; K59-V62 PolarHBondContact O-N 3.46Å; K59-A63 WeakPolarHBondContact O-CB 3.19Å; K59-A63 PolarHBondContact O-N 3.03Å; K59-L92 HydrophobicContact CG-CD1 3.88Å
60	R	90.2	Very high	89.6	Confident	106 Å²	106	68.7 Å²	68.7	40%	0.4	36%	0.363	S	S	.	.	H	α-helix	trans	-59.7	-44.1	173.9	-68.2	174.4	-176.4	-160.4	3.8	111.6	D41 L42 E56 A57 A63 M64	D41-R60 IonicContact OD2-NH1 3.09Å; D41-R60 PolarHBondContact OD2-NH1 3Å; L42-R60 HydrophobicContact CD2-CB 3.94Å; L42-R60 HydrophobicContact CD2-CG 4.43Å; E56-R60 WeakPolarHBondContact O-CG 3.44Å; E56-R60 PolarHBondContact O-N 3.06Å; E56-R60 IonicContact OE1-CZ 3.33Å; E56-R60 IonicContact OE1-NE 3.2Å; E56-R60 PolarHBondContact OE1-NE 3.16Å; E56-R60 IonicContact OE1-NH2 2.68Å; E56-R60 PolarHBondContact OE1-NH2 3.26Å; A57-R60 PolarHBondContact O-N 3.24Å; R60-A63 PolarHBondContact O-N 3.34Å; R60-M64 WeakPolarHBondContact O-CG 3.38Å; R60-M64 PolarHBondContact O-N 3.04Å
61	I	91.2	Very high	89.5	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-64.1	-47.9	179	-68.7	163	0	0	0	111.7	L42 L46 A57 M58 K59 A63 M64 I65 A71 L74 V78 Y96	L42-I61 HydrophobicContact CD1-CG1 4.06Å; L46-I61 HydrophobicContact CD1-CD1 3.73Å; L46-I61 HydrophobicContact CG-CD1 4.44Å; A57-I61 WeakPolarHBondContact O-CB 3.38Å; A57-I61 WeakPolarHBondContact O-CD1 3.34Å; A57-I61 WeakPolarHBondContact O-CG1 3.43Å; A57-I61 PolarHBondContact O-N 3.17Å; M58-I61 PolarHBondContact O-N 3.03Å; M58-I61 HydrophobicContact SD-CD1 4.19Å; K59-I61 PolarHBondContact O-N 3.39Å; I61-A63 VanDerWaalsContact C-N 3.29Å; I61-A63 PolarHBondContact O-N 3.44Å; I61-M64 HydrophobicContact CG1-CE 4.1Å; I61-M64 WeakPolarHBondContact O-CB 3.42Å; I61-M64 PolarHBondContact O-N 3.22Å; I61-M64 VanDerWaalsContact O-N 3.1Å; I61-I65 HydrophobicContact CG2-CD1 3.99Å; I61-I65 WeakPolarHBondContact O-CG1 3.37Å; I61-I65 PolarHBondContact O-N 2.9Å; I61-A71 HydrophobicContact CG2-CB 4.27Å; I61-L74 HydrophobicContact CD1-CD1 3.73Å; I61-L74 HydrophobicContact CG1-CD1 3.68Å; I61-V78 HydrophobicContact CD1-CG2 4.26Å; I61-Y96 HydrophobicContact CG2-CD2 3.65Å; I61-Y96 HydrophobicContact CG2-CE2 3.76Å
62	V	90.1	Very high	89.4	Confident	40 Å²	40	61.1 Å²	61.1	24%	0.242	33%	0.332	C	S	.	.	H	α-helix	trans	-64.5	-35.4	177	173.7	0	0	0	0	111.1	M58 K59 M64 I65 A66 L92	M58-V62 WeakPolarHBondContact O-CG2 3.48Å; M58-V62 PolarHBondContact O-N 2.79Å; K59-V62 PolarHBondContact O-N 3.46Å; V62-M64 VanDerWaalsContact C-N 3.34Å; V62-M64 PolarHBondContact O-N 3.07Å; V62-I65 PolarHBondContact O-N 3.16Å; V62-A66 WeakPolarHBondContact O-CB 3.26Å; V62-A66 PolarHBondContact O-N 3.38Å; V62-L92 HydrophobicContact CG2-CD2 4.16Å
63	A	89.7	Confident	89.3	Confident	45 Å²	45	62.9 Å²	62.9	37%	0.372	34%	0.335	S	S	.	.	H	α-helix	trans	-67.6	-28.5	172.6	0	0	0	0	0	113.8	K59 R60 I61 R67	K59-A63 WeakPolarHBondContact O-CB 3.19Å; K59-A63 PolarHBondContact O-N 3.03Å; R60-A63 PolarHBondContact O-N 3.34Å; I61-A63 VanDerWaalsContact C-N 3.29Å; I61-A63 PolarHBondContact O-N 3.44Å; A63-R67 WeakPolarHBondContact O-CD 3.11Å; A63-R67 VanDerWaalsContact O-CG 3.25Å; A63-R67 WeakPolarHBondContact O-CG 3.23Å; A63-R67 PolarHBondContact O-N 3.23Å
64	M	87.5	Confident	89.3	Confident	34 Å²	34	60.5 Å²	60.5	17%	0.167	32%	0.322	C	S	.	.	H	α-helix	trans	-70.4	-43.3	170.5	-71.8	-169.5	-60.8	0	0	111.6	H39 L42 R60 I61 V62 R67 G68 K69 L74	H39-M64 VanDerWaalsContact CE1-SD 3.55Å; L42-M64 HydrophobicContact CD1-CE 3.41Å; L42-M64 VanDerWaalsContact CD1-CE 3.41Å; L42-M64 HydrophobicContact CD1-SD 4.43Å; R60-M64 WeakPolarHBondContact O-CG 3.38Å; R60-M64 PolarHBondContact O-N 3.04Å; I61-M64 HydrophobicContact CG1-CE 4.1Å; I61-M64 WeakPolarHBondContact O-CB 3.42Å; I61-M64 PolarHBondContact O-N 3.22Å; I61-M64 VanDerWaalsContact O-N 3.1Å; V62-M64 VanDerWaalsContact C-N 3.34Å; V62-M64 PolarHBondContact O-N 3.07Å; M64-R67 CarbonylContact O-C 3.44Å; M64-R67 WeakPolarHBondContact O-CA 3.34Å; M64-R67 PolarHBondContact O-N 3.1Å; M64-R67 VanDerWaalsContact O-N 3.08Å; M64-G68 PolarHBondContact O-N 3.42Å; M64-K69 HydrophobicContact CB-CB 4.23Å; M64-K69 WeakPolarHBondContact O-CB 3.28Å; M64-K69 PolarHBondContact O-N 3.45Å; M64-L74 HydrophobicContact CE-CD1 4.4Å
65	I	89.8	Confident	89.2	Confident	44 Å²	44	59.5 Å²	59.5	23%	0.226	32%	0.318	C	S	.	.	H	α-helix	trans	-63.6	-43	177.3	-64.2	161.9	0	0	0	110.8	I61 V62 R67 G68 A71 Y96 Y100	I61-I65 HydrophobicContact CG2-CD1 3.99Å; I61-I65 WeakPolarHBondContact O-CG1 3.37Å; I61-I65 PolarHBondContact O-N 2.9Å; V62-I65 PolarHBondContact O-N 3.16Å; I65-R67 PolarHBondContact O-N 3.13Å; I65-G68 PolarHBondContact O-N 3.11Å; I65-A71 HydrophobicContact CD1-CB 4.38Å; I65-A71 HydrophobicContact CG1-CB 4.06Å; I65-Y96 HydrophobicContact CD1-CD2 3.6Å; I65-Y96 HydrophobicContact CD1-CE2 4.06Å; I65-Y100 HydrophobicContact CD1-CE2 3.74Å; I65-Y100 HydrophobicContact CG1-CE2 4.02Å
66	A	90.4	Very high	89.1	Confident	87 Å²	87	61.7 Å²	61.7	72%	0.719	33%	0.334	S	S	*	.	H	α-helix	trans	-63.6	-19.8	174.7	0	0	0	0	0	113.5	V62	V62-A66 WeakPolarHBondContact O-CB 3.26Å; V62-A66 PolarHBondContact O-N 3.38Å
67	R	91.8	Very high	88.9	Confident	200 Å²	200	58.4 Å²	58.4	76%	0.755	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	14.4	172.4	-69.2	171.2	175.6	-179.3	-3.2	112.9	A63 M64 I65 K69	A63-R67 WeakPolarHBondContact O-CD 3.11Å; A63-R67 VanDerWaalsContact O-CG 3.25Å; A63-R67 WeakPolarHBondContact O-CG 3.23Å; A63-R67 PolarHBondContact O-N 3.23Å; M64-R67 CarbonylContact O-C 3.44Å; M64-R67 WeakPolarHBondContact O-CA 3.34Å; M64-R67 PolarHBondContact O-N 3.1Å; M64-R67 VanDerWaalsContact O-N 3.08Å; I65-R67 PolarHBondContact O-N 3.13Å; R67-K69 VanDerWaalsContact C-N 3.25Å; R67-K69 PolarHBondContact O-N 3.33Å
68	G	87.4	Confident	88.8	Confident	66 Å²	66	58.4 Å²	58.4	68%	0.68	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	15.9	179.2	0	0	0	0	0	115	M64 I65	M64-G68 PolarHBondContact O-N 3.42Å; I65-G68 PolarHBondContact O-N 3.11Å
69	K	87.4	Confident	88.6	Confident	128 Å²	128	59.2 Å²	59.2	56%	0.557	33%	0.326	S	S	*	.			trans	-88.7	131.6	178.8	-60.7	-168.9	177.2	-168.7	0	110.9	M64 R67 A71	M64-K69 HydrophobicContact CB-CB 4.23Å; M64-K69 WeakPolarHBondContact O-CB 3.28Å; M64-K69 PolarHBondContact O-N 3.45Å; R67-K69 VanDerWaalsContact C-N 3.25Å; R67-K69 PolarHBondContact O-N 3.33Å; K69-A71 PolarHBondContact O-N 2.6Å
70	N	84.6	Confident	88.3	Confident	127 Å²	127	60.5 Å²	60.5	68%	0.679	33%	0.331	S	S	*	.			trans	-61.4	132.5	174.8	-66.8	-8.5	0	0	0	110.5
71	A	86.5	Confident	88.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.313	C	S	.	.			trans	-132.1	22.4	178.7	0	0	0	0	0	111.5	I61 I65 K69 D73 L74 Y96 Y100	I61-A71 HydrophobicContact CG2-CB 4.27Å; I65-A71 HydrophobicContact CD1-CB 4.38Å; I65-A71 HydrophobicContact CG1-CB 4.06Å; K69-A71 PolarHBondContact O-N 2.6Å; A71-D73 VanDerWaalsContact C-N 3.26Å; A71-D73 PolarHBondContact O-N 2.89Å; A71-L74 PolarHBondContact O-N 3.48Å; A71-Y96 HydrophobicContact CB-CE2 4.28Å; A71-Y96 PolarHBondContact O-OH 2.91Å; A71-Y100 HydrophobicContact CB-CE2 4.31Å; A71-Y100 PolarHBondContact N-OH 3.43Å
72	S	85.7	Confident	88	Confident	34 Å²	34	55.8 Å²	55.8	24%	0.238	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-51.4	-41.8	175.9	42.2	0	0	0	0	112.7	L74 F75	S72-L74 PolarHBondContact O-N 3Å; S72-F75 VanDerWaalsContact O-CB 3.22Å; S72-F75 WeakPolarHBondContact O-CB 3.33Å; S72-F75 PolarHBondContact O-N 3.12Å
73	D	86.6	Confident	87.7	Confident	116 Å²	116	56.7 Å²	56.7	62%	0.62	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-68.6	-8.8	-171	-51	1.9	0	0	0	113.1	A71	A71-D73 VanDerWaalsContact C-N 3.26Å; A71-D73 PolarHBondContact O-N 2.89Å
74	L	88.1	Confident	87.5	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-96.3	-4.4	176.1	-65.4	174	0	0	0	113.2	H39 L42 K43 I61 M64 A71 S72 P76 A77 V78	H39-L74 HydrophobicContact CB-CD1 4.03Å; H39-L74 HydrophobicContact CB-CD2 3.82Å; H39-L74 HydrophobicContact CB-CG 4.13Å; L42-L74 HydrophobicContact CB-CD1 4.33Å; L42-L74 HydrophobicContact CB-CD2 4.49Å; L42-L74 HydrophobicContact CD1-CD1 4.1Å; K43-L74 HydrophobicContact CD-CD2 4.31Å; K43-L74 HydrophobicContact CG-CD2 3.45Å; K43-L74 VanDerWaalsContact CG-CD2 3.45Å; I61-L74 HydrophobicContact CD1-CD1 3.73Å; I61-L74 HydrophobicContact CG1-CD1 3.68Å; M64-L74 HydrophobicContact CE-CD1 4.4Å; A71-L74 PolarHBondContact O-N 3.48Å; S72-L74 PolarHBondContact O-N 3Å; L74-P76 VanDerWaalsContact C-CD 3.49Å; L74-A77 PolarHBondContact O-N 2.57Å; L74-V78 HydrophobicContact CB-CG2 4.32Å; L74-V78 WeakPolarHBondContact O-CG2 3.3Å; L74-V78 PolarHBondContact O-N 3.38Å
75	F	88.2	Confident	87.4	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-53.1	-44.5	-172.7	-164	-89.5	0	0	0	113.7	S72 A77 V78 V79 Y96 L97 Q104 L107 A108	S72-F75 VanDerWaalsContact O-CB 3.22Å; S72-F75 WeakPolarHBondContact O-CB 3.33Å; S72-F75 PolarHBondContact O-N 3.12Å; F75-A77 PolarHBondContact O-N 2.92Å; F75-V78 PolarHBondContact O-N 3.37Å; F75-V79 HydrophobicContact CD1-CG2 3.63Å; F75-V79 HydrophobicContact CE1-CG2 3.38Å; F75-V79 HydrophobicContact CG-CG2 4.38Å; F75-V79 HydrophobicContact CZ-CG2 3.95Å; F75-V79 WeakPolarHBondContact O-CB 3.46Å; F75-V79 VanDerWaalsContact O-CG2 3.29Å; F75-V79 WeakPolarHBondContact O-CG2 3.48Å; F75-V79 PolarHBondContact O-N 2.85Å; F75-Y96 VanDerWaalsContact CA-OH 3.26Å; F75-Y96 WeakPolarHBondContact CA-OH 3.44Å; F75-Y96 HydrophobicContact CB-CE1 4.31Å; F75-Y96 HydrophobicContact CD2-CD1 4.4Å; F75-Y96 AromaticContact CD2-CE1 3.49Å; F75-Y96 HydrophobicContact CD2-CE1 3.49Å; F75-Y96 VanDerWaalsContact CD2-CE1 3.49Å; F75-Y96 HydrophobicContact CE2-CE1 4.15Å; F75-Y96 HydrophobicContact CG-CE1 4.2Å; F75-Y96 PolarHBondContact N-OH 3.4Å; F75-L97 HydrophobicContact CE1-CD2 4.47Å; F75-L97 HydrophobicContact CE2-CD2 3.79Å; F75-L97 HydrophobicContact CZ-CD2 3.66Å; F75-Q104 HydrophobicContact CD1-CB 3.78Å; F75-Q104 HydrophobicContact CD1-CG 4.39Å; F75-Q104 HydrophobicContact CD2-CB 4.25Å; F75-Q104 HydrophobicContact CE1-CB 3.76Å; F75-Q104 HydrophobicContact CE2-CB 4.26Å; F75-Q104 HydrophobicContact CG-CB 4.04Å; F75-Q104 HydrophobicContact CG-CG 4.28Å; F75-Q104 HydrophobicContact CZ-CB 4.02Å; F75-L107 HydrophobicContact CD1-CB 3.72Å; F75-L107 HydrophobicContact CD1-CD1 4.06Å; F75-L107 HydrophobicContact CE1-CB 3.56Å; F75-A108 HydrophobicContact CE1-CB 4.49Å; F75-A108 HydrophobicContact CZ-CB 4.12Å
76	P	88.4	Confident	87.3	Confident	74 Å²	74	63.2 Å²	63.2	48%	0.481	35%	0.347	S	S	.	.	H	α-helix	trans	-62.5	-40.3	177	-20.6	32.4	0	0	0	113.5	L74 K80 L107	L74-P76 VanDerWaalsContact C-CD 3.49Å; P76-K80 PolarHBondContact O-N 3.37Å; P76-K80 VanDerWaalsContact O-N 3.15Å; P76-L107 HydrophobicContact CG-CD1 4.07Å
77	A	87.3	Confident	87	Confident	13 Å²	13	63 Å²	63	11%	0.107	33%	0.333	C	S	.	.	H	α-helix	trans	-71.1	-31.4	-179.9	0	0	0	0	0	112.1	L46 L74 F75 N81	L46-A77 HydrophobicContact CB-CB 4.39Å; L46-A77 HydrophobicContact CD1-CB 3.91Å; L74-A77 PolarHBondContact O-N 2.57Å; F75-A77 PolarHBondContact O-N 2.92Å; A77-N81 PolarHBondContact O-ND2 3.44Å
78	V	89.6	Confident	86.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-77.2	-43.2	175.3	-179.7	0	0	0	0	111.4	L46 M58 I61 L74 F75 K80 N81 V93 Y96	L46-V78 HydrophobicContact CD1-CG2 3.79Å; M58-V78 HydrophobicContact CE-CG1 3.94Å; M58-V78 HydrophobicContact CE-CG2 4.49Å; M58-V78 HydrophobicContact SD-CG1 3.94Å; M58-V78 HydrophobicContact SD-CG2 3.93Å; I61-V78 HydrophobicContact CD1-CG2 4.26Å; L74-V78 HydrophobicContact CB-CG2 4.32Å; L74-V78 WeakPolarHBondContact O-CG2 3.3Å; L74-V78 PolarHBondContact O-N 3.38Å; F75-V78 PolarHBondContact O-N 3.37Å; V78-K80 VanDerWaalsContact C-N 3.31Å; V78-K80 PolarHBondContact O-N 3.15Å; V78-N81 PolarHBondContact O-N 3.12Å; V78-V93 HydrophobicContact CG1-CB 4.32Å; V78-V93 HydrophobicContact CG1-CG1 3.98Å; V78-V93 HydrophobicContact CG1-CG2 4.09Å; V78-Y96 HydrophobicContact CB-CD1 3.87Å; V78-Y96 HydrophobicContact CB-CE1 3.75Å; V78-Y96 HydrophobicContact CB-CG 4.47Å; V78-Y96 HydrophobicContact CG1-CD1 3.37Å; V78-Y96 HydrophobicContact CG1-CE1 3.81Å; V78-Y96 HydrophobicContact CG1-CG 3.78Å; V78-Y96 HydrophobicContact CG2-CD1 4.27Å; V78-Y96 HydrophobicContact CG2-CD2 4.47Å; V78-Y96 HydrophobicContact CG2-CE1 4.02Å; V78-Y96 HydrophobicContact CG2-CE2 4.28Å; V78-Y96 HydrophobicContact CG2-CG 4.49Å
79	V	87.8	Confident	86.9	Confident	17 Å²	17	55.2 Å²	55.2	10%	0.103	29%	0.287	C	S	.	.	H	α-helix	trans	-56.5	-42.2	175.2	164.5	0	0	0	0	111.8	F75 N81 V82 L97 L110	F75-V79 HydrophobicContact CD1-CG2 3.63Å; F75-V79 HydrophobicContact CE1-CG2 3.38Å; F75-V79 HydrophobicContact CG-CG2 4.38Å; F75-V79 HydrophobicContact CZ-CG2 3.95Å; F75-V79 WeakPolarHBondContact O-CB 3.46Å; F75-V79 VanDerWaalsContact O-CG2 3.29Å; F75-V79 WeakPolarHBondContact O-CG2 3.48Å; F75-V79 PolarHBondContact O-N 2.85Å; V79-N81 PolarHBondContact O-N 3.03Å; V79-V82 WeakPolarHBondContact O-CB 3.32Å; V79-V82 WeakPolarHBondContact O-CG2 3.45Å; V79-V82 PolarHBondContact O-N 3.46Å; V79-V82 VanDerWaalsContact O-N 3.14Å; V79-L97 HydrophobicContact CG2-CD2 3.86Å; V79-L110 HydrophobicContact CG1-CB 4.25Å
80	K	86.8	Confident	86.9	Confident	138 Å²	138	50.3 Å²	50.3	60%	0.6	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-24.7	175.7	-173.4	175.3	174.9	-175.9	0	113.4	D47 P76 V78	D47-K80 VanDerWaalsContact OD1-CD 3.31Å; D47-K80 WeakPolarHBondContact OD1-CD 3.33Å; D47-K80 VanDerWaalsContact OD1-CE 3.29Å; D47-K80 WeakPolarHBondContact OD1-CE 3.49Å; D47-K80 IonicContact OD1-NZ 2.62Å; D47-K80 PolarHBondContact OD1-NZ 3.14Å; D47-K80 IonicContact OD2-NZ 3.07Å; P76-K80 PolarHBondContact O-N 3.37Å; P76-K80 VanDerWaalsContact O-N 3.15Å; V78-K80 VanDerWaalsContact C-N 3.31Å; V78-K80 PolarHBondContact O-N 3.15Å
81	N	88.1	Confident	87.1	Confident	5 Å²	5	50.7 Å²	50.7	3%	0.027	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	1.4	-176.4	-76.8	-64.1	0	0	0	115.1	L46 K54 A77 V78 V79 A83 C84 V93	L46-N81 PolarHBondContact O-ND2 3.07Å; K54-N81 WeakPolarHBondContact CD-OD1 3.15Å; K54-N81 WeakPolarHBondContact CE-OD1 3.26Å; K54-N81 PolarHBondContact NZ-OD1 3.44Å; A77-N81 PolarHBondContact O-ND2 3.44Å; V78-N81 PolarHBondContact O-N 3.12Å; V79-N81 PolarHBondContact O-N 3.03Å; N81-A83 PolarHBondContact O-N 2.91Å; N81-A83 VanDerWaalsContact O-N 3.17Å; N81-C84 WeakPolarHBondContact O-CB 3.1Å; N81-C84 PolarHBondContact O-N 2.94Å; N81-V93 HydrophobicContact CB-CG2 4.25Å
82	V	86.2	Confident	87.3	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.018	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-31.1	174.9	177.3	0	0	0	0	112.8	V79 C84 V93 Y94 L97 T114 F115	V79-V82 WeakPolarHBondContact O-CB 3.32Å; V79-V82 WeakPolarHBondContact O-CG2 3.45Å; V79-V82 PolarHBondContact O-N 3.46Å; V79-V82 VanDerWaalsContact O-N 3.14Å; V82-C84 VanDerWaalsContact C-N 3.35Å; V82-V93 HydrophobicContact CB-CG1 4.32Å; V82-V93 HydrophobicContact CG2-CG1 3.52Å; V82-Y94 HydrophobicContact CG1-CE1 4.23Å; V82-L97 HydrophobicContact CG2-CD1 3.59Å; V82-T114 HydrophobicContact CG1-CG2 3.77Å; V82-F115 HydrophobicContact CG1-CZ 4.46Å
83	A	83.9	Confident	87.6	Confident	58 Å²	58	50.7 Å²	50.7	48%	0.479	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	9.9	179.3	0	0	0	0	0	114.5	N81 T114	N81-A83 PolarHBondContact O-N 2.91Å; N81-A83 VanDerWaalsContact O-N 3.17Å; A83-T114 HydrophobicContact CB-CG2 4.1Å
84	C	85.2	Confident	87.8	Confident	15 Å²	15	45.7 Å²	45.7	10%	0.101	23%	0.231	C	C	.	.			trans	-59.6	145	175.3	-178.7	0	0	0	0	111.7	D51 N81 V82 N86 V89	D51-C84 PolarHBondContact OD1-SG 3.02Å; D51-C84 VanDerWaalsContact OD1-SG 3.36Å; N81-C84 WeakPolarHBondContact O-CB 3.1Å; N81-C84 PolarHBondContact O-N 2.94Å; V82-C84 VanDerWaalsContact C-N 3.35Å; C84-N86 PolarHBondContact SG-N 2.84Å; C84-N86 VanDerWaalsContact SG-N 3.35Å; C84-V89 HydrophobicContact CB-CG1 4.2Å
85	K	85	Confident	87.8	Confident	199 Å²	199	49.7 Å²	49.7	87%	0.865	26%	0.255	S	S	*	.	S	Bend	trans	-78.6	-28.5	176.8	-66.3	-175.8	-179.9	-179.4	0	112.6	I87	K85-I87 PolarHBondContact O-N 3.13Å
86	N	87.8	Confident	87.9	Confident	46 Å²	46	49.7 Å²	49.7	25%	0.246	26%	0.256	C	S	.	.			trans	-68.9	118.9	178.1	-175.6	-20.6	0	0	0	110.5	D51 C84 E88 V89 K90	D51-N86 HydrophobicContact CB-CB 4.22Å; C84-N86 PolarHBondContact SG-N 2.84Å; C84-N86 VanDerWaalsContact SG-N 3.35Å; N86-E88 VanDerWaalsContact C-N 3.28Å; N86-E88 PolarHBondContact O-N 2.68Å; N86-E88 WeakPolarHBondContact OD1-CB 3.32Å; N86-E88 PolarHBondContact OD1-N 2.96Å; N86-V89 HydrophobicContact CB-CB 4.24Å; N86-V89 HydrophobicContact CB-CG2 3.98Å; N86-V89 PolarHBondContact O-N 3.47Å; N86-K90 VanDerWaalsContact O-CB 3.3Å; N86-K90 WeakPolarHBondContact O-CB 3.43Å; N86-K90 PolarHBondContact O-N 3.3Å
87	I	84.7	Confident	88	Confident	84 Å²	84	46.2 Å²	46.2	43%	0.431	23%	0.233	S	C	.	.	H	α-helix	trans	-63.6	-32.1	-177.2	-59.3	174.8	0	0	0	111.6	K85 K91	K85-I87 PolarHBondContact O-N 3.13Å; I87-K91 HydrophobicContact CG2-CD 4.39Å; I87-K91 WeakPolarHBondContact O-CB 3.47Å; I87-K91 VanDerWaalsContact O-CG 3.27Å; I87-K91 WeakPolarHBondContact O-CG 3.31Å; I87-K91 PolarHBondContact O-N 2.91Å
88	E	87.8	Confident	88	Confident	101 Å²	101	48.4 Å²	48.4	47%	0.472	25%	0.245	S	C	.	.	H	α-helix	trans	-70.9	-48.9	178.2	-62.5	-173.3	-177.2	0	0	112.1	L55 N86 K90 K91 L92	L55-E88 HydrophobicContact CD1-CB 3.51Å; L55-E88 WeakPolarHBondContact CD1-OE2 3.11Å; N86-E88 VanDerWaalsContact C-N 3.28Å; N86-E88 PolarHBondContact O-N 2.68Å; N86-E88 WeakPolarHBondContact OD1-CB 3.32Å; N86-E88 PolarHBondContact OD1-N 2.96Å; E88-K90 VanDerWaalsContact C-N 3.27Å; E88-K90 PolarHBondContact O-N 3.06Å; E88-K91 WeakPolarHBondContact O-CB 3.23Å; E88-K91 PolarHBondContact O-N 3.22Å; E88-L92 WeakPolarHBondContact O-CG 3.31Å; E88-L92 PolarHBondContact O-N 2.94Å
89	V	89.4	Confident	88	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-56.9	-46.8	174.5	179.7	0	0	0	0	109.3	K54 L55 M58 C84 N86 K91 L92 V93	K54-V89 HydrophobicContact CB-CG1 4.18Å; K54-V89 HydrophobicContact CB-CG2 4.31Å; L55-V89 HydrophobicContact CB-CG2 3.98Å; L55-V89 HydrophobicContact CD1-CG2 3.99Å; M58-V89 HydrophobicContact CG-CG1 4.42Å; C84-V89 HydrophobicContact CB-CG1 4.2Å; N86-V89 HydrophobicContact CB-CB 4.24Å; N86-V89 HydrophobicContact CB-CG2 3.98Å; N86-V89 PolarHBondContact O-N 3.47Å; V89-K91 PolarHBondContact O-N 3.43Å; V89-L92 PolarHBondContact O-N 3.36Å; V89-V93 HydrophobicContact CG1-CG2 4.24Å; V89-V93 WeakPolarHBondContact O-CB 3.5Å; V89-V93 VanDerWaalsContact O-CG2 3.24Å; V89-V93 WeakPolarHBondContact O-CG2 3.41Å; V89-V93 PolarHBondContact O-N 2.97Å
90	K	87.7	Confident	88.1	Confident	26 Å²	26	55.3 Å²	55.3	11%	0.113	27%	0.269	C	S	.	.	H	α-helix	trans	-58.8	-43.4	176.8	-169.1	172.1	-179.3	177.3	0	112.5	N86 E88 V93 Y94	N86-K90 VanDerWaalsContact O-CB 3.3Å; N86-K90 WeakPolarHBondContact O-CB 3.43Å; N86-K90 PolarHBondContact O-N 3.3Å; E88-K90 VanDerWaalsContact C-N 3.27Å; E88-K90 PolarHBondContact O-N 3.06Å; K90-V93 PolarHBondContact O-N 2.87Å; K90-Y94 WeakPolarHBondContact CE-OH 3.45Å; K90-Y94 HydrophobicContact CG-CD1 4.27Å; K90-Y94 HydrophobicContact CG-CE1 3.79Å; K90-Y94 HydrophobicContact CG-CE2 4.15Å; K90-Y94 VanDerWaalsContact O-CB 3.26Å; K90-Y94 WeakPolarHBondContact O-CB 3.07Å; K90-Y94 WeakPolarHBondContact O-CD1 3.02Å; K90-Y94 PolarHBondContact O-N 3.08Å
91	K	89	Confident	88.1	Confident	134 Å²	134	48.9 Å²	48.9	58%	0.583	24%	0.241	S	C	*	.	H	α-helix	trans	-60.3	-43.6	173.6	-79.7	171.6	177.4	-180	0	112.5	I87 E88 V89 Y94 V95	I87-K91 HydrophobicContact CG2-CD 4.39Å; I87-K91 WeakPolarHBondContact O-CB 3.47Å; I87-K91 VanDerWaalsContact O-CG 3.27Å; I87-K91 WeakPolarHBondContact O-CG 3.31Å; I87-K91 PolarHBondContact O-N 2.91Å; E88-K91 WeakPolarHBondContact O-CB 3.23Å; E88-K91 PolarHBondContact O-N 3.22Å; V89-K91 PolarHBondContact O-N 3.43Å; K91-Y94 WeakPolarHBondContact O-CB 3.4Å; K91-Y94 PolarHBondContact O-N 2.86Å; K91-V95 WeakPolarHBondContact O-CG2 3.44Å; K91-V95 PolarHBondContact O-N 3.38Å; K91-V95 VanDerWaalsContact O-N 3.07Å
92	L	90.6	Very high	88	Confident	35 Å²	35	52 Å²	52	18%	0.183	26%	0.256	C	S	.	.	H	α-helix	trans	-69.3	-41.9	179.6	-64.7	170	0	0	0	111.7	L55 M58 K59 V62 E88 V89 Y94 V95 Y96	L55-L92 HydrophobicContact CD1-CD1 4.07Å; M58-L92 HydrophobicContact CB-CB 3.83Å; M58-L92 HydrophobicContact CB-CD1 3.72Å; M58-L92 HydrophobicContact CB-CG 4.43Å; M58-L92 HydrophobicContact CE-CB 4.09Å; M58-L92 HydrophobicContact CG-CB 4.42Å; K59-L92 HydrophobicContact CG-CD1 3.88Å; V62-L92 HydrophobicContact CG2-CD2 4.16Å; E88-L92 WeakPolarHBondContact O-CG 3.31Å; E88-L92 PolarHBondContact O-N 2.94Å; V89-L92 PolarHBondContact O-N 3.36Å; L92-Y94 VanDerWaalsContact C-N 3.28Å; L92-Y94 PolarHBondContact O-N 2.97Å; L92-V95 PolarHBondContact O-N 2.68Å; L92-Y96 PolarHBondContact O-N 3.22Å
93	V	91	Very high	88	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-40.8	173	171.5	0	0	0	0	110.5	M58 V78 N81 V82 V89 K90 Y96 L97	M58-V93 HydrophobicContact CE-CG2 4.1Å; M58-V93 HydrophobicContact CG-CG2 4.26Å; M58-V93 HydrophobicContact SD-CG2 3.99Å; V78-V93 HydrophobicContact CG1-CB 4.32Å; V78-V93 HydrophobicContact CG1-CG1 3.98Å; V78-V93 HydrophobicContact CG1-CG2 4.09Å; N81-V93 HydrophobicContact CB-CG2 4.25Å; V82-V93 HydrophobicContact CB-CG1 4.32Å; V82-V93 HydrophobicContact CG2-CG1 3.52Å; V89-V93 HydrophobicContact CG1-CG2 4.24Å; V89-V93 WeakPolarHBondContact O-CB 3.5Å; V89-V93 VanDerWaalsContact O-CG2 3.24Å; V89-V93 WeakPolarHBondContact O-CG2 3.41Å; V89-V93 PolarHBondContact O-N 2.97Å; K90-V93 PolarHBondContact O-N 2.87Å; V93-Y96 PolarHBondContact O-N 2.69Å; V93-L97 HydrophobicContact CG1-CD1 4.14Å; V93-L97 HydrophobicContact CG1-CG 4.47Å; V93-L97 WeakPolarHBondContact O-CG 3.34Å; V93-L97 PolarHBondContact O-N 3.31Å
94	Y	90.5	Very high	88.1	Confident	10 Å²	10	58.1 Å²	58.1	4%	0.039	27%	0.274	C	S	.	.	H	α-helix	trans	-63	-41.1	176.6	-78.8	10.9	0	0	0	112.7	V82 K90 K91 L92 V98 F115 V133	V82-Y94 HydrophobicContact CG1-CE1 4.23Å; K90-Y94 WeakPolarHBondContact CE-OH 3.45Å; K90-Y94 HydrophobicContact CG-CD1 4.27Å; K90-Y94 HydrophobicContact CG-CE1 3.79Å; K90-Y94 HydrophobicContact CG-CE2 4.15Å; K90-Y94 VanDerWaalsContact O-CB 3.26Å; K90-Y94 WeakPolarHBondContact O-CB 3.07Å; K90-Y94 WeakPolarHBondContact O-CD1 3.02Å; K90-Y94 PolarHBondContact O-N 3.08Å; K91-Y94 WeakPolarHBondContact O-CB 3.4Å; K91-Y94 PolarHBondContact O-N 2.86Å; L92-Y94 VanDerWaalsContact C-N 3.28Å; L92-Y94 PolarHBondContact O-N 2.97Å; Y94-V98 WeakPolarHBondContact O-CG2 3.2Å; Y94-V98 PolarHBondContact O-N 3.47Å; Y94-F115 AromaticContact CD1-CE1 3.84Å; Y94-F115 HydrophobicContact CD1-CE1 3.84Å; Y94-F115 HydrophobicContact CD1-CZ 4.22Å; Y94-F115 HydrophobicContact CE1-CD1 4.18Å; Y94-F115 AromaticContact CE1-CE1 3.33Å; Y94-F115 HydrophobicContact CE1-CE1 3.33Å; Y94-F115 AromaticContact CE1-CZ 3.99Å; Y94-F115 HydrophobicContact CE1-CZ 3.99Å; Y94-F115 HydrophobicContact CE2-CE1 4.22Å; Y94-F115 HydrophobicContact CG-CE1 4.45Å; Y94-F115 AromaticContact CZ-CE1 3.52Å; Y94-V133 HydrophobicContact CD2-CG2 3.65Å; Y94-V133 HydrophobicContact CE2-CG2 4.38Å; Y94-V133 HydrophobicContact CG-CG2 3.75Å
95	V	88.6	Confident	88.2	Confident	85 Å²	85	61.5 Å²	61.5	52%	0.515	29%	0.289	S	S	.	.	H	α-helix	trans	-65.4	-43.5	174.2	171.2	0	0	0	0	111.4	K91 L92 L97 V98 R99	K91-V95 WeakPolarHBondContact O-CG2 3.44Å; K91-V95 PolarHBondContact O-N 3.38Å; K91-V95 VanDerWaalsContact O-N 3.07Å; L92-V95 PolarHBondContact O-N 2.68Å; V95-L97 PolarHBondContact O-N 3.28Å; V95-V98 PolarHBondContact O-N 3.26Å; V95-R99 PolarHBondContact O-N 3.44Å
96	Y	91.5	Very high	88.2	Confident	1 Å²	1	58.4 Å²	58.4	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-59.8	-44.5	177.4	178	-84.2	0	0	0	112.3	I61 I65 A71 F75 V78 L92 V93 R99 Y100	I61-Y96 HydrophobicContact CG2-CD2 3.65Å; I61-Y96 HydrophobicContact CG2-CE2 3.76Å; I65-Y96 HydrophobicContact CD1-CD2 3.6Å; I65-Y96 HydrophobicContact CD1-CE2 4.06Å; A71-Y96 HydrophobicContact CB-CE2 4.28Å; A71-Y96 PolarHBondContact O-OH 2.91Å; F75-Y96 VanDerWaalsContact CA-OH 3.26Å; F75-Y96 WeakPolarHBondContact CA-OH 3.44Å; F75-Y96 HydrophobicContact CB-CE1 4.31Å; F75-Y96 HydrophobicContact CD2-CD1 4.4Å; F75-Y96 AromaticContact CD2-CE1 3.49Å; F75-Y96 HydrophobicContact CD2-CE1 3.49Å; F75-Y96 VanDerWaalsContact CD2-CE1 3.49Å; F75-Y96 HydrophobicContact CE2-CE1 4.15Å; F75-Y96 HydrophobicContact CG-CE1 4.2Å; F75-Y96 PolarHBondContact N-OH 3.4Å; V78-Y96 HydrophobicContact CB-CD1 3.87Å; V78-Y96 HydrophobicContact CB-CE1 3.75Å; V78-Y96 HydrophobicContact CB-CG 4.47Å; V78-Y96 HydrophobicContact CG1-CD1 3.37Å; V78-Y96 HydrophobicContact CG1-CE1 3.81Å; V78-Y96 HydrophobicContact CG1-CG 3.78Å; V78-Y96 HydrophobicContact CG2-CD1 4.27Å; V78-Y96 HydrophobicContact CG2-CD2 4.47Å; V78-Y96 HydrophobicContact CG2-CE1 4.02Å; V78-Y96 HydrophobicContact CG2-CE2 4.28Å; V78-Y96 HydrophobicContact CG2-CG 4.49Å; L92-Y96 PolarHBondContact O-N 3.22Å; V93-Y96 PolarHBondContact O-N 2.69Å; Y96-R99 PolarHBondContact O-N 3.23Å; Y96-Y100 HydrophobicContact CD1-CD2 4.37Å; Y96-Y100 AromaticContact CD2-CD2 3.95Å; Y96-Y100 HydrophobicContact CD2-CD2 3.95Å; Y96-Y100 HydrophobicContact CD2-CE2 4.2Å; Y96-Y100 HydrophobicContact CE1-CD2 4.07Å; Y96-Y100 AromaticContact CE2-CD2 3.58Å; Y96-Y100 HydrophobicContact CE2-CD2 3.58Å; Y96-Y100 AromaticContact CE2-CE2 3.75Å; Y96-Y100 HydrophobicContact CE2-CE2 3.75Å; Y96-Y100 HydrophobicContact CG-CD2 4.32Å; Y96-Y100 AromaticContact CZ-CD2 3.64Å; Y96-Y100 PolarHBondContact O-N 3.19Å; Y96-Y100 VanDerWaalsContact O-N 3.12Å
97	L	89.7	Confident	88.1	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-64.6	-40.4	179.5	-74.1	174.5	0	0	0	113	F75 V79 V82 V93 V95 R99 Y100 A101 F115	F75-L97 HydrophobicContact CE1-CD2 4.47Å; F75-L97 HydrophobicContact CE2-CD2 3.79Å; F75-L97 HydrophobicContact CZ-CD2 3.66Å; V79-L97 HydrophobicContact CG2-CD2 3.86Å; V82-L97 HydrophobicContact CG2-CD1 3.59Å; V93-L97 HydrophobicContact CG1-CD1 4.14Å; V93-L97 HydrophobicContact CG1-CG 4.47Å; V93-L97 WeakPolarHBondContact O-CG 3.34Å; V93-L97 PolarHBondContact O-N 3.31Å; V95-L97 PolarHBondContact O-N 3.28Å; L97-R99 PolarHBondContact O-N 2.71Å; L97-Y100 PolarHBondContact O-N 3.04Å; L97-A101 WeakPolarHBondContact O-CB 3.32Å; L97-A101 PolarHBondContact O-N 3.25Å; L97-F115 HydrophobicContact CD1-CE2 4.31Å; L97-F115 HydrophobicContact CD1-CZ 3.89Å
98	V	88.1	Confident	88.1	Confident	58 Å²	58	55 Å²	55	35%	0.352	27%	0.265	S	S	.	.	H	α-helix	trans	-63	-23	176.9	174.3	0	0	0	0	112	Y94 V95 V133	Y94-V98 WeakPolarHBondContact O-CG2 3.2Å; Y94-V98 PolarHBondContact O-N 3.47Å; V95-V98 PolarHBondContact O-N 3.26Å; V98-V133 HydrophobicContact CG2-CB 4.49Å; V98-V133 HydrophobicContact CG2-CG1 3.96Å; V98-V133 HydrophobicContact CG2-CG2 4.34Å
99	R	88.6	Confident	88	Confident	154 Å²	154	53 Å²	53	58%	0.581	26%	0.256	S	S	*	.	H	α-helix	trans	-83	-44.3	172.8	179.2	58	-171.3	-166.9	2.6	113.6	V95 Y96 L97	V95-R99 PolarHBondContact O-N 3.44Å; Y96-R99 PolarHBondContact O-N 3.23Å; L97-R99 PolarHBondContact O-N 2.71Å
100	Y	89.4	Confident	87.7	Confident	9 Å²	9	58.2 Å²	58.2	4%	0.035	28%	0.284	C	S	.	.	H	α-helix	trans	-106.4	-8.1	-166.8	-73.8	-68.3	0	0	0	115.7	I65 A71 Y96 L97 E102 E103 Q104	I65-Y100 HydrophobicContact CD1-CE2 3.74Å; I65-Y100 HydrophobicContact CG1-CE2 4.02Å; A71-Y100 HydrophobicContact CB-CE2 4.31Å; A71-Y100 PolarHBondContact N-OH 3.43Å; Y96-Y100 HydrophobicContact CD1-CD2 4.37Å; Y96-Y100 AromaticContact CD2-CD2 3.95Å; Y96-Y100 HydrophobicContact CD2-CD2 3.95Å; Y96-Y100 HydrophobicContact CD2-CE2 4.2Å; Y96-Y100 HydrophobicContact CE1-CD2 4.07Å; Y96-Y100 AromaticContact CE2-CD2 3.58Å; Y96-Y100 HydrophobicContact CE2-CD2 3.58Å; Y96-Y100 AromaticContact CE2-CE2 3.75Å; Y96-Y100 HydrophobicContact CE2-CE2 3.75Å; Y96-Y100 HydrophobicContact CG-CD2 4.32Å; Y96-Y100 AromaticContact CZ-CD2 3.64Å; Y96-Y100 PolarHBondContact O-N 3.19Å; Y96-Y100 VanDerWaalsContact O-N 3.12Å; L97-Y100 PolarHBondContact O-N 3.04Å; Y100-E102 PolarHBondContact O-N 2.88Å; Y100-E103 VanDerWaalsContact CD1-OE2 3.31Å; Y100-E103 WeakPolarHBondContact CD1-OE2 3.34Å; Y100-E103 PolarHBondContact O-N 2.76Å; Y100-E103 VanDerWaalsContact O-N 3.16Å; Y100-Q104 PolarHBondContact O-N 3.3Å
101	A	86.8	Confident	87.7	Confident	2 Å²	2	57.1 Å²	57.1	2%	0.017	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.6	-178.9	0	0	0	0	0	114	L97 A108 I137	L97-A101 WeakPolarHBondContact O-CB 3.32Å; L97-A101 PolarHBondContact O-N 3.25Å; A101-A108 HydrophobicContact CB-CB 3.78Å; A101-I137 HydrophobicContact CB-CG1 4.13Å; A101-I137 HydrophobicContact CB-CG2 4.15Å
102	E	86.4	Confident	87.7	Confident	72 Å²	72	51.5 Å²	51.5	34%	0.336	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-35.6	174.4	-56.2	-172.7	159.1	0	0	111.7	Y100 Q105 R138	Y100-E102 PolarHBondContact O-N 2.88Å; E102-Q105 WeakPolarHBondContact O-CG 3.45Å; E102-Q105 PolarHBondContact O-NE2 3.09Å; E102-Q105 VanDerWaalsContact O-NE2 3.12Å; E102-R138 HydrophobicContact CG-CB 4.24Å; E102-R138 WeakPolarHBondContact OE1-CB 3.36Å; E102-R138 WeakPolarHBondContact OE1-CD 3.49Å; E102-R138 WeakPolarHBondContact OE1-CG 3.11Å; E102-R138 IonicContact OE1-CZ 2.79Å; E102-R138 IonicContact OE1-NE 3.71Å; E102-R138 IonicContact OE1-NH1 2.68Å; E102-R138 PolarHBondContact OE1-NH1 3Å; E102-R138 IonicContact OE2-NH1 2.71Å; E102-R138 PolarHBondContact OE2-NH1 2.66Å
103	E	87.3	Confident	87.6	Confident	103 Å²	103	53.2 Å²	53.2	48%	0.481	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-27.5	178.7	-62.9	176.7	-157.3	0	0	112.8	Y100	Y100-E103 VanDerWaalsContact CD1-OE2 3.31Å; Y100-E103 WeakPolarHBondContact CD1-OE2 3.34Å; Y100-E103 PolarHBondContact O-N 2.76Å; Y100-E103 VanDerWaalsContact O-N 3.16Å
104	Q	85.7	Confident	87.5	Confident	86 Å²	86	54 Å²	54	40%	0.402	28%	0.275	S	S	.	.	S	Bend	trans	-131.9	57.9	-171.9	-68.5	-65.3	-76.1	0	0	112.2	F75 Y100 D106 L107 A108	F75-Q104 HydrophobicContact CD1-CB 3.78Å; F75-Q104 HydrophobicContact CD1-CG 4.39Å; F75-Q104 HydrophobicContact CD2-CB 4.25Å; F75-Q104 HydrophobicContact CE1-CB 3.76Å; F75-Q104 HydrophobicContact CE2-CB 4.26Å; F75-Q104 HydrophobicContact CG-CB 4.04Å; F75-Q104 HydrophobicContact CG-CG 4.28Å; F75-Q104 HydrophobicContact CZ-CB 4.02Å; Y100-Q104 PolarHBondContact O-N 3.3Å; Q104-D106 PolarHBondContact O-N 3.45Å; Q104-L107 PolarHBondContact O-N 3.01Å; Q104-A108 PolarHBondContact O-N 3.18Å
105	Q	86.8	Confident	87.5	Confident	86 Å²	86	53.5 Å²	53.5	40%	0.402	27%	0.273	S	S	.	.	H	α-helix	trans	-58.9	-47.6	-168.3	-54.4	-171.6	11.2	0	0	113.5	E102 L107 A108 L109 V139	E102-Q105 WeakPolarHBondContact O-CG 3.45Å; E102-Q105 PolarHBondContact O-NE2 3.09Å; E102-Q105 VanDerWaalsContact O-NE2 3.12Å; Q105-L107 VanDerWaalsContact C-N 3.34Å; Q105-L107 PolarHBondContact O-N 3.28Å; Q105-A108 WeakPolarHBondContact O-CA 3.42Å; Q105-A108 VanDerWaalsContact O-CB 3.31Å; Q105-A108 WeakPolarHBondContact O-CB 3.37Å; Q105-A108 PolarHBondContact O-N 3.36Å; Q105-L109 WeakPolarHBondContact O-CG 3.49Å; Q105-L109 PolarHBondContact O-N 3.44Å; Q105-L109 VanDerWaalsContact O-N 3.11Å; Q105-V139 HydrophobicContact CB-CG1 4.49Å; Q105-V139 HydrophobicContact CB-CG2 4.06Å; Q105-V139 HydrophobicContact CG-CG2 3.94Å
106	D	85.6	Confident	87.6	Confident	133 Å²	133	53.4 Å²	53.4	71%	0.711	27%	0.267	S	S	*	.	H	α-helix	trans	-59.2	-42.5	-178.3	-63.6	-45.1	0	0	0	112.8	Q104 A108 L109	Q104-D106 PolarHBondContact O-N 3.45Å; D106-A108 VanDerWaalsContact C-N 3.34Å; D106-L109 WeakPolarHBondContact O-CB 3.32Å; D106-L109 PolarHBondContact O-N 3.24Å
107	L	84.1	Confident	87.5	Confident	57 Å²	57	61 Å²	61	30%	0.298	30%	0.296	S	S	.	.	H	α-helix	trans	-72.7	-28.9	177.1	-67.3	176.5	0	0	0	111.7	F75 P76 Q104 Q105 L109 L110	F75-L107 HydrophobicContact CD1-CB 3.72Å; F75-L107 HydrophobicContact CD1-CD1 4.06Å; F75-L107 HydrophobicContact CE1-CB 3.56Å; P76-L107 HydrophobicContact CG-CD1 4.07Å; Q104-L107 PolarHBondContact O-N 3.01Å; Q105-L107 VanDerWaalsContact C-N 3.34Å; Q105-L107 PolarHBondContact O-N 3.28Å; L107-L109 VanDerWaalsContact C-N 3.3Å; L107-L109 PolarHBondContact O-N 3.37Å; L107-L110 HydrophobicContact CD2-CD1 4.24Å; L107-L110 PolarHBondContact O-N 3.16Å
108	A	84.8	Confident	87.5	Confident	3 Å²	3	61.1 Å²	61.1	3%	0.025	30%	0.298	C	S	.	.	H	α-helix	trans	-65.8	-32.9	173.3	0	0	0	0	0	111.9	F75 A101 Q104 Q105 D106 L110 S111	F75-A108 HydrophobicContact CE1-CB 4.49Å; F75-A108 HydrophobicContact CZ-CB 4.12Å; A101-A108 HydrophobicContact CB-CB 3.78Å; Q104-A108 PolarHBondContact O-N 3.18Å; Q105-A108 WeakPolarHBondContact O-CA 3.42Å; Q105-A108 VanDerWaalsContact O-CB 3.31Å; Q105-A108 WeakPolarHBondContact O-CB 3.37Å; Q105-A108 PolarHBondContact O-N 3.36Å; D106-A108 VanDerWaalsContact C-N 3.34Å; A108-L110 PolarHBondContact O-N 2.99Å; A108-S111 VanDerWaalsContact O-CB 3.26Å; A108-S111 WeakPolarHBondContact O-CB 3.45Å; A108-S111 PolarHBondContact O-N 3.49Å
109	L	85.6	Confident	87.6	Confident	57 Å²	57	59.5 Å²	59.5	30%	0.298	29%	0.287	S	S	.	.	H	α-helix	trans	-55.9	-36.3	178.8	-59.1	-176.4	0	0	0	112.8	Q105 D106 L107 S111 I112 V139 I142	Q105-L109 WeakPolarHBondContact O-CG 3.49Å; Q105-L109 PolarHBondContact O-N 3.44Å; Q105-L109 VanDerWaalsContact O-N 3.11Å; D106-L109 WeakPolarHBondContact O-CB 3.32Å; D106-L109 PolarHBondContact O-N 3.24Å; L107-L109 VanDerWaalsContact C-N 3.3Å; L107-L109 PolarHBondContact O-N 3.37Å; L109-S111 PolarHBondContact O-N 3.03Å; L109-S111 VanDerWaalsContact O-N 3.16Å; L109-I112 HydrophobicContact CB-CD1 4.2Å; L109-I112 HydrophobicContact CD2-CD1 3.66Å; L109-I112 WeakPolarHBondContact O-CB 3.33Å; L109-I112 WeakPolarHBondContact O-CG1 3.31Å; L109-I112 PolarHBondContact O-N 2.96Å; L109-I112 VanDerWaalsContact O-N 3.08Å; L109-V139 HydrophobicContact CD2-CG1 4.13Å; L109-I142 HydrophobicContact CD2-CG2 4.32Å
110	L	84.9	Confident	87.7	Confident	111 Å²	111	58.8 Å²	58.8	58%	0.581	29%	0.288	S	S	*	.	H	α-helix	trans	-56.3	-33.1	176.9	-59	175.2	0	0	0	112.3	V79 L107 A108 S113	V79-L110 HydrophobicContact CG1-CB 4.25Å; L107-L110 HydrophobicContact CD2-CD1 4.24Å; L107-L110 PolarHBondContact O-N 3.16Å; A108-L110 PolarHBondContact O-N 2.99Å; L110-S113 PolarHBondContact O-OG 2.93Å
111	S	87.7	Confident	87.8	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.021	30%	0.297	C	S	.	.	H	α-helix	trans	-73.1	-25.7	-178.8	-55.4	0	0	0	0	113.2	A108 L109 S113 T114 F115	A108-S111 VanDerWaalsContact O-CB 3.26Å; A108-S111 WeakPolarHBondContact O-CB 3.45Å; A108-S111 PolarHBondContact O-N 3.49Å; L109-S111 PolarHBondContact O-N 3.03Å; L109-S111 VanDerWaalsContact O-N 3.16Å; S111-S113 VanDerWaalsContact C-N 3.29Å; S111-S113 PolarHBondContact O-N 3.15Å; S111-T114 PolarHBondContact O-N 2.88Å; S111-F115 WeakPolarHBondContact O-CD2 3.46Å; S111-F115 PolarHBondContact O-N 3.05Å
112	I	88	Confident	87.9	Confident	16 Å²	16	66.3 Å²	66.3	8%	0.082	34%	0.335	C	S	.	.	H	α-helix	trans	-56.4	-43.8	-176.4	-58.8	168.3	0	0	0	111.1	L109 T114 F115 Q116 L134 I142 I145	L109-I112 HydrophobicContact CB-CD1 4.2Å; L109-I112 HydrophobicContact CD2-CD1 3.66Å; L109-I112 WeakPolarHBondContact O-CB 3.33Å; L109-I112 WeakPolarHBondContact O-CG1 3.31Å; L109-I112 PolarHBondContact O-N 2.96Å; L109-I112 VanDerWaalsContact O-N 3.08Å; I112-T114 PolarHBondContact O-N 2.91Å; I112-T114 VanDerWaalsContact O-N 3.17Å; I112-F115 PolarHBondContact O-N 2.94Å; I112-Q116 HydrophobicContact CG2-CG 4.27Å; I112-Q116 WeakPolarHBondContact O-CG 3.3Å; I112-Q116 PolarHBondContact O-N 2.72Å; I112-L134 HydrophobicContact CG2-CD1 4.37Å; I112-I142 HydrophobicContact CD1-CB 4.34Å; I112-I142 HydrophobicContact CD1-CG2 3.38Å; I112-I142 HydrophobicContact CG1-CG2 4.27Å; I112-I145 HydrophobicContact CG2-CD1 4.09Å; I112-I145 HydrophobicContact CG2-CG2 4.14Å
113	S	87.6	Confident	88.1	Confident	70 Å²	70	65.7 Å²	65.7	49%	0.49	33%	0.334	S	S	.	.	H	α-helix	trans	-53.9	-35.4	176.3	67.1	0	0	0	0	113.1	L110 S111 R117	L110-S113 PolarHBondContact O-OG 2.93Å; S111-S113 VanDerWaalsContact C-N 3.29Å; S111-S113 PolarHBondContact O-N 3.15Å; S113-R117 PolarHBondContact O-N 2.96Å
114	T	89.4	Confident	88.4	Confident	17 Å²	17	65 Å²	65	10%	0.104	33%	0.331	C	S	.	.	H	α-helix	trans	-85.7	-29	179.3	-66.6	0	0	0	0	112.2	V82 A83 S111 I112 R117 G118	V82-T114 HydrophobicContact CG1-CG2 3.77Å; A83-T114 HydrophobicContact CB-CG2 4.1Å; S111-T114 PolarHBondContact O-N 2.88Å; I112-T114 PolarHBondContact O-N 2.91Å; I112-T114 VanDerWaalsContact O-N 3.17Å; T114-R117 PolarHBondContact OG1-NH2 2.96Å; T114-G118 PolarHBondContact O-N 3.37Å
115	F	90.4	Very high	88.6	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-65.6	-46	167.6	-66.7	-62.5	0	0	0	111.7	V82 Y94 L97 S111 I112 R117 G118 L119 A130 V133 L134 I137	V82-F115 HydrophobicContact CG1-CZ 4.46Å; Y94-F115 AromaticContact CD1-CE1 3.84Å; Y94-F115 HydrophobicContact CD1-CE1 3.84Å; Y94-F115 HydrophobicContact CD1-CZ 4.22Å; Y94-F115 HydrophobicContact CE1-CD1 4.18Å; Y94-F115 AromaticContact CE1-CE1 3.33Å; Y94-F115 HydrophobicContact CE1-CE1 3.33Å; Y94-F115 AromaticContact CE1-CZ 3.99Å; Y94-F115 HydrophobicContact CE1-CZ 3.99Å; Y94-F115 HydrophobicContact CE2-CE1 4.22Å; Y94-F115 HydrophobicContact CG-CE1 4.45Å; Y94-F115 AromaticContact CZ-CE1 3.52Å; L97-F115 HydrophobicContact CD1-CE2 4.31Å; L97-F115 HydrophobicContact CD1-CZ 3.89Å; S111-F115 WeakPolarHBondContact O-CD2 3.46Å; S111-F115 PolarHBondContact O-N 3.05Å; I112-F115 PolarHBondContact O-N 2.94Å; F115-R117 VanDerWaalsContact C-N 3.3Å; F115-R117 PolarHBondContact O-N 3.49Å; F115-G118 CarbonylContact O-C 3.59Å; F115-G118 WeakPolarHBondContact O-CA 3.44Å; F115-G118 PolarHBondContact O-N 3.43Å; F115-L119 WeakPolarHBondContact O-CG 3.44Å; F115-L119 PolarHBondContact O-N 3.47Å; F115-A130 HydrophobicContact CD1-CB 4.3Å; F115-V133 HydrophobicContact CD1-CB 4.39Å; F115-V133 HydrophobicContact CD1-CG1 4.42Å; F115-V133 HydrophobicContact CE1-CB 3.7Å; F115-V133 HydrophobicContact CE1-CG1 3.44Å; F115-V133 VanDerWaalsContact CE1-CG1 3.44Å; F115-V133 HydrophobicContact CE1-CG2 4.5Å; F115-V133 HydrophobicContact CE2-CG1 4.17Å; F115-V133 HydrophobicContact CZ-CB 4.1Å; F115-V133 HydrophobicContact CZ-CG1 3.3Å; F115-L134 HydrophobicContact CB-CB 4.46Å; F115-L134 HydrophobicContact CB-CD1 4.29Å; F115-I137 HydrophobicContact CD2-CD1 4.44Å; F115-I137 HydrophobicContact CE2-CD1 3.84Å; F115-I137 HydrophobicContact CZ-CD1 4.43Å
116	Q	90.6	Very high	88.8	Confident	83 Å²	83	62.1 Å²	62.1	39%	0.388	32%	0.32	S	S	.	.	H	α-helix	trans	-55.3	-43.1	174.4	-74.4	175.8	-27.2	0	0	112.3	I112 L119 I145	I112-Q116 HydrophobicContact CG2-CG 4.27Å; I112-Q116 WeakPolarHBondContact O-CG 3.3Å; I112-Q116 PolarHBondContact O-N 2.72Å; Q116-L119 PolarHBondContact O-N 2.69Å; Q116-I145 HydrophobicContact CG-CG2 4.1Å; Q116-I145 VanDerWaalsContact NE2-CG2 3.3Å
117	R	90.1	Very high	89.1	Confident	160 Å²	160	57.6 Å²	57.6	60%	0.604	29%	0.293	S	S	*	.	H	α-helix	trans	-66.4	-37.7	172.4	-180	171.2	54.2	-175.3	-7.4	112.4	S113 T114 F115 L119 K120	S113-R117 PolarHBondContact O-N 2.96Å; T114-R117 PolarHBondContact OG1-NH2 2.96Å; F115-R117 VanDerWaalsContact C-N 3.3Å; F115-R117 PolarHBondContact O-N 3.49Å; R117-L119 VanDerWaalsContact C-N 3.31Å; R117-L119 PolarHBondContact O-N 2.83Å; R117-K120 PolarHBondContact O-N 3.41Å; R117-K120 VanDerWaalsContact O-N 3.1Å
118	G	89.1	Confident	89.5	Confident	4 Å²	4	55 Å²	55	4%	0.041	28%	0.28	C	S	.	.	H	α-helix	trans	-64.2	-30.6	176.1	0	0	0	0	0	114.1	T114 F115 K120 D121 R127	T114-G118 PolarHBondContact O-N 3.37Å; F115-G118 CarbonylContact O-C 3.59Å; F115-G118 WeakPolarHBondContact O-CA 3.44Å; F115-G118 PolarHBondContact O-N 3.43Å; G118-K120 PolarHBondContact O-N 3.31Å; G118-D121 VanDerWaalsContact O-CB 3.3Å; G118-D121 WeakPolarHBondContact O-CB 3.31Å; G118-D121 PolarHBondContact O-N 3.19Å; G118-R127 WeakPolarHBondContact O-CA 3.45Å
119	L	90.2	Very high	89.7	Confident	23 Å²	23	56.5 Å²	56.5	12%	0.12	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-15.8	171.9	-65.9	172.3	0	0	0	113.3	F115 Q116 R117 R127 A130 L131 L134 A149	F115-L119 WeakPolarHBondContact O-CG 3.44Å; F115-L119 PolarHBondContact O-N 3.47Å; Q116-L119 PolarHBondContact O-N 2.69Å; R117-L119 VanDerWaalsContact C-N 3.31Å; R117-L119 PolarHBondContact O-N 2.83Å; L119-R127 WeakPolarHBondContact O-CD 3.2Å; L119-R127 WeakPolarHBondContact O-CG 3.35Å; L119-A130 HydrophobicContact CD2-CB 4.34Å; L119-L131 HydrophobicContact CD2-CB 3.66Å; L119-L131 HydrophobicContact CD2-CD1 4.06Å; L119-L131 HydrophobicContact CD2-CG 4.41Å; L119-L134 HydrophobicContact CD1-CD2 4.13Å; L119-A149 HydrophobicContact CD1-CB 3.45Å; L119-A149 VanDerWaalsContact CD1-CB 3.45Å
120	K	91.8	Very high	90	Very high	140 Å²	140	53.8 Å²	53.8	61%	0.609	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	17	-178.5	-53.3	-166.4	179.3	-163.6	0	112.3	R117 G118 E152	R117-K120 PolarHBondContact O-N 3.41Å; R117-K120 VanDerWaalsContact O-N 3.1Å; G118-K120 PolarHBondContact O-N 3.31Å; K120-E152 WeakPolarHBondContact CE-OE2 3.26Å; K120-E152 VanDerWaalsContact NZ-CD 3.25Å; K120-E152 IonicContact NZ-OE1 2.69Å; K120-E152 PolarHBondContact NZ-OE1 2.85Å; K120-E152 IonicContact NZ-OE2 3.82Å; K120-E152 PolarHBondContact NZ-OE2 3.43Å
121	D	90.8	Very high	90.4	Very high	44 Å²	44	48.5 Å²	48.5	24%	0.235	25%	0.249	C	C	.	.			trans	-73.4	140.8	174	-167.7	-68.8	0	0	0	111.1	G118 N123 I126 R127	G118-D121 VanDerWaalsContact O-CB 3.3Å; G118-D121 WeakPolarHBondContact O-CB 3.31Å; G118-D121 PolarHBondContact O-N 3.19Å; D121-N123 PolarHBondContact O-N 3.02Å; D121-N123 WeakPolarHBondContact OD1-CB 3.36Å; D121-N123 PolarHBondContact OD1-N 2.91Å; D121-I126 HydrophobicContact CB-CB 4.04Å; D121-I126 HydrophobicContact CB-CG2 3.73Å; D121-R127 HydrophobicContact CB-CG 4.38Å; D121-R127 WeakPolarHBondContact O-CD 3.49Å; D121-R127 WeakPolarHBondContact O-CG 3.21Å; D121-R127 PolarHBondContact O-NH1 3.17Å
122	P	90.1	Very high	90.6	Very high	124 Å²	124	55.6 Å²	55.6	81%	0.805	28%	0.275	S	S	*	.	S	Bend	trans	-60.5	-27.3	177.3	24.4	-35.2	0	0	0	113.6	Q124 R127	P122-Q124 PolarHBondContact O-N 3.36Å; P122-R127 VanDerWaalsContact C-NH1 3.25Å; P122-R127 PolarHBondContact O-NH1 2.96Å
123	N	90.8	Very high	90.8	Very high	60 Å²	60	55 Å²	55	32%	0.321	27%	0.272	S	S	.	.			trans	-82.5	116.5	-179.4	-173.6	-18.8	0	0	0	111.9	D121 L125 I126 R127	D121-N123 PolarHBondContact O-N 3.02Å; D121-N123 WeakPolarHBondContact OD1-CB 3.36Å; D121-N123 PolarHBondContact OD1-N 2.91Å; N123-L125 PolarHBondContact O-N 2.95Å; N123-L125 VanDerWaalsContact O-N 3.12Å; N123-L125 WeakPolarHBondContact OD1-CB 3.38Å; N123-L125 PolarHBondContact OD1-N 3.28Å; N123-I126 HydrophobicContact CB-CB 4.26Å; N123-I126 HydrophobicContact CB-CD1 4.03Å; N123-I126 HydrophobicContact CB-CG1 4.01Å; N123-I126 PolarHBondContact O-N 3.03Å; N123-R127 PolarHBondContact O-N 3.1Å; N123-R127 VanDerWaalsContact O-N 3.07Å
124	Q	92.6	Very high	91	Very high	88 Å²	88	51.6 Å²	51.6	41%	0.411	25%	0.248	S	C	.	.	H	α-helix	trans	-53	-32.8	177.1	65.5	-177.5	1.6	0	0	114.1	P122 A128 S158 V161	P122-Q124 PolarHBondContact O-N 3.36Å; Q124-A128 VanDerWaalsContact O-CB 3.29Å; Q124-A128 WeakPolarHBondContact O-CB 3.46Å; Q124-A128 PolarHBondContact O-N 2.78Å; Q124-S158 VanDerWaalsContact OE1-CB 3.3Å; Q124-S158 PolarHBondContact OE1-OG 2.95Å; Q124-V161 HydrophobicContact CB-CG2 4.11Å; Q124-V161 WeakPolarHBondContact O-CG2 3.49Å
125	L	90.4	Very high	91.1	Very high	92 Å²	92	51 Å²	51	48%	0.482	25%	0.245	S	C	.	.	H	α-helix	trans	-72.6	-30.6	178.5	-57.4	179.2	0	0	0	111.7	N123 S129 Y160	N123-L125 PolarHBondContact O-N 2.95Å; N123-L125 VanDerWaalsContact O-N 3.12Å; N123-L125 WeakPolarHBondContact OD1-CB 3.38Å; N123-L125 PolarHBondContact OD1-N 3.28Å; L125-S129 VanDerWaalsContact O-CB 3.25Å; L125-S129 WeakPolarHBondContact O-CB 3.44Å; L125-S129 PolarHBondContact O-N 3.24Å; L125-S129 PolarHBondContact O-OG 3.32Å; L125-Y160 HydrophobicContact CD2-CD1 4.03Å; L125-Y160 HydrophobicContact CD2-CE1 3.74Å
126	I	89.4	Confident	91.1	Very high	20 Å²	20	52.3 Å²	52.3	10%	0.103	25%	0.254	C	S	.	.	H	α-helix	trans	-75.8	-42	175.5	-61.5	-178.8	0	0	0	109.9	D121 N123 S129 A130	D121-I126 HydrophobicContact CB-CB 4.04Å; D121-I126 HydrophobicContact CB-CG2 3.73Å; N123-I126 HydrophobicContact CB-CB 4.26Å; N123-I126 HydrophobicContact CB-CD1 4.03Å; N123-I126 HydrophobicContact CB-CG1 4.01Å; N123-I126 PolarHBondContact O-N 3.03Å; I126-S129 PolarHBondContact O-N 3.42Å; I126-S129 PolarHBondContact O-OG 2.93Å; I126-A130 VanDerWaalsContact O-CB 3.28Å; I126-A130 WeakPolarHBondContact O-CB 3.19Å; I126-A130 PolarHBondContact O-N 2.62Å
127	R	92.3	Very high	91	Very high	37 Å²	37	48.6 Å²	48.6	14%	0.14	24%	0.237	C	C	.	.	H	α-helix	trans	-59.2	-51.6	173	-60.6	-161.5	-63.1	-83.7	9.3	112.1	G118 L119 D121 P122 N123 A130 L131 D156 V161	G118-R127 WeakPolarHBondContact O-CA 3.45Å; L119-R127 WeakPolarHBondContact O-CD 3.2Å; L119-R127 WeakPolarHBondContact O-CG 3.35Å; D121-R127 HydrophobicContact CB-CG 4.38Å; D121-R127 WeakPolarHBondContact O-CD 3.49Å; D121-R127 WeakPolarHBondContact O-CG 3.21Å; D121-R127 PolarHBondContact O-NH1 3.17Å; P122-R127 VanDerWaalsContact C-NH1 3.25Å; P122-R127 PolarHBondContact O-NH1 2.96Å; N123-R127 PolarHBondContact O-N 3.1Å; N123-R127 VanDerWaalsContact O-N 3.07Å; R127-A130 PolarHBondContact O-N 2.76Å; R127-L131 PolarHBondContact O-N 3.41Å; R127-D156 IonicContact CZ-OD1 2.74Å; R127-D156 IonicContact CZ-OD2 3.29Å; R127-D156 IonicContact NE-OD1 3.83Å; R127-D156 IonicContact NE-OD2 3.03Å; R127-D156 PolarHBondContact NE-OD2 2.78Å; R127-D156 IonicContact NH2-OD1 2.71Å; R127-D156 PolarHBondContact NH2-OD1 2.93Å; R127-D156 IonicContact NH2-OD2 3.68Å; R127-D156 PolarHBondContact NH2-OD2 3.18Å; R127-D156 VanDerWaalsContact NH2-OD2 3.14Å; R127-V161 HydrophobicContact CB-CG2 4.12Å
128	A	92.2	Very high	90.8	Very high	3 Å²	3	48.3 Å²	48.3	3%	0.025	24%	0.236	C	C	.	.	H	α-helix	trans	-62.2	-45.3	178.5	0	0	0	0	0	112.5	Q124 A130 L131 R132 Y160 V161 T164	Q124-A128 VanDerWaalsContact O-CB 3.29Å; Q124-A128 WeakPolarHBondContact O-CB 3.46Å; Q124-A128 PolarHBondContact O-N 2.78Å; A128-A130 PolarHBondContact O-N 2.99Å; A128-L131 PolarHBondContact O-N 3.15Å; A128-R132 WeakPolarHBondContact O-CB 3.18Å; A128-R132 PolarHBondContact O-N 2.81Å; A128-Y160 HydrophobicContact CB-CD1 3.64Å; A128-Y160 HydrophobicContact CB-CE1 3.5Å; A128-V161 HydrophobicContact CB-CG2 4.25Å; A128-T164 HydrophobicContact CB-CG2 4.29Å; A128-T164 WeakPolarHBondContact O-CG2 3.24Å
129	S	90.4	Very high	90.7	Very high	34 Å²	34	48.2 Å²	48.2	24%	0.238	23%	0.234	C	C	.	.	H	α-helix	trans	-67.4	-35.1	178.8	57.4	0	0	0	0	113	L125 I126 V133	L125-S129 VanDerWaalsContact O-CB 3.25Å; L125-S129 WeakPolarHBondContact O-CB 3.44Å; L125-S129 PolarHBondContact O-N 3.24Å; L125-S129 PolarHBondContact O-OG 3.32Å; I126-S129 PolarHBondContact O-N 3.42Å; I126-S129 PolarHBondContact O-OG 2.93Å; S129-V133 WeakPolarHBondContact O-CG2 3.31Å; S129-V133 PolarHBondContact O-N 3.16Å
130	A	91.6	Very high	90.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-46.7	171.6	0	0	0	0	0	111.7	F115 L119 I126 R127 A128 R132 V133 L134	F115-A130 HydrophobicContact CD1-CB 4.3Å; L119-A130 HydrophobicContact CD2-CB 4.34Å; I126-A130 VanDerWaalsContact O-CB 3.28Å; I126-A130 WeakPolarHBondContact O-CB 3.19Å; I126-A130 PolarHBondContact O-N 2.62Å; R127-A130 PolarHBondContact O-N 2.76Å; A128-A130 PolarHBondContact O-N 2.99Å; A130-R132 PolarHBondContact O-N 2.92Å; A130-V133 PolarHBondContact O-N 2.98Å; A130-L134 WeakPolarHBondContact O-CB 3.43Å; A130-L134 PolarHBondContact O-N 3.42Å
131	L	93.3	Very high	90.3	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-62.2	-41.7	177	-173.2	62.6	0	0	0	112.4	L119 R127 A128 V133 L134 S135 A149 I150 A153 T164 A165 A168	L119-L131 HydrophobicContact CD2-CB 3.66Å; L119-L131 HydrophobicContact CD2-CD1 4.06Å; L119-L131 HydrophobicContact CD2-CG 4.41Å; R127-L131 PolarHBondContact O-N 3.41Å; A128-L131 PolarHBondContact O-N 3.15Å; L131-V133 VanDerWaalsContact C-N 3.3Å; L131-V133 PolarHBondContact O-N 3.46Å; L131-L134 PolarHBondContact O-N 2.91Å; L131-S135 WeakPolarHBondContact O-CB 3.31Å; L131-S135 PolarHBondContact O-N 3.07Å; L131-S135 PolarHBondContact O-OG 3.26Å; L131-A149 HydrophobicContact CD1-CB 4.14Å; L131-I150 HydrophobicContact CD1-CG1 4.23Å; L131-A153 HydrophobicContact CD2-CB 3.48Å; L131-A153 VanDerWaalsContact CD2-CB 3.48Å; L131-T164 HydrophobicContact CB-CG2 4.38Å; L131-T164 HydrophobicContact CD2-CG2 4.28Å; L131-T164 HydrophobicContact CG-CG2 4.5Å; L131-A165 HydrophobicContact CD2-CB 3.98Å; L131-A168 HydrophobicContact CG-CB 4.5Å
132	R	92.3	Very high	90.3	Very high	151 Å²	151	48.2 Å²	48.2	57%	0.57	24%	0.244	S	C	*	.	H	α-helix	trans	-63.9	-34	179.3	-168	-178.1	71.9	151	3.3	112.5	A128 A130 S135 S136 T164	A128-R132 WeakPolarHBondContact O-CB 3.18Å; A128-R132 PolarHBondContact O-N 2.81Å; A130-R132 PolarHBondContact O-N 2.92Å; R132-S135 PolarHBondContact O-OG 3.39Å; R132-S136 WeakPolarHBondContact O-CB 3.37Å; R132-S136 PolarHBondContact O-N 3.21Å; R132-S136 PolarHBondContact O-OG 2.94Å; R132-T164 HydrophobicContact CB-CG2 4.09Å
133	V	91.4	Very high	90.3	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.018	21%	0.208	C	C	.	.	H	α-helix	trans	-81.5	-44.6	177.6	177.4	0	0	0	0	111.1	Y94 V98 F115 S129 A130 L131 S135 S136 I137	Y94-V133 HydrophobicContact CD2-CG2 3.65Å; Y94-V133 HydrophobicContact CE2-CG2 4.38Å; Y94-V133 HydrophobicContact CG-CG2 3.75Å; V98-V133 HydrophobicContact CG2-CB 4.49Å; V98-V133 HydrophobicContact CG2-CG1 3.96Å; V98-V133 HydrophobicContact CG2-CG2 4.34Å; F115-V133 HydrophobicContact CD1-CB 4.39Å; F115-V133 HydrophobicContact CD1-CG1 4.42Å; F115-V133 HydrophobicContact CE1-CB 3.7Å; F115-V133 HydrophobicContact CE1-CG1 3.44Å; F115-V133 VanDerWaalsContact CE1-CG1 3.44Å; F115-V133 HydrophobicContact CE1-CG2 4.5Å; F115-V133 HydrophobicContact CE2-CG1 4.17Å; F115-V133 HydrophobicContact CZ-CB 4.1Å; F115-V133 HydrophobicContact CZ-CG1 3.3Å; S129-V133 WeakPolarHBondContact O-CG2 3.31Å; S129-V133 PolarHBondContact O-N 3.16Å; A130-V133 PolarHBondContact O-N 2.98Å; L131-V133 VanDerWaalsContact C-N 3.3Å; L131-V133 PolarHBondContact O-N 3.46Å; V133-S135 PolarHBondContact O-N 2.69Å; V133-S136 PolarHBondContact O-N 3.32Å; V133-I137 HydrophobicContact CG1-CD1 4.23Å; V133-I137 WeakPolarHBondContact O-CG1 3.47Å; V133-I137 PolarHBondContact O-N 2.67Å
134	L	91.2	Very high	90.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-53.9	-43.5	174.2	-175.1	67.7	0	0	0	111.1	I112 F115 L119 A130 L131 S136 I137 I142 A149	I112-L134 HydrophobicContact CG2-CD1 4.37Å; F115-L134 HydrophobicContact CB-CB 4.46Å; F115-L134 HydrophobicContact CB-CD1 4.29Å; L119-L134 HydrophobicContact CD1-CD2 4.13Å; A130-L134 WeakPolarHBondContact O-CB 3.43Å; A130-L134 PolarHBondContact O-N 3.42Å; L131-L134 PolarHBondContact O-N 2.91Å; L134-S136 VanDerWaalsContact C-N 3.27Å; L134-S136 PolarHBondContact O-N 3.4Å; L134-I137 PolarHBondContact O-N 2.93Å; L134-I142 HydrophobicContact CD1-CD1 3.93Å; L134-I142 HydrophobicContact CG-CD1 4.46Å; L134-I142 WeakPolarHBondContact O-CD1 3.37Å; L134-A149 HydrophobicContact CD2-CB 3.84Å
135	S	91.8	Very high	90.2	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.021	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-1.2	175.8	59.3	0	0	0	0	116	L131 R132 V133 M146 K171	L131-S135 WeakPolarHBondContact O-CB 3.31Å; L131-S135 PolarHBondContact O-N 3.07Å; L131-S135 PolarHBondContact O-OG 3.26Å; R132-S135 PolarHBondContact O-OG 3.39Å; V133-S135 PolarHBondContact O-N 2.69Å; S135-M146 VanDerWaalsContact CA-SD 3.54Å; S135-K171 VanDerWaalsContact O-CB 3.29Å; S135-K171 WeakPolarHBondContact O-CB 3.39Å; S135-K171 WeakPolarHBondContact O-CD 3.43Å
136	S	91.1	Very high	90.3	Very high	29 Å²	29	38.4 Å²	38.4	20%	0.203	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	7.6	174.8	-50.2	0	0	0	0	112.9	R132 V133 L134 K171	R132-S136 WeakPolarHBondContact O-CB 3.37Å; R132-S136 PolarHBondContact O-N 3.21Å; R132-S136 PolarHBondContact O-OG 2.94Å; V133-S136 PolarHBondContact O-N 3.32Å; L134-S136 VanDerWaalsContact C-N 3.27Å; L134-S136 PolarHBondContact O-N 3.4Å; S136-K171 PolarHBondContact OG-NZ 3.19Å
137	I	89.1	Confident	90.4	Very high	5 Å²	5	37.9 Å²	37.9	3%	0.026	19%	0.19	C	C	.	.			trans	-95.9	107.7	174.2	-68.9	165.1	0	0	0	108	A101 F115 V133 L134 V139 I142	A101-I137 HydrophobicContact CB-CG1 4.13Å; A101-I137 HydrophobicContact CB-CG2 4.15Å; F115-I137 HydrophobicContact CD2-CD1 4.44Å; F115-I137 HydrophobicContact CE2-CD1 3.84Å; F115-I137 HydrophobicContact CZ-CD1 4.43Å; V133-I137 HydrophobicContact CG1-CD1 4.23Å; V133-I137 WeakPolarHBondContact O-CG1 3.47Å; V133-I137 PolarHBondContact O-N 2.67Å; L134-I137 PolarHBondContact O-N 2.93Å; I137-V139 VanDerWaalsContact C-N 3.27Å; I137-V139 HydrophobicContact CG2-CB 4.08Å; I137-V139 HydrophobicContact CG2-CG2 3.69Å; I137-V139 PolarHBondContact O-N 2.78Å; I137-I142 HydrophobicContact CB-CD1 4.13Å; I137-I142 HydrophobicContact CG2-CD1 4.21Å
138	R	85.4	Confident	90.4	Very high	154 Å²	154	41.2 Å²	41.2	58%	0.581	21%	0.21	S	C	*	.			trans	-81.6	63.7	-177.4	-59.9	-162.4	-172.1	113.7	-15	112.9	E102 L175	E102-R138 HydrophobicContact CG-CB 4.24Å; E102-R138 WeakPolarHBondContact OE1-CB 3.36Å; E102-R138 WeakPolarHBondContact OE1-CD 3.49Å; E102-R138 WeakPolarHBondContact OE1-CG 3.11Å; E102-R138 IonicContact OE1-CZ 2.79Å; E102-R138 IonicContact OE1-NE 3.71Å; E102-R138 IonicContact OE1-NH1 2.68Å; E102-R138 PolarHBondContact OE1-NH1 3Å; E102-R138 IonicContact OE2-NH1 2.71Å; E102-R138 PolarHBondContact OE2-NH1 2.66Å; R138-L175 HydrophobicContact CB-CD2 3.67Å; R138-L175 HydrophobicContact CG-CD2 3.87Å
139	V	87.3	Confident	90.4	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.012	21%	0.211	C	C	.	.			trans	-121.3	107.3	179	177.2	0	0	0	0	109.4	Q105 L109 I137 I141 I142	Q105-V139 HydrophobicContact CB-CG1 4.49Å; Q105-V139 HydrophobicContact CB-CG2 4.06Å; Q105-V139 HydrophobicContact CG-CG2 3.94Å; L109-V139 HydrophobicContact CD2-CG1 4.13Å; I137-V139 VanDerWaalsContact C-N 3.27Å; I137-V139 HydrophobicContact CG2-CB 4.08Å; I137-V139 HydrophobicContact CG2-CG2 3.69Å; I137-V139 PolarHBondContact O-N 2.78Å; V139-I141 HydrophobicContact CG1-CB 4.27Å; V139-I141 PolarHBondContact O-N 3.22Å; V139-I142 HydrophobicContact CB-CG2 4.17Å; V139-I142 HydrophobicContact CG1-CG2 4.22Å; V139-I142 WeakPolarHBondContact O-CG1 3.27Å; V139-I142 PolarHBondContact O-N 2.7Å
140	P	85.3	Confident	90.6	Very high	83 Å²	83	39.7 Å²	39.7	54%	0.539	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-53.9	-31.5	-171.9	-30.6	36.5	0	0	0	115.3	I142 V143	P140-I142 PolarHBondContact O-N 2.81Å; P140-V143 WeakPolarHBondContact O-CB 3.35Å; P140-V143 WeakPolarHBondContact O-CG2 3.29Å; P140-V143 PolarHBondContact O-N 2.99Å; P140-V143 VanDerWaalsContact O-N 3.1Å
141	I	88.5	Confident	90.7	Very high	123 Å²	123	42.3 Å²	42.3	63%	0.631	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-56.8	-25	177.9	-58.2	172.4	0	0	0	112.5	V139	V139-I141 HydrophobicContact CG1-CB 4.27Å; V139-I141 PolarHBondContact O-N 3.22Å
142	I	89.2	Confident	90.7	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-85.6	-7.9	-177.6	85.4	165.6	0	0	0	114	L109 I112 L134 I137 V139 P140 I145 M146	L109-I142 HydrophobicContact CD2-CG2 4.32Å; I112-I142 HydrophobicContact CD1-CB 4.34Å; I112-I142 HydrophobicContact CD1-CG2 3.38Å; I112-I142 HydrophobicContact CG1-CG2 4.27Å; L134-I142 HydrophobicContact CD1-CD1 3.93Å; L134-I142 HydrophobicContact CG-CD1 4.46Å; L134-I142 WeakPolarHBondContact O-CD1 3.37Å; I137-I142 HydrophobicContact CB-CD1 4.13Å; I137-I142 HydrophobicContact CG2-CD1 4.21Å; V139-I142 HydrophobicContact CB-CG2 4.17Å; V139-I142 HydrophobicContact CG1-CG2 4.22Å; V139-I142 WeakPolarHBondContact O-CG1 3.27Å; V139-I142 PolarHBondContact O-N 2.7Å; P140-I142 PolarHBondContact O-N 2.81Å; I142-I145 WeakPolarHBondContact O-CB 3.45Å; I142-I145 PolarHBondContact O-N 3.04Å; I142-M146 HydrophobicContact CG1-CE 4.27Å; I142-M146 PolarHBondContact O-N 2.81Å
143	V	90.4	Very high	90.7	Very high	8 Å²	8	39.3 Å²	39.3	5%	0.048	21%	0.205	C	C	.	.	H	α-helix	trans	-52.2	-48.8	-172.2	157.4	0	0	0	0	113.8	P140 I145 M146 M147 L172 L175 D176 Q179	P140-V143 WeakPolarHBondContact O-CB 3.35Å; P140-V143 WeakPolarHBondContact O-CG2 3.29Å; P140-V143 PolarHBondContact O-N 2.99Å; P140-V143 VanDerWaalsContact O-N 3.1Å; V143-I145 VanDerWaalsContact C-N 3.31Å; V143-I145 PolarHBondContact O-N 3.24Å; V143-M146 HydrophobicContact CG2-CE 4.38Å; V143-M146 PolarHBondContact O-N 2.84Å; V143-M147 PolarHBondContact O-N 3.06Å; V143-L172 HydrophobicContact CB-CD1 4.31Å; V143-L172 HydrophobicContact CG1-CD1 3.89Å; V143-L172 HydrophobicContact CG2-CD1 4.04Å; V143-L175 HydrophobicContact CG2-CB 4.47Å; V143-D176 HydrophobicContact CG1-CB 3.87Å; V143-D176 WeakPolarHBondContact CG1-OD2 3.32Å; V143-D176 HydrophobicContact CG2-CB 3.98Å; V143-Q179 HydrophobicContact CG1-CG 4.02Å
144	P	91.4	Very high	90.8	Very high	94 Å²	94	39.4 Å²	39.4	61%	0.61	21%	0.206	S	C	*	.	H	α-helix	trans	-64.7	-33.5	178.6	-23.3	35	0	0	0	113.5	L148	P144-L148 PolarHBondContact O-N 2.97Å
145	I	90.9	Very high	90.9	Very high	56 Å²	56	42.5 Å²	42.5	29%	0.287	23%	0.228	S	C	.	.	H	α-helix	trans	-69.9	-40.7	176.6	-64.2	170.5	0	0	0	110.1	I112 Q116 I142 V143 L148 A149	I112-I145 HydrophobicContact CG2-CD1 4.09Å; I112-I145 HydrophobicContact CG2-CG2 4.14Å; Q116-I145 HydrophobicContact CG-CG2 4.1Å; Q116-I145 VanDerWaalsContact NE2-CG2 3.3Å; I142-I145 WeakPolarHBondContact O-CB 3.45Å; I142-I145 PolarHBondContact O-N 3.04Å; V143-I145 VanDerWaalsContact C-N 3.31Å; V143-I145 PolarHBondContact O-N 3.24Å; I145-L148 PolarHBondContact O-N 2.86Å; I145-A149 WeakPolarHBondContact O-CB 3.49Å; I145-A149 PolarHBondContact O-N 3.09Å
146	M	91.7	Very high	91	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.4	-41.7	177.7	178.1	158	52.1	0	0	112.2	S135 I142 V143 A149 I150 L172 L175	S135-M146 VanDerWaalsContact CA-SD 3.54Å; I142-M146 HydrophobicContact CG1-CE 4.27Å; I142-M146 PolarHBondContact O-N 2.81Å; V143-M146 HydrophobicContact CG2-CE 4.38Å; V143-M146 PolarHBondContact O-N 2.84Å; M146-A149 PolarHBondContact O-N 3.19Å; M146-I150 HydrophobicContact CG-CD1 3.86Å; M146-I150 WeakPolarHBondContact O-CB 3.26Å; M146-I150 WeakPolarHBondContact O-CG1 3.44Å; M146-I150 PolarHBondContact O-N 3.18Å; M146-L172 HydrophobicContact CE-CB 4.2Å; M146-L172 HydrophobicContact CE-CD1 3.74Å; M146-L172 HydrophobicContact CE-CG 4.48Å; M146-L172 HydrophobicContact CG-CB 4.35Å; M146-L172 HydrophobicContact CG-CD1 4.43Å; M146-L172 HydrophobicContact CG-CD2 4.16Å; M146-L172 HydrophobicContact SD-CB 4.32Å; M146-L175 HydrophobicContact CE-CD1 3.72Å
147	M	92.1	Very high	90.9	Very high	8 Å²	8	50.5 Å²	50.5	4%	0.039	27%	0.265	C	S	.	.	H	α-helix	trans	-56.8	-50.5	172.4	172	55	77.7	0	0	111.3	V143 A149 I150 K151 L172 Q179 Q182 L183	V143-M147 PolarHBondContact O-N 3.06Å; M147-A149 PolarHBondContact O-N 3.07Å; M147-I150 PolarHBondContact O-N 3.26Å; M147-K151 HydrophobicContact CG-CD 4.38Å; M147-K151 PolarHBondContact O-N 3.05Å; M147-K151 HydrophobicContact SD-CD 3.79Å; M147-K151 VanDerWaalsContact SD-CE 3.59Å; M147-K151 HydrophobicContact SD-CG 4.01Å; M147-L172 HydrophobicContact CB-CD2 4.03Å; M147-L172 HydrophobicContact CE-CD2 4.05Å; M147-Q179 HydrophobicContact CE-CB 3.67Å; M147-Q179 HydrophobicContact CE-CG 4.19Å; M147-Q182 HydrophobicContact CE-CB 3.37Å; M147-Q182 HydrophobicContact CE-CG 4.46Å; M147-Q182 HydrophobicContact SD-CB 4Å; M147-L183 HydrophobicContact CE-CD2 3.75Å; M147-L183 HydrophobicContact CE-CG 4.01Å
148	L	91.7	Very high	91.2	Very high	107 Å²	107	50.7 Å²	50.7	56%	0.56	27%	0.266	S	S	*	.	H	α-helix	trans	-62	-42.3	177.8	-176.9	62.3	0	0	0	111.9	P144 I145 I150 K151 E152	P144-L148 PolarHBondContact O-N 2.97Å; I145-L148 PolarHBondContact O-N 2.86Å; L148-I150 VanDerWaalsContact C-N 3.33Å; L148-I150 PolarHBondContact O-N 3.35Å; L148-K151 PolarHBondContact O-N 3.35Å; L148-E152 PolarHBondContact O-N 3.02Å
149	A	93	Very high	91.5	Very high	5 Å²	5	45.1 Å²	45.1	4%	0.041	25%	0.25	C	C	.	.	H	α-helix	trans	-60.8	-39	176.2	0	0	0	0	0	112.9	L119 L131 L134 I145 M146 M147 A153	L119-A149 HydrophobicContact CD1-CB 3.45Å; L119-A149 VanDerWaalsContact CD1-CB 3.45Å; L131-A149 HydrophobicContact CD1-CB 4.14Å; L134-A149 HydrophobicContact CD2-CB 3.84Å; I145-A149 WeakPolarHBondContact O-CB 3.49Å; I145-A149 PolarHBondContact O-N 3.09Å; M146-A149 PolarHBondContact O-N 3.19Å; M147-A149 PolarHBondContact O-N 3.07Å; A149-A153 WeakPolarHBondContact O-CB 3.41Å; A149-A153 PolarHBondContact O-N 3.42Å
150	I	94.4	Very high	91.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-70.5	-42.3	176.3	-71.5	166.6	0	0	0	110.6	L131 M146 M147 L148 A153 A154 A168 I169 L172 V186	L131-I150 HydrophobicContact CD1-CG1 4.23Å; M146-I150 HydrophobicContact CG-CD1 3.86Å; M146-I150 WeakPolarHBondContact O-CB 3.26Å; M146-I150 WeakPolarHBondContact O-CG1 3.44Å; M146-I150 PolarHBondContact O-N 3.18Å; M147-I150 PolarHBondContact O-N 3.26Å; L148-I150 VanDerWaalsContact C-N 3.33Å; L148-I150 PolarHBondContact O-N 3.35Å; I150-A153 PolarHBondContact O-N 3.08Å; I150-A154 VanDerWaalsContact O-CB 3.28Å; I150-A154 WeakPolarHBondContact O-CB 3.05Å; I150-A154 PolarHBondContact O-N 3.03Å; I150-A168 HydrophobicContact CD1-CB 3.76Å; I150-A168 HydrophobicContact CG1-CB 3.9Å; I150-I169 HydrophobicContact CG2-CD1 4.5Å; I150-I169 HydrophobicContact CG2-CG1 3.87Å; I150-L172 HydrophobicContact CD1-CB 4.09Å; I150-L172 HydrophobicContact CD1-CD2 3.77Å; I150-V186 HydrophobicContact CG2-CG1 4.14Å
151	K	94	Very high	92.3	Very high	56 Å²	56	47 Å²	47	24%	0.243	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-38.4	175.4	-78.6	-177.8	168.1	-173.6	0	112.7	M147 L148 S155 Q182 E185 V186	M147-K151 HydrophobicContact CG-CD 4.38Å; M147-K151 PolarHBondContact O-N 3.05Å; M147-K151 HydrophobicContact SD-CD 3.79Å; M147-K151 VanDerWaalsContact SD-CE 3.59Å; M147-K151 HydrophobicContact SD-CG 4.01Å; L148-K151 PolarHBondContact O-N 3.35Å; K151-S155 PolarHBondContact O-OG 2.96Å; K151-S155 VanDerWaalsContact O-OG 3.11Å; K151-Q182 WeakPolarHBondContact CE-O 3.45Å; K151-E185 WeakPolarHBondContact CE-OE2 3.44Å; K151-E185 IonicContact NZ-OE2 3.32Å; K151-E185 PolarHBondContact NZ-OE2 3.27Å; K151-V186 HydrophobicContact CD-CG2 4.4Å; K151-V186 HydrophobicContact CG-CG2 3.56Å
152	E	92.4	Very high	92.6	Very high	81 Å²	81	42.6 Å²	42.6	38%	0.379	22%	0.223	S	C	.	.	H	α-helix	trans	-64.4	-53.9	169.2	-74.4	-169.8	166.2	0	0	111.1	K120 L148 A154 S155	K120-E152 WeakPolarHBondContact CE-OE2 3.26Å; K120-E152 VanDerWaalsContact NZ-CD 3.25Å; K120-E152 IonicContact NZ-OE1 2.69Å; K120-E152 PolarHBondContact NZ-OE1 2.85Å; K120-E152 IonicContact NZ-OE2 3.82Å; K120-E152 PolarHBondContact NZ-OE2 3.43Å; L148-E152 PolarHBondContact O-N 3.02Å; E152-A154 PolarHBondContact O-N 3.09Å; E152-S155 WeakPolarHBondContact O-CA 3.44Å; E152-S155 VanDerWaalsContact O-CB 3.23Å; E152-S155 WeakPolarHBondContact O-CB 3.44Å; E152-S155 PolarHBondContact O-N 3.33Å; E152-S155 PolarHBondContact O-OG 3.45Å
153	A	93.4	Very high	92.9	Very high	7 Å²	7	44.2 Å²	44.2	6%	0.058	23%	0.23	C	C	.	.	H	α-helix	trans	-67.3	-28.9	-173.4	0	0	0	0	0	114.6	L131 A149 I150 S155 D156 V161 A165	L131-A153 HydrophobicContact CD2-CB 3.48Å; L131-A153 VanDerWaalsContact CD2-CB 3.48Å; A149-A153 WeakPolarHBondContact O-CB 3.41Å; A149-A153 PolarHBondContact O-N 3.42Å; I150-A153 PolarHBondContact O-N 3.08Å; A153-S155 PolarHBondContact O-N 3.46Å; A153-D156 VanDerWaalsContact O-CB 3.31Å; A153-D156 WeakPolarHBondContact O-CB 3.48Å; A153-D156 PolarHBondContact O-N 2.78Å; A153-D156 VanDerWaalsContact O-N 3.11Å; A153-V161 HydrophobicContact CB-CG1 4Å; A153-A165 HydrophobicContact CB-CB 3.97Å
154	A	93.2	Very high	93.1	Very high	5 Å²	5	44.6 Å²	44.6	4%	0.041	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-11.7	170.2	0	0	0	0	0	113.2	I150 E152 R162 V186 L190	I150-A154 VanDerWaalsContact O-CB 3.28Å; I150-A154 WeakPolarHBondContact O-CB 3.05Å; I150-A154 PolarHBondContact O-N 3.03Å; E152-A154 PolarHBondContact O-N 3.09Å; A154-R162 WeakPolarHBondContact O-CD 3.39Å; A154-V186 HydrophobicContact CB-CG1 3.59Å; A154-L190 HydrophobicContact CB-CD1 4.1Å; A154-L190 HydrophobicContact CB-CD2 3.95Å; A154-L190 HydrophobicContact CB-CG 4.07Å
155	S	92.1	Very high	93.3	Very high	66 Å²	66	40.1 Å²	40.1	46%	0.462	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	1.2	175.2	-42.8	0	0	0	0	113.3	K151 E152 A153 K189	K151-S155 PolarHBondContact O-OG 2.96Å; K151-S155 VanDerWaalsContact O-OG 3.11Å; E152-S155 WeakPolarHBondContact O-CA 3.44Å; E152-S155 VanDerWaalsContact O-CB 3.23Å; E152-S155 WeakPolarHBondContact O-CB 3.44Å; E152-S155 PolarHBondContact O-N 3.33Å; E152-S155 PolarHBondContact O-OG 3.45Å; A153-S155 PolarHBondContact O-N 3.46Å; S155-K189 PolarHBondContact OG-NZ 2.66Å
156	D	94	Very high	93.5	Very high	26 Å²	26	37.5 Å²	37.5	14%	0.139	19%	0.19	C	C	.	.			trans	-65.1	144.6	-174.6	-162.7	-68.4	0	0	0	111.9	R127 A153 S158 V161 R162	R127-D156 IonicContact CZ-OD1 2.74Å; R127-D156 IonicContact CZ-OD2 3.29Å; R127-D156 IonicContact NE-OD1 3.83Å; R127-D156 IonicContact NE-OD2 3.03Å; R127-D156 PolarHBondContact NE-OD2 2.78Å; R127-D156 IonicContact NH2-OD1 2.71Å; R127-D156 PolarHBondContact NH2-OD1 2.93Å; R127-D156 IonicContact NH2-OD2 3.68Å; R127-D156 PolarHBondContact NH2-OD2 3.18Å; R127-D156 VanDerWaalsContact NH2-OD2 3.14Å; A153-D156 VanDerWaalsContact O-CB 3.31Å; A153-D156 WeakPolarHBondContact O-CB 3.48Å; A153-D156 PolarHBondContact O-N 2.78Å; A153-D156 VanDerWaalsContact O-N 3.11Å; D156-S158 PolarHBondContact O-N 3.16Å; D156-S158 WeakPolarHBondContact OD1-CB 3.41Å; D156-S158 PolarHBondContact OD1-N 2.95Å; D156-V161 HydrophobicContact CB-CB 3.76Å; D156-V161 HydrophobicContact CB-CG1 3.63Å; D156-R162 HydrophobicContact CB-CG 4.35Å; D156-R162 VanDerWaalsContact O-CD 3.3Å; D156-R162 WeakPolarHBondContact O-CD 3.27Å; D156-R162 WeakPolarHBondContact O-CG 3.46Å; D156-R162 PolarHBondContact O-NH1 2.89Å
157	M	90.5	Very high	93.6	Very high	174 Å²	174	41.4 Å²	41.4	86%	0.857	21%	0.208	S	C	*	.	S	Bend	trans	-59.2	-33.1	175.3	-60.3	-60.1	-68.5	0	0	112.4	R162	M157-R162 PolarHBondContact O-NH1 3.02Å
158	S	93.7	Very high	93.7	Very high	8 Å²	8	41 Å²	41	6%	0.056	21%	0.206	C	C	.	.			trans	-81.2	122.9	-178	-179.8	0	0	0	0	112.7	Q124 D156 Y160 V161 R162	Q124-S158 VanDerWaalsContact OE1-CB 3.3Å; Q124-S158 PolarHBondContact OE1-OG 2.95Å; D156-S158 PolarHBondContact O-N 3.16Å; D156-S158 WeakPolarHBondContact OD1-CB 3.41Å; D156-S158 PolarHBondContact OD1-N 2.95Å; S158-Y160 PolarHBondContact O-N 3.21Å; S158-Y160 PolarHBondContact OG-N 3.5Å; S158-V161 PolarHBondContact O-N 3.43Å; S158-V161 VanDerWaalsContact O-N 3.15Å; S158-R162 PolarHBondContact O-N 3.35Å; S158-R162 VanDerWaalsContact O-N 3.16Å
159	P	93.1	Very high	93.8	Very high	37 Å²	37	36 Å²	36	24%	0.24	18%	0.179	C	C	.	.	H	α-helix	trans	-57.6	-29.4	170.7	-23.1	33.8	0	0	0	113.1	R162 K163 T195 L197 V198	P159-R162 PolarHBondContact O-N 2.83Å; P159-K163 WeakPolarHBondContact O-CB 2.95Å; P159-K163 PolarHBondContact O-N 3.2Å; P159-T195 HydrophobicContact CG-CG2 4.21Å; P159-L197 HydrophobicContact CB-CD1 4.44Å; P159-V198 HydrophobicContact CB-CG2 4.03Å; P159-V198 WeakPolarHBondContact O-CG2 3.38Å
160	Y	93.8	Very high	93.8	Very high	121 Å²	121	35.9 Å²	35.9	48%	0.475	18%	0.179	S	C	.	.	H	α-helix	trans	-68.1	-37.1	178.6	-174.1	-104.1	0	0	0	112.4	L125 A128 S158 T164	L125-Y160 HydrophobicContact CD2-CD1 4.03Å; L125-Y160 HydrophobicContact CD2-CE1 3.74Å; A128-Y160 HydrophobicContact CB-CD1 3.64Å; A128-Y160 HydrophobicContact CB-CE1 3.5Å; S158-Y160 PolarHBondContact O-N 3.21Å; S158-Y160 PolarHBondContact OG-N 3.5Å; Y160-T164 PolarHBondContact O-N 2.87Å; Y160-T164 VanDerWaalsContact O-N 3.08Å; Y160-T164 PolarHBondContact O-OG1 2.94Å
161	V	95.1	Very high	93.7	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.018	19%	0.193	C	C	.	.	H	α-helix	trans	-71.2	-42.2	174.6	179.9	0	0	0	0	110.2	Q124 R127 A128 A153 D156 S158 K163 T164 A165	Q124-V161 HydrophobicContact CB-CG2 4.11Å; Q124-V161 WeakPolarHBondContact O-CG2 3.49Å; R127-V161 HydrophobicContact CB-CG2 4.12Å; A128-V161 HydrophobicContact CB-CG2 4.25Å; A153-V161 HydrophobicContact CB-CG1 4Å; D156-V161 HydrophobicContact CB-CB 3.76Å; D156-V161 HydrophobicContact CB-CG1 3.63Å; S158-V161 PolarHBondContact O-N 3.43Å; S158-V161 VanDerWaalsContact O-N 3.15Å; V161-K163 PolarHBondContact O-N 3.41Å; V161-T164 CarbonylContact O-C 3.56Å; V161-T164 WeakPolarHBondContact O-CA 3.15Å; V161-T164 WeakPolarHBondContact O-CB 3.49Å; V161-T164 PolarHBondContact O-N 3.36Å; V161-T164 VanDerWaalsContact O-N 3.09Å; V161-A165 PolarHBondContact O-N 2.92Å
162	R	95.2	Very high	93.7	Very high	31 Å²	31	36.6 Å²	36.6	12%	0.117	18%	0.181	C	C	.	.	H	α-helix	trans	-63.9	-39.6	175.7	-61.5	-164.4	-54.3	-85.3	3.7	112.9	A154 D156 M157 S158 P159 T164 A165 A166 L190 D193 T195 V198	A154-R162 WeakPolarHBondContact O-CD 3.39Å; D156-R162 HydrophobicContact CB-CG 4.35Å; D156-R162 VanDerWaalsContact O-CD 3.3Å; D156-R162 WeakPolarHBondContact O-CD 3.27Å; D156-R162 WeakPolarHBondContact O-CG 3.46Å; D156-R162 PolarHBondContact O-NH1 2.89Å; M157-R162 PolarHBondContact O-NH1 3.02Å; S158-R162 PolarHBondContact O-N 3.35Å; S158-R162 VanDerWaalsContact O-N 3.16Å; P159-R162 PolarHBondContact O-N 2.83Å; R162-T164 VanDerWaalsContact C-N 3.29Å; R162-T164 PolarHBondContact O-N 3.47Å; R162-A165 WeakPolarHBondContact O-CB 3.48Å; R162-A165 PolarHBondContact O-N 3.17Å; R162-A166 PolarHBondContact O-N 3.33Å; R162-L190 HydrophobicContact CB-CD2 4.14Å; R162-D193 IonicContact CZ-OD2 3.86Å; R162-D193 IonicContact NE-OD2 3.56Å; R162-D193 PolarHBondContact NE-OD2 3.44Å; R162-D193 IonicContact NH2-OD1 3.73Å; R162-D193 PolarHBondContact NH2-OD1 3.41Å; R162-D193 IonicContact NH2-OD2 2.83Å; R162-D193 PolarHBondContact NH2-OD2 2.86Å; R162-T195 PolarHBondContact NH2-OG1 3.38Å; R162-V198 HydrophobicContact CB-CG1 4.4Å; R162-V198 HydrophobicContact CB-CG2 4.09Å
163	K	94.3	Very high	93.6	Very high	36 Å²	36	35.9 Å²	35.9	16%	0.157	18%	0.176	C	C	.	.	H	α-helix	trans	-58.1	-42.3	169.7	-168.2	-172.4	-172.6	-179.7	0	111.4	P159 V161 A166 H167 L197 V198 S201 E232	P159-K163 WeakPolarHBondContact O-CB 2.95Å; P159-K163 PolarHBondContact O-N 3.2Å; V161-K163 PolarHBondContact O-N 3.41Å; K163-A166 PolarHBondContact O-N 2.74Å; K163-H167 PolarHBondContact O-CD2 3.45Å; K163-H167 VanDerWaalsContact O-CD2 3.23Å; K163-H167 PolarHBondContact O-N 3.14Å; K163-H167 VanDerWaalsContact O-N 3.15Å; K163-L197 WeakPolarHBondContact CD-O 3.24Å; K163-L197 WeakPolarHBondContact CE-O 3.44Å; K163-L197 WeakPolarHBondContact CG-O 3.33Å; K163-V198 HydrophobicContact CB-CG2 4.41Å; K163-S201 WeakPolarHBondContact CE-OG 3.47Å; K163-S201 WeakPolarHBondContact CG-OG 3.41Å; K163-E232 IonicContact NZ-OE1 3.75Å; K163-E232 PolarHBondContact NZ-OE1 3.26Å; K163-E232 IonicContact NZ-OE2 2.65Å; K163-E232 PolarHBondContact NZ-OE2 3.38Å
164	T	94.9	Very high	93.5	Very high	16 Å²	16	39.7 Å²	39.7	10%	0.098	20%	0.202	C	C	.	.	H	α-helix	trans	-69	-34	177.7	-53.6	0	0	0	0	112.2	A128 L131 R132 Y160 V161 R162 H167 A168	A128-T164 HydrophobicContact CB-CG2 4.29Å; A128-T164 WeakPolarHBondContact O-CG2 3.24Å; L131-T164 HydrophobicContact CB-CG2 4.38Å; L131-T164 HydrophobicContact CD2-CG2 4.28Å; L131-T164 HydrophobicContact CG-CG2 4.5Å; R132-T164 HydrophobicContact CB-CG2 4.09Å; Y160-T164 PolarHBondContact O-N 2.87Å; Y160-T164 VanDerWaalsContact O-N 3.08Å; Y160-T164 PolarHBondContact O-OG1 2.94Å; V161-T164 CarbonylContact O-C 3.56Å; V161-T164 WeakPolarHBondContact O-CA 3.15Å; V161-T164 WeakPolarHBondContact O-CB 3.49Å; V161-T164 PolarHBondContact O-N 3.36Å; V161-T164 VanDerWaalsContact O-N 3.09Å; R162-T164 VanDerWaalsContact C-N 3.29Å; R162-T164 PolarHBondContact O-N 3.47Å; T164-H167 PolarHBondContact O-N 3.07Å; T164-A168 PolarHBondContact O-N 2.83Å; T164-A168 VanDerWaalsContact O-N 3.16Å
165	A	95.5	Very high	93.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.4	-42.6	172.5	0	0	0	0	0	111.7	L131 A153 V161 R162 H167 A168 I169	L131-A165 HydrophobicContact CD2-CB 3.98Å; A153-A165 HydrophobicContact CB-CB 3.97Å; V161-A165 PolarHBondContact O-N 2.92Å; R162-A165 WeakPolarHBondContact O-CB 3.48Å; R162-A165 PolarHBondContact O-N 3.17Å; A165-H167 VanDerWaalsContact C-N 3.35Å; A165-H167 PolarHBondContact O-N 3.28Å; A165-A168 WeakPolarHBondContact O-CB 3.45Å; A165-A168 PolarHBondContact O-N 2.97Å; A165-I169 PolarHBondContact O-N 3.3Å
166	A	94.9	Very high	93.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.6	-44.8	172.9	0	0	0	0	0	112.2	R162 K163 A168 I169 P170 L190 V202	R162-A166 PolarHBondContact O-N 3.33Å; K163-A166 PolarHBondContact O-N 2.74Å; A166-A168 PolarHBondContact O-N 3.12Å; A166-I169 PolarHBondContact O-N 3.2Å; A166-P170 WeakPolarHBondContact O-CD 3.38Å; A166-L190 HydrophobicContact CB-CD1 4.35Å; A166-V202 HydrophobicContact CB-CG2 3.71Å
167	H	93.9	Very high	92.9	Very high	82 Å²	82	42.2 Å²	42.2	38%	0.38	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-6.9	174	-73.3	-66.2	0	0	0	115.3	K163 T164 A165 S201 M204	K163-H167 PolarHBondContact O-CD2 3.45Å; K163-H167 VanDerWaalsContact O-CD2 3.23Å; K163-H167 PolarHBondContact O-N 3.14Å; K163-H167 VanDerWaalsContact O-N 3.15Å; T164-H167 PolarHBondContact O-N 3.07Å; A165-H167 VanDerWaalsContact C-N 3.35Å; A165-H167 PolarHBondContact O-N 3.28Å; H167-S201 PolarHBondContact CD2-OG 2.72Å; H167-S201 PolarHBondContact CE1-OG 3.28Å; H167-S201 PolarHBondContact NE2-OG 3.06Å; H167-M204 WeakPolarHBondContact ND1-CE 3.35Å
168	A	94.5	Very high	92.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-21.8	174.8	0	0	0	0	0	112.5	L131 I150 T164 A165 A166 K171 L172	L131-A168 HydrophobicContact CG-CB 4.5Å; I150-A168 HydrophobicContact CD1-CB 3.76Å; I150-A168 HydrophobicContact CG1-CB 3.9Å; T164-A168 PolarHBondContact O-N 2.83Å; T164-A168 VanDerWaalsContact O-N 3.16Å; A165-A168 WeakPolarHBondContact O-CB 3.45Å; A165-A168 PolarHBondContact O-N 2.97Å; A166-A168 PolarHBondContact O-N 3.12Å; A168-K171 PolarHBondContact O-N 3.1Å; A168-L172 PolarHBondContact O-N 2.89Å; A168-L172 VanDerWaalsContact O-N 3.11Å
169	I	94.6	Very high	92.5	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-59.9	-50.7	-177.3	-73.9	168.3	0	0	0	112.4	I150 A165 A166 K171 L172 Y173 L183 V186 I187 L190 A205 V209	I150-I169 HydrophobicContact CG2-CD1 4.5Å; I150-I169 HydrophobicContact CG2-CG1 3.87Å; A165-I169 PolarHBondContact O-N 3.3Å; A166-I169 PolarHBondContact O-N 3.2Å; I169-K171 VanDerWaalsContact C-N 3.29Å; I169-K171 PolarHBondContact O-N 2.92Å; I169-L172 PolarHBondContact O-N 3.22Å; I169-Y173 PolarHBondContact O-N 3.49Å; I169-L183 HydrophobicContact CG1-CD2 4.32Å; I169-L183 HydrophobicContact CG2-CB 4.27Å; I169-L183 HydrophobicContact CG2-CD1 4.36Å; I169-L183 HydrophobicContact CG2-CD2 4.18Å; I169-V186 HydrophobicContact CD1-CB 4.33Å; I169-V186 HydrophobicContact CD1-CG1 3.81Å; I169-I187 HydrophobicContact CD1-CG1 4.04Å; I169-I187 HydrophobicContact CG2-CD1 4.02Å; I169-I187 HydrophobicContact CG2-CG1 4.18Å; I169-L190 HydrophobicContact CD1-CD1 4.05Å; I169-A205 HydrophobicContact CB-CB 4.25Å; I169-A205 HydrophobicContact CG2-CB 4.17Å; I169-V209 HydrophobicContact CG2-CG2 3.98Å
170	P	93.3	Very high	92.3	Very high	4 Å²	4	42.3 Å²	42.3	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-70.7	-25.3	-179.7	-18.9	32.7	0	0	0	113.8	A166 L172 Y173 S174 M204 A205 E208 V209	A166-P170 WeakPolarHBondContact O-CD 3.38Å; P170-L172 VanDerWaalsContact C-N 3.35Å; P170-Y173 PolarHBondContact O-N 2.63Å; P170-S174 WeakPolarHBondContact O-CB 3.45Å; P170-S174 PolarHBondContact O-N 2.86Å; P170-S174 PolarHBondContact O-OG 3.35Å; P170-M204 HydrophobicContact CG-CE 4.3Å; P170-M204 HydrophobicContact CG-SD 4.23Å; P170-A205 HydrophobicContact CG-CB 3.95Å; P170-E208 HydrophobicContact CB-CB 4.21Å; P170-E208 HydrophobicContact CB-CG 3.99Å; P170-E208 WeakPolarHBondContact CB-OE2 3.38Å; P170-E208 HydrophobicContact CG-CB 4.3Å; P170-E208 WeakPolarHBondContact CG-OE2 3.47Å; P170-V209 HydrophobicContact CB-CG2 4.32Å; P170-V209 HydrophobicContact CG-CG2 4.37Å
171	K	92.4	Very high	92.1	Very high	70 Å²	70	42.3 Å²	42.3	30%	0.304	22%	0.221	S	C	.	.	H	α-helix	trans	-69.9	-32.8	173.7	-56.2	-171.5	-173.9	177.8	0	112.6	S135 S136 A168 I169 S174 L175	S135-K171 VanDerWaalsContact O-CB 3.29Å; S135-K171 WeakPolarHBondContact O-CB 3.39Å; S135-K171 WeakPolarHBondContact O-CD 3.43Å; S136-K171 PolarHBondContact OG-NZ 3.19Å; A168-K171 PolarHBondContact O-N 3.1Å; I169-K171 VanDerWaalsContact C-N 3.29Å; I169-K171 PolarHBondContact O-N 2.92Å; K171-S174 WeakPolarHBondContact CA-OG 3.31Å; K171-S174 PolarHBondContact O-OG 2.94Å; K171-L175 WeakPolarHBondContact O-CD1 3.28Å; K171-L175 VanDerWaalsContact O-CG 3.27Å; K171-L175 WeakPolarHBondContact O-CG 3.31Å
172	L	92.2	Very high	91.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-72.9	-43.9	170.9	171.8	51.9	0	0	0	110.3	V143 M146 M147 I150 A168 I169 P170 S174 L175 D176 Q179 L183	V143-L172 HydrophobicContact CB-CD1 4.31Å; V143-L172 HydrophobicContact CG1-CD1 3.89Å; V143-L172 HydrophobicContact CG2-CD1 4.04Å; M146-L172 HydrophobicContact CE-CB 4.2Å; M146-L172 HydrophobicContact CE-CD1 3.74Å; M146-L172 HydrophobicContact CE-CG 4.48Å; M146-L172 HydrophobicContact CG-CB 4.35Å; M146-L172 HydrophobicContact CG-CD1 4.43Å; M146-L172 HydrophobicContact CG-CD2 4.16Å; M146-L172 HydrophobicContact SD-CB 4.32Å; M147-L172 HydrophobicContact CB-CD2 4.03Å; M147-L172 HydrophobicContact CE-CD2 4.05Å; I150-L172 HydrophobicContact CD1-CB 4.09Å; I150-L172 HydrophobicContact CD1-CD2 3.77Å; A168-L172 PolarHBondContact O-N 2.89Å; A168-L172 VanDerWaalsContact O-N 3.11Å; I169-L172 PolarHBondContact O-N 3.22Å; P170-L172 VanDerWaalsContact C-N 3.35Å; L172-S174 VanDerWaalsContact C-N 3.34Å; L172-S174 PolarHBondContact O-N 3.31Å; L172-L175 PolarHBondContact O-N 2.89Å; L172-D176 PolarHBondContact O-N 3.37Å; L172-Q179 HydrophobicContact CD1-CG 4.43Å; L172-L183 HydrophobicContact CD2-CD2 3.83Å; L172-L183 HydrophobicContact CG-CD1 4.46Å; L172-L183 HydrophobicContact CG-CD2 4.24Å
173	Y	92.2	Very high	91.6	Very high	66 Å²	66	44.3 Å²	44.3	26%	0.259	23%	0.231	S	C	.	.	H	α-helix	trans	-59.9	-38.4	176.2	-177.7	-121.9	0	0	0	113.9	I169 P170 L175 D176 K180 L183 V209	I169-Y173 PolarHBondContact O-N 3.49Å; P170-Y173 PolarHBondContact O-N 2.63Å; Y173-L175 PolarHBondContact O-N 3.41Å; Y173-D176 CarbonylContact O-C 3.54Å; Y173-K180 HydrophobicContact CE2-CB 4.18Å; Y173-K180 HydrophobicContact CE2-CD 4.27Å; Y173-K180 HydrophobicContact CE2-CG 4.22Å; Y173-L183 HydrophobicContact CD2-CD1 4.47Å; Y173-V209 HydrophobicContact CD1-CB 4.23Å; Y173-V209 HydrophobicContact CD1-CG1 4.24Å; Y173-V209 HydrophobicContact CD1-CG2 3.78Å; Y173-V209 HydrophobicContact CD2-CG1 4.02Å; Y173-V209 HydrophobicContact CE2-CG1 4.33Å; Y173-V209 HydrophobicContact CG-CB 4.38Å; Y173-V209 HydrophobicContact CG-CG1 3.97Å; Y173-V209 HydrophobicContact CG-CG2 3.88Å
174	S	91.1	Very high	91.5	Very high	88 Å²	88	43.3 Å²	43.3	62%	0.615	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	2.1	174.7	51.8	0	0	0	0	114.5	P170 K171 L172	P170-S174 WeakPolarHBondContact O-CB 3.45Å; P170-S174 PolarHBondContact O-N 2.86Å; P170-S174 PolarHBondContact O-OG 3.35Å; K171-S174 WeakPolarHBondContact CA-OG 3.31Å; K171-S174 PolarHBondContact O-OG 2.94Å; L172-S174 VanDerWaalsContact C-N 3.34Å; L172-S174 PolarHBondContact O-N 3.31Å
175	L	88.9	Confident	91.3	Very high	42 Å²	42	48 Å²	48	22%	0.22	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-30.6	171.4	-73.3	171.8	0	0	0	113.2	R138 V143 M146 K171 L172 Y173	R138-L175 HydrophobicContact CB-CD2 3.67Å; R138-L175 HydrophobicContact CG-CD2 3.87Å; V143-L175 HydrophobicContact CG2-CB 4.47Å; M146-L175 HydrophobicContact CE-CD1 3.72Å; K171-L175 WeakPolarHBondContact O-CD1 3.28Å; K171-L175 VanDerWaalsContact O-CG 3.27Å; K171-L175 WeakPolarHBondContact O-CG 3.31Å; L172-L175 PolarHBondContact O-N 2.89Å; Y173-L175 PolarHBondContact O-N 3.41Å
176	D	89.4	Confident	91.2	Very high	37 Å²	37	48.3 Å²	48.3	20%	0.198	25%	0.25	C	S	.	.			trans	-149.4	112.4	172.1	-179.7	7.8	0	0	0	109.9	V143 L172 Y173 D178 Q179	V143-D176 HydrophobicContact CG1-CB 3.87Å; V143-D176 WeakPolarHBondContact CG1-OD2 3.32Å; V143-D176 HydrophobicContact CG2-CB 3.98Å; L172-D176 PolarHBondContact O-N 3.37Å; Y173-D176 CarbonylContact O-C 3.54Å; D176-D178 VanDerWaalsContact C-N 3.31Å; D176-D178 VanDerWaalsContact OD1-CB 3.31Å; D176-D178 WeakPolarHBondContact OD1-CB 3.26Å; D176-D178 PolarHBondContact OD1-N 3.17Å; D176-Q179 HydrophobicContact CB-CG 4.19Å; D176-Q179 VanDerWaalsContact OD2-CG 3.32Å; D176-Q179 WeakPolarHBondContact OD2-CG 3.36Å; D176-Q179 PolarHBondContact OD2-NE2 3.13Å
177	S	88	Confident	91.1	Very high	71 Å²	71	48.3 Å²	48.3	50%	0.497	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-68.8	-27.6	176.7	46.2	0	0	0	0	113.1	Q179 K180	S177-Q179 PolarHBondContact O-N 2.95Å; S177-Q179 VanDerWaalsContact O-N 3.15Å; S177-K180 WeakPolarHBondContact O-CB 3.43Å; S177-K180 PolarHBondContact O-N 3.16Å; S177-K180 VanDerWaalsContact O-N 3.08Å
178	D	89.5	Confident	91	Very high	132 Å²	132	47.8 Å²	47.8	71%	0.706	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-72.1	-14.4	-170	-61.1	2.5	0	0	0	111.3	D176 K180	D176-D178 VanDerWaalsContact C-N 3.31Å; D176-D178 VanDerWaalsContact OD1-CB 3.31Å; D176-D178 WeakPolarHBondContact OD1-CB 3.26Å; D176-D178 PolarHBondContact OD1-N 3.17Å; D178-K180 VanDerWaalsContact C-N 3.27Å; D178-K180 PolarHBondContact O-N 3.37Å
179	Q	86.3	Confident	90.9	Very high	35 Å²	35	53.1 Å²	53.1	16%	0.164	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-78.4	-1.2	173.5	-55	-47.9	-48.5	0	0	114.3	V143 M147 L172 D176 S177 D181 Q182 L183	V143-Q179 HydrophobicContact CG1-CG 4.02Å; M147-Q179 HydrophobicContact CE-CB 3.67Å; M147-Q179 HydrophobicContact CE-CG 4.19Å; L172-Q179 HydrophobicContact CD1-CG 4.43Å; D176-Q179 HydrophobicContact CB-CG 4.19Å; D176-Q179 VanDerWaalsContact OD2-CG 3.32Å; D176-Q179 WeakPolarHBondContact OD2-CG 3.36Å; D176-Q179 PolarHBondContact OD2-NE2 3.13Å; S177-Q179 PolarHBondContact O-N 2.95Å; S177-Q179 VanDerWaalsContact O-N 3.15Å; Q179-D181 VanDerWaalsContact C-N 3.32Å; Q179-D181 PolarHBondContact O-N 3.17Å; Q179-D181 VanDerWaalsContact O-N 3.17Å; Q179-Q182 PolarHBondContact O-N 2.9Å; Q179-L183 HydrophobicContact CB-CD1 4.46Å; Q179-L183 HydrophobicContact CB-CG 4.38Å; Q179-L183 WeakPolarHBondContact O-CG 3.47Å; Q179-L183 PolarHBondContact O-N 2.94Å
180	K	88.4	Confident	90.7	Very high	54 Å²	54	53.3 Å²	53.3	24%	0.235	27%	0.272	C	S	.	.	H	α-helix	trans	-46.5	-48.5	-172.9	-173.3	176.5	178.6	-178.5	0	113.4	Y173 S177 D178 Q182 L183 I184 V209 E212	Y173-K180 HydrophobicContact CE2-CB 4.18Å; Y173-K180 HydrophobicContact CE2-CD 4.27Å; Y173-K180 HydrophobicContact CE2-CG 4.22Å; S177-K180 WeakPolarHBondContact O-CB 3.43Å; S177-K180 PolarHBondContact O-N 3.16Å; S177-K180 VanDerWaalsContact O-N 3.08Å; D178-K180 VanDerWaalsContact C-N 3.27Å; D178-K180 PolarHBondContact O-N 3.37Å; K180-Q182 PolarHBondContact O-N 3.38Å; K180-L183 WeakPolarHBondContact O-CB 3.18Å; K180-L183 PolarHBondContact O-N 3.25Å; K180-I184 HydrophobicContact CG-CD1 4.04Å; K180-I184 WeakPolarHBondContact O-CG1 3.49Å; K180-I184 PolarHBondContact O-N 2.97Å; K180-V209 WeakPolarHBondContact CE-O 3.47Å; K180-V209 HydrophobicContact CG-CG1 4.41Å; K180-E212 IonicContact NZ-OE2 2.99Å; K180-E212 PolarHBondContact NZ-OE2 2.74Å
181	D	89.8	Confident	90.6	Very high	121 Å²	121	53.5 Å²	53.5	65%	0.647	27%	0.273	S	S	*	.	H	α-helix	trans	-64.8	-42.5	-178.8	-67.4	-35.2	0	0	0	112.8	Q179 L183 I184 E185	Q179-D181 VanDerWaalsContact C-N 3.32Å; Q179-D181 PolarHBondContact O-N 3.17Å; Q179-D181 VanDerWaalsContact O-N 3.17Å; D181-L183 VanDerWaalsContact C-N 3.28Å; D181-L183 PolarHBondContact O-N 3.02Å; D181-I184 WeakPolarHBondContact O-CB 3.36Å; D181-I184 PolarHBondContact O-N 3.38Å; D181-E185 PolarHBondContact O-N 3.44Å
182	Q	89.2	Confident	90.4	Very high	75 Å²	75	53 Å²	53	35%	0.35	28%	0.282	S	S	.	.	H	α-helix	trans	-69.2	-25.5	176.6	-72.4	-163.4	75.2	0	0	113.2	M147 K151 Q179 K180	M147-Q182 HydrophobicContact CE-CB 3.37Å; M147-Q182 HydrophobicContact CE-CG 4.46Å; M147-Q182 HydrophobicContact SD-CB 4Å; K151-Q182 WeakPolarHBondContact CE-O 3.45Å; Q179-Q182 PolarHBondContact O-N 2.9Å; K180-Q182 PolarHBondContact O-N 3.38Å
183	L	91.4	Very high	90.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-74.3	-38.3	170.8	-66	177.4	0	0	0	111.2	M147 I169 L172 Y173 Q179 K180 D181 E185 V186 I187 V209	M147-L183 HydrophobicContact CE-CD2 3.75Å; M147-L183 HydrophobicContact CE-CG 4.01Å; I169-L183 HydrophobicContact CG1-CD2 4.32Å; I169-L183 HydrophobicContact CG2-CB 4.27Å; I169-L183 HydrophobicContact CG2-CD1 4.36Å; I169-L183 HydrophobicContact CG2-CD2 4.18Å; L172-L183 HydrophobicContact CD2-CD2 3.83Å; L172-L183 HydrophobicContact CG-CD1 4.46Å; L172-L183 HydrophobicContact CG-CD2 4.24Å; Y173-L183 HydrophobicContact CD2-CD1 4.47Å; Q179-L183 HydrophobicContact CB-CD1 4.46Å; Q179-L183 HydrophobicContact CB-CG 4.38Å; Q179-L183 WeakPolarHBondContact O-CG 3.47Å; Q179-L183 PolarHBondContact O-N 2.94Å; K180-L183 WeakPolarHBondContact O-CB 3.18Å; K180-L183 PolarHBondContact O-N 3.25Å; D181-L183 VanDerWaalsContact C-N 3.28Å; D181-L183 PolarHBondContact O-N 3.02Å; L183-E185 VanDerWaalsContact C-N 3.33Å; L183-E185 PolarHBondContact O-N 2.89Å; L183-V186 WeakPolarHBondContact O-CB 3.45Å; L183-V186 PolarHBondContact O-N 3.48Å; L183-I187 WeakPolarHBondContact O-CG1 3.38Å; L183-I187 PolarHBondContact O-N 3.49Å; L183-V209 HydrophobicContact CB-CG1 4.47Å; L183-V209 HydrophobicContact CD1-CG1 4.4Å
184	I	91.2	Very high	89.8	Confident	15 Å²	15	58.2 Å²	58.2	8%	0.077	31%	0.308	C	S	.	.	H	α-helix	trans	-59.1	-41.6	175.8	-74.2	164.8	0	0	0	111.4	K180 D181 V186 I187 E188 C210 R213 L216	K180-I184 HydrophobicContact CG-CD1 4.04Å; K180-I184 WeakPolarHBondContact O-CG1 3.49Å; K180-I184 PolarHBondContact O-N 2.97Å; D181-I184 WeakPolarHBondContact O-CB 3.36Å; D181-I184 PolarHBondContact O-N 3.38Å; I184-V186 VanDerWaalsContact C-N 3.25Å; I184-V186 PolarHBondContact O-N 3.22Å; I184-I187 PolarHBondContact O-N 2.89Å; I184-E188 PolarHBondContact O-N 2.93Å; I184-C210 HydrophobicContact CD1-CB 4.07Å; I184-C210 HydrophobicContact CG1-CB 3.98Å; I184-R213 HydrophobicContact CD1-CG 4.42Å; I184-L216 HydrophobicContact CG2-CD1 4.17Å
185	E	91.1	Very high	89.7	Confident	116 Å²	116	56.1 Å²	56.1	54%	0.542	29%	0.291	S	S	.	.	H	α-helix	trans	-54.3	-41.3	172.2	-63.7	178.3	139.6	0	0	112.5	K151 D181 L183 K189	K151-E185 WeakPolarHBondContact CE-OE2 3.44Å; K151-E185 IonicContact NZ-OE2 3.32Å; K151-E185 PolarHBondContact NZ-OE2 3.27Å; D181-E185 PolarHBondContact O-N 3.44Å; L183-E185 VanDerWaalsContact C-N 3.33Å; L183-E185 PolarHBondContact O-N 2.89Å; E185-K189 WeakPolarHBondContact O-CB 3.49Å; E185-K189 PolarHBondContact O-N 3.31Å
186	V	92.4	Very high	89.7	Confident	5 Å²	5	56 Å²	56	3%	0.03	29%	0.292	C	S	.	.	H	α-helix	trans	-75.2	-39.1	-179.4	-178.3	0	0	0	0	111	I150 K151 A154 I169 L183 I184 K189 L190	I150-V186 HydrophobicContact CG2-CG1 4.14Å; K151-V186 HydrophobicContact CD-CG2 4.4Å; K151-V186 HydrophobicContact CG-CG2 3.56Å; A154-V186 HydrophobicContact CB-CG1 3.59Å; I169-V186 HydrophobicContact CD1-CB 4.33Å; I169-V186 HydrophobicContact CD1-CG1 3.81Å; L183-V186 WeakPolarHBondContact O-CB 3.45Å; L183-V186 PolarHBondContact O-N 3.48Å; I184-V186 VanDerWaalsContact C-N 3.25Å; I184-V186 PolarHBondContact O-N 3.22Å; V186-K189 PolarHBondContact O-N 3.3Å; V186-L190 HydrophobicContact CG1-CD1 3.87Å; V186-L190 HydrophobicContact CG1-CG 4.32Å; V186-L190 WeakPolarHBondContact O-CB 3.45Å; V186-L190 VanDerWaalsContact O-CG 3.32Å; V186-L190 WeakPolarHBondContact O-CG 3.43Å; V186-L190 PolarHBondContact O-N 2.64Å
187	I	93.1	Very high	89.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-62.2	-46	175.3	-66.8	168.1	0	0	0	110.3	I169 L183 I184 K189 L190 L191 V202 F206 V209	I169-I187 HydrophobicContact CD1-CG1 4.04Å; I169-I187 HydrophobicContact CG2-CD1 4.02Å; I169-I187 HydrophobicContact CG2-CG1 4.18Å; L183-I187 WeakPolarHBondContact O-CG1 3.38Å; L183-I187 PolarHBondContact O-N 3.49Å; I184-I187 PolarHBondContact O-N 2.89Å; I187-K189 PolarHBondContact O-N 2.67Å; I187-L190 PolarHBondContact O-N 2.68Å; I187-L191 HydrophobicContact CG2-CD1 3.86Å; I187-L191 HydrophobicContact CG2-CG 4.15Å; I187-L191 WeakPolarHBondContact O-CB 3.33Å; I187-L191 WeakPolarHBondContact O-CG 3.24Å; I187-L191 PolarHBondContact O-N 3.43Å; I187-V202 HydrophobicContact CG2-CG1 4.39Å; I187-F206 HydrophobicContact CG2-CB 4.13Å; I187-F206 HydrophobicContact CG2-CD2 4.28Å; I187-V209 HydrophobicContact CD1-CB 4.22Å; I187-V209 HydrophobicContact CD1-CG1 4.37Å
188	E	92.3	Very high	89.9	Confident	72 Å²	72	55.5 Å²	55.5	34%	0.336	28%	0.283	S	S	.	.	H	α-helix	trans	-60.3	-46.1	177.6	-178.3	164.4	-147.7	0	0	111.8	I184 L190 L191 A192 L216 K219	I184-E188 PolarHBondContact O-N 2.93Å; E188-L190 VanDerWaalsContact C-N 3.31Å; E188-L190 PolarHBondContact O-N 3.42Å; E188-L191 PolarHBondContact O-N 3.18Å; E188-A192 PolarHBondContact O-N 3.28Å; E188-A192 VanDerWaalsContact O-N 3.15Å; E188-L216 HydrophobicContact CB-CD2 3.97Å; E188-L216 HydrophobicContact CG-CD2 4.01Å; E188-K219 IonicContact OE1-NZ 3.61Å; E188-K219 PolarHBondContact OE1-NZ 2.88Å
189	K	91.4	Very high	89.9	Confident	112 Å²	112	49.9 Å²	49.9	49%	0.487	26%	0.255	S	S	.	.	H	α-helix	trans	-60.7	-37.9	176.4	179.5	176.4	170.9	-178.1	0	112.7	S155 E185 V186 I187	S155-K189 PolarHBondContact OG-NZ 2.66Å; E185-K189 WeakPolarHBondContact O-CB 3.49Å; E185-K189 PolarHBondContact O-N 3.31Å; V186-K189 PolarHBondContact O-N 3.3Å; I187-K189 PolarHBondContact O-N 2.67Å
190	L	91.6	Very high	90.2	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.021	25%	0.25	C	C	.	.	H	α-helix	trans	-79.5	-32.4	178.3	-71.7	175.3	0	0	0	112.9	A154 R162 A166 I169 V186 I187 E188 A192 D193 V198 V202	A154-L190 HydrophobicContact CB-CD1 4.1Å; A154-L190 HydrophobicContact CB-CD2 3.95Å; A154-L190 HydrophobicContact CB-CG 4.07Å; R162-L190 HydrophobicContact CB-CD2 4.14Å; A166-L190 HydrophobicContact CB-CD1 4.35Å; I169-L190 HydrophobicContact CD1-CD1 4.05Å; V186-L190 HydrophobicContact CG1-CD1 3.87Å; V186-L190 HydrophobicContact CG1-CG 4.32Å; V186-L190 WeakPolarHBondContact O-CB 3.45Å; V186-L190 VanDerWaalsContact O-CG 3.32Å; V186-L190 WeakPolarHBondContact O-CG 3.43Å; V186-L190 PolarHBondContact O-N 2.64Å; I187-L190 PolarHBondContact O-N 2.68Å; E188-L190 VanDerWaalsContact C-N 3.31Å; E188-L190 PolarHBondContact O-N 3.42Å; L190-A192 PolarHBondContact O-N 3.08Å; L190-D193 WeakPolarHBondContact O-CB 3.18Å; L190-D193 PolarHBondContact O-N 2.94Å; L190-D193 VanDerWaalsContact O-N 3.11Å; L190-V198 HydrophobicContact CD2-CG1 4.47Å; L190-V202 HydrophobicContact CB-CB 4.49Å; L190-V202 HydrophobicContact CB-CG1 3.94Å; L190-V202 HydrophobicContact CB-CG2 3.62Å; L190-V202 HydrophobicContact CD1-CG2 4.3Å; L190-V202 HydrophobicContact CG-CG2 4.5Å
191	L	90.1	Very high	90.4	Very high	9 Å²	9	46 Å²	46	5%	0.047	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-30.1	171.8	-78.7	172.6	0	0	0	111.3	I187 E188 D193 V202 V203 L216 I217 N220 K223	I187-L191 HydrophobicContact CG2-CD1 3.86Å; I187-L191 HydrophobicContact CG2-CG 4.15Å; I187-L191 WeakPolarHBondContact O-CB 3.33Å; I187-L191 WeakPolarHBondContact O-CG 3.24Å; I187-L191 PolarHBondContact O-N 3.43Å; E188-L191 PolarHBondContact O-N 3.18Å; L191-D193 VanDerWaalsContact C-N 3.3Å; L191-D193 PolarHBondContact O-N 2.84Å; L191-V202 HydrophobicContact CB-CG1 4.46Å; L191-V202 HydrophobicContact CD2-CG1 3.66Å; L191-V202 HydrophobicContact CG-CG1 3.66Å; L191-V203 HydrophobicContact CD2-CG2 4.1Å; L191-L216 HydrophobicContact CD1-CB 3.86Å; L191-I217 HydrophobicContact CD1-CD1 4.05Å; L191-I217 HydrophobicContact CD2-CD1 4.45Å; L191-N220 PolarHBondContact O-OD1 3.45Å; L191-N220 VanDerWaalsContact O-OD1 3.13Å; L191-K223 PolarHBondContact O-NZ 3.46Å
192	A	88.8	Confident	90.6	Very high	60 Å²	60	40.3 Å²	40.3	50%	0.496	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-19.6	174.6	0	0	0	0	0	114.2	E188 L190 K194 K223	E188-A192 PolarHBondContact O-N 3.28Å; E188-A192 VanDerWaalsContact O-N 3.15Å; L190-A192 PolarHBondContact O-N 3.08Å; A192-K194 PolarHBondContact O-N 3.16Å; A192-K223 PolarHBondContact O-NZ 3.41Å
193	D	87.8	Confident	90.8	Very high	31 Å²	31	36.8 Å²	36.8	17%	0.166	19%	0.193	C	C	.	.			trans	-58.6	133.7	-178.9	-169.1	-24.5	0	0	0	112.3	R162 L190 L191 T195 K223	R162-D193 IonicContact CZ-OD2 3.86Å; R162-D193 IonicContact NE-OD2 3.56Å; R162-D193 PolarHBondContact NE-OD2 3.44Å; R162-D193 IonicContact NH2-OD1 3.73Å; R162-D193 PolarHBondContact NH2-OD1 3.41Å; R162-D193 IonicContact NH2-OD2 2.83Å; R162-D193 PolarHBondContact NH2-OD2 2.86Å; L190-D193 WeakPolarHBondContact O-CB 3.18Å; L190-D193 PolarHBondContact O-N 2.94Å; L190-D193 VanDerWaalsContact O-N 3.11Å; L191-D193 VanDerWaalsContact C-N 3.3Å; L191-D193 PolarHBondContact O-N 2.84Å; D193-T195 VanDerWaalsContact C-N 3.32Å; D193-T195 WeakPolarHBondContact OD1-CB 3.44Å; D193-T195 PolarHBondContact OD1-N 3.35Å; D193-T195 PolarHBondContact OD1-OG1 3.38Å; D193-T195 PolarHBondContact OD2-OG1 2.9Å; D193-K223 WeakPolarHBondContact O-CE 3.34Å; D193-K223 PolarHBondContact O-NZ 3.28Å
194	K	83.3	Confident	90.8	Very high	144 Å²	144	39 Å²	39	63%	0.626	20%	0.203	S	C	*	.			trans	-80.8	-6.6	-179.8	-62.1	-174.4	-179.4	-177.3	0	113.5	A192	A192-K194 PolarHBondContact O-N 3.16Å
195	T	89.6	Confident	90.9	Very high	44 Å²	44	38.3 Å²	38.3	27%	0.27	20%	0.2	S	C	.	.			trans	-89.6	125.8	-173.4	58.8	0	0	0	0	113.8	P159 R162 D193 L197 V198 A199	P159-T195 HydrophobicContact CG-CG2 4.21Å; R162-T195 PolarHBondContact NH2-OG1 3.38Å; D193-T195 VanDerWaalsContact C-N 3.32Å; D193-T195 WeakPolarHBondContact OD1-CB 3.44Å; D193-T195 PolarHBondContact OD1-N 3.35Å; D193-T195 PolarHBondContact OD1-OG1 3.38Å; D193-T195 PolarHBondContact OD2-OG1 2.9Å; T195-L197 VanDerWaalsContact C-N 3.34Å; T195-L197 PolarHBondContact O-N 3.47Å; T195-V198 PolarHBondContact O-N 3.36Å; T195-V198 WeakPolarHBondContact OG1-CG2 3.15Å; T195-A199 PolarHBondContact O-N 3.14Å
196	T	88.4	Confident	91	Very high	40 Å²	40	33 Å²	33	25%	0.245	18%	0.176	C	C	.	.	H	α-helix	trans	-64	-34.8	-174.6	55.3	0	0	0	0	113.5	V198 A199 L227 D230 V231	T196-V198 PolarHBondContact O-N 3.33Å; T196-V198 VanDerWaalsContact O-N 3.14Å; T196-A199 PolarHBondContact O-N 3.35Å; T196-L227 HydrophobicContact CG2-CB 4.45Å; T196-L227 HydrophobicContact CG2-CD2 4.03Å; T196-D230 VanDerWaalsContact CB-O 3.28Å; T196-D230 WeakPolarHBondContact CB-O 3.29Å; T196-D230 HydrophobicContact CG2-CB 3.77Å; T196-D230 PolarHBondContact OG1-O 3.03Å; T196-V231 HydrophobicContact CG2-CG2 4.35Å
197	L	89.4	Confident	90.9	Very high	96 Å²	96	35.3 Å²	35.3	50%	0.503	19%	0.186	S	C	.	.	H	α-helix	trans	-56.7	-25.1	175.3	-73.3	169.7	0	0	0	114.1	P159 K163 T195	P159-L197 HydrophobicContact CB-CD1 4.44Å; K163-L197 WeakPolarHBondContact CD-O 3.24Å; K163-L197 WeakPolarHBondContact CE-O 3.44Å; K163-L197 WeakPolarHBondContact CG-O 3.33Å; T195-L197 VanDerWaalsContact C-N 3.34Å; T195-L197 PolarHBondContact O-N 3.47Å
198	V	91.9	Very high	90.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-96.2	-35.5	-177	179.6	0	0	0	0	111	P159 R162 K163 L190 T195 T196 G200 S201 V202	P159-V198 HydrophobicContact CB-CG2 4.03Å; P159-V198 WeakPolarHBondContact O-CG2 3.38Å; R162-V198 HydrophobicContact CB-CG1 4.4Å; R162-V198 HydrophobicContact CB-CG2 4.09Å; K163-V198 HydrophobicContact CB-CG2 4.41Å; L190-V198 HydrophobicContact CD2-CG1 4.47Å; T195-V198 PolarHBondContact O-N 3.36Å; T195-V198 WeakPolarHBondContact OG1-CG2 3.15Å; T196-V198 PolarHBondContact O-N 3.33Å; T196-V198 VanDerWaalsContact O-N 3.14Å; V198-G200 PolarHBondContact O-N 2.79Å; V198-S201 PolarHBondContact O-N 2.94Å; V198-V202 HydrophobicContact CG1-CG2 3.58Å; V198-V202 WeakPolarHBondContact O-CG2 3.46Å; V198-V202 PolarHBondContact O-N 3.39Å; V198-V202 VanDerWaalsContact O-N 3.13Å
199	A	90.5	Very high	90.5	Very high	14 Å²	14	37 Å²	37	12%	0.116	19%	0.194	C	C	.	.	H	α-helix	trans	-52.6	-48.2	-171.5	0	0	0	0	0	114.5	T195 T196 S201 V202 V203 V231	T195-A199 PolarHBondContact O-N 3.14Å; T196-A199 PolarHBondContact O-N 3.35Å; A199-S201 PolarHBondContact O-N 3.14Å; A199-V202 PolarHBondContact O-N 3.18Å; A199-V203 WeakPolarHBondContact O-CG2 3.36Å; A199-V203 PolarHBondContact O-N 2.74Å; A199-V231 HydrophobicContact CB-CG2 4.34Å
200	G	91.8	Very high	90.2	Very high	5 Å²	5	31.7 Å²	31.7	5%	0.052	17%	0.171	C	C	.	.	H	α-helix	trans	-61	-45.6	-179.5	0	0	0	0	0	113.4	V198 V202 V203 M204	V198-G200 PolarHBondContact O-N 2.79Å; G200-V202 VanDerWaalsContact C-N 3.31Å; G200-V202 PolarHBondContact O-N 2.98Å; G200-V203 PolarHBondContact O-N 2.94Å; G200-M204 PolarHBondContact O-N 3.25Å; G200-M204 VanDerWaalsContact O-N 3.08Å
201	S	93.3	Very high	89.8	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-67.7	-29.7	178.7	-57.4	0	0	0	0	113.2	K163 H167 V198 A199 A205	K163-S201 WeakPolarHBondContact CE-OG 3.47Å; K163-S201 WeakPolarHBondContact CG-OG 3.41Å; H167-S201 PolarHBondContact CD2-OG 2.72Å; H167-S201 PolarHBondContact CE1-OG 3.28Å; H167-S201 PolarHBondContact NE2-OG 3.06Å; V198-S201 PolarHBondContact O-N 2.94Å; A199-S201 PolarHBondContact O-N 3.14Å; S201-A205 PolarHBondContact O-N 3.33Å; S201-A205 VanDerWaalsContact O-N 3.14Å
202	V	94.1	Very high	89.4	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.012	21%	0.212	C	C	.	.	H	α-helix	trans	-76.3	-40	177	179.2	0	0	0	0	111.4	A166 I187 L190 L191 V198 A199 G200 M204 A205 F206	A166-V202 HydrophobicContact CB-CG2 3.71Å; I187-V202 HydrophobicContact CG2-CG1 4.39Å; L190-V202 HydrophobicContact CB-CB 4.49Å; L190-V202 HydrophobicContact CB-CG1 3.94Å; L190-V202 HydrophobicContact CB-CG2 3.62Å; L190-V202 HydrophobicContact CD1-CG2 4.3Å; L190-V202 HydrophobicContact CG-CG2 4.5Å; L191-V202 HydrophobicContact CB-CG1 4.46Å; L191-V202 HydrophobicContact CD2-CG1 3.66Å; L191-V202 HydrophobicContact CG-CG1 3.66Å; V198-V202 HydrophobicContact CG1-CG2 3.58Å; V198-V202 WeakPolarHBondContact O-CG2 3.46Å; V198-V202 PolarHBondContact O-N 3.39Å; V198-V202 VanDerWaalsContact O-N 3.13Å; A199-V202 PolarHBondContact O-N 3.18Å; G200-V202 VanDerWaalsContact C-N 3.31Å; G200-V202 PolarHBondContact O-N 2.98Å; V202-M204 VanDerWaalsContact C-N 3.3Å; V202-M204 PolarHBondContact O-N 2.9Å; V202-A205 PolarHBondContact O-N 2.96Å; V202-F206 WeakPolarHBondContact O-CB 3.46Å; V202-F206 PolarHBondContact O-N 2.83Å
203	V	92.8	Very high	89.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-67.6	-33.9	176	176.7	0	0	0	0	111.2	L191 A199 G200 F206 E207 L224 V238 I239 M242	L191-V203 HydrophobicContact CD2-CG2 4.1Å; A199-V203 WeakPolarHBondContact O-CG2 3.36Å; A199-V203 PolarHBondContact O-N 2.74Å; G200-V203 PolarHBondContact O-N 2.94Å; V203-F206 WeakPolarHBondContact O-CB 3.23Å; V203-F206 PolarHBondContact O-N 3.18Å; V203-E207 WeakPolarHBondContact O-CB 3.46Å; V203-E207 PolarHBondContact O-N 2.88Å; V203-L224 HydrophobicContact CG2-CD1 4.26Å; V203-L224 HydrophobicContact CG2-CD2 4.11Å; V203-V238 HydrophobicContact CG1-CG1 4.2Å; V203-I239 HydrophobicContact CB-CG1 4Å; V203-I239 HydrophobicContact CG1-CG1 4.16Å; V203-I239 HydrophobicContact CG2-CG1 4.04Å; V203-M242 HydrophobicContact CG1-CB 3.77Å; V203-M242 HydrophobicContact CG1-CE 3.57Å; V203-M242 HydrophobicContact CG1-CG 3.98Å; V203-M242 HydrophobicContact CG2-CE 4.2Å
204	M	92.6	Very high	88.8	Confident	46 Å²	46	42 Å²	42	23%	0.227	21%	0.208	C	C	.	.	H	α-helix	trans	-58.9	-49.4	168	-176.1	-79.7	-55.7	0	0	111.6	H167 P170 G200 V202 F206 E207 E208 V238	H167-M204 WeakPolarHBondContact ND1-CE 3.35Å; P170-M204 HydrophobicContact CG-CE 4.3Å; P170-M204 HydrophobicContact CG-SD 4.23Å; G200-M204 PolarHBondContact O-N 3.25Å; G200-M204 VanDerWaalsContact O-N 3.08Å; V202-M204 VanDerWaalsContact C-N 3.3Å; V202-M204 PolarHBondContact O-N 2.9Å; M204-F206 VanDerWaalsContact C-N 3.28Å; M204-F206 PolarHBondContact O-N 2.92Å; M204-E207 PolarHBondContact O-N 2.99Å; M204-E208 PolarHBondContact O-N 3.38Å; M204-E208 VanDerWaalsContact O-N 3.09Å; M204-V238 HydrophobicContact CB-CG1 3.99Å
205	A	93.2	Very high	88.7	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-65.5	-29.4	178.3	0	0	0	0	0	113.5	I169 P170 S201 V202 V209	I169-A205 HydrophobicContact CB-CB 4.25Å; I169-A205 HydrophobicContact CG2-CB 4.17Å; P170-A205 HydrophobicContact CG-CB 3.95Å; S201-A205 PolarHBondContact O-N 3.33Å; S201-A205 VanDerWaalsContact O-N 3.14Å; V202-A205 PolarHBondContact O-N 2.96Å; A205-V209 WeakPolarHBondContact O-CB 3.5Å; A205-V209 WeakPolarHBondContact O-CG2 3.03Å; A205-V209 PolarHBondContact O-N 3.41Å
206	F	92.9	Very high	88.5	Confident	6 Å²	6	36.7 Å²	36.7	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-67.8	-47.1	171.3	170.3	-92.6	0	0	0	111.8	I187 V202 V203 M204 E208 V209 C210 R213 L216 I217 M242	I187-F206 HydrophobicContact CG2-CB 4.13Å; I187-F206 HydrophobicContact CG2-CD2 4.28Å; V202-F206 WeakPolarHBondContact O-CB 3.46Å; V202-F206 PolarHBondContact O-N 2.83Å; V203-F206 WeakPolarHBondContact O-CB 3.23Å; V203-F206 PolarHBondContact O-N 3.18Å; M204-F206 VanDerWaalsContact C-N 3.28Å; M204-F206 PolarHBondContact O-N 2.92Å; F206-E208 VanDerWaalsContact C-N 3.3Å; F206-E208 PolarHBondContact O-N 2.9Å; F206-V209 PolarHBondContact O-N 2.77Å; F206-C210 VanDerWaalsContact CD2-SG 3.53Å; F206-C210 WeakPolarHBondContact CE2-O 3.49Å; F206-C210 CarbonylContact O-C 3.27Å; F206-C210 PolarHBondContact O-N 2.84Å; F206-R213 HydrophobicContact CE2-CB 4.49Å; F206-R213 WeakPolarHBondContact CE2-O 3.46Å; F206-L216 HydrophobicContact CD2-CD1 4.38Å; F206-L216 HydrophobicContact CE2-CB 4.36Å; F206-L216 HydrophobicContact CE2-CD1 4.27Å; F206-I217 HydrophobicContact CD1-CD1 3.98Å; F206-I217 HydrophobicContact CD1-CG1 4.35Å; F206-I217 HydrophobicContact CD2-CD1 4.14Å; F206-I217 HydrophobicContact CE1-CD1 3.83Å; F206-I217 HydrophobicContact CE1-CG1 3.68Å; F206-I217 HydrophobicContact CE2-CD1 3.99Å; F206-I217 HydrophobicContact CE2-CG1 4.01Å; F206-I217 HydrophobicContact CG-CD1 4.15Å; F206-I217 HydrophobicContact CZ-CD1 3.85Å; F206-I217 HydrophobicContact CZ-CG1 3.49Å; F206-I217 VanDerWaalsContact CZ-CG1 3.49Å; F206-M242 HydrophobicContact CD1-CG 4.13Å; F206-M242 HydrophobicContact CE1-CG 4.06Å; F206-M242 HydrophobicContact CE1-SD 4.32Å
207	E	89.6	Confident	88.4	Confident	52 Å²	52	34.8 Å²	34.8	24%	0.243	17%	0.173	C	C	.	.	H	α-helix	trans	-63.7	-33.5	-179.4	-168	168.4	-151.7	0	0	112.1	V203 M204 S241	V203-E207 WeakPolarHBondContact O-CB 3.46Å; V203-E207 PolarHBondContact O-N 2.88Å; M204-E207 PolarHBondContact O-N 2.99Å; E207-S241 PolarHBondContact OE1-OG 3.02Å
208	E	88.4	Confident	88.2	Confident	107 Å²	107	31.1 Å²	31.1	50%	0.5	15%	0.153	S	C	.	.	H	α-helix	trans	-83	-32.2	178.9	-161.4	175.3	164.9	0	0	114.1	P170 M204 F206	P170-E208 HydrophobicContact CB-CB 4.21Å; P170-E208 HydrophobicContact CB-CG 3.99Å; P170-E208 WeakPolarHBondContact CB-OE2 3.38Å; P170-E208 HydrophobicContact CG-CB 4.3Å; P170-E208 WeakPolarHBondContact CG-OE2 3.47Å; M204-E208 PolarHBondContact O-N 3.38Å; M204-E208 VanDerWaalsContact O-N 3.09Å; F206-E208 VanDerWaalsContact C-N 3.3Å; F206-E208 PolarHBondContact O-N 2.9Å
209	V	88.4	Confident	87.9	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.012	18%	0.176	C	C	.	.	H	α-helix	trans	-103.5	-35.6	-173.1	-180	0	0	0	0	114.2	I169 P170 Y173 K180 L183 I187 A205 F206	I169-V209 HydrophobicContact CG2-CG2 3.98Å; P170-V209 HydrophobicContact CB-CG2 4.32Å; P170-V209 HydrophobicContact CG-CG2 4.37Å; Y173-V209 HydrophobicContact CD1-CB 4.23Å; Y173-V209 HydrophobicContact CD1-CG1 4.24Å; Y173-V209 HydrophobicContact CD1-CG2 3.78Å; Y173-V209 HydrophobicContact CD2-CG1 4.02Å; Y173-V209 HydrophobicContact CE2-CG1 4.33Å; Y173-V209 HydrophobicContact CG-CB 4.38Å; Y173-V209 HydrophobicContact CG-CG1 3.97Å; Y173-V209 HydrophobicContact CG-CG2 3.88Å; K180-V209 WeakPolarHBondContact CE-O 3.47Å; K180-V209 HydrophobicContact CG-CG1 4.41Å; L183-V209 HydrophobicContact CB-CG1 4.47Å; L183-V209 HydrophobicContact CD1-CG1 4.4Å; I187-V209 HydrophobicContact CD1-CB 4.22Å; I187-V209 HydrophobicContact CD1-CG1 4.37Å; A205-V209 WeakPolarHBondContact O-CB 3.5Å; A205-V209 WeakPolarHBondContact O-CG2 3.03Å; A205-V209 PolarHBondContact O-N 3.41Å; F206-V209 PolarHBondContact O-N 2.77Å
210	C	85.9	Confident	87.7	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.174	C	C	.	.			trans	-149.7	49.6	-170	58	0	0	0	0	115.2	I184 F206 E212 R213	I184-C210 HydrophobicContact CD1-CB 4.07Å; I184-C210 HydrophobicContact CG1-CB 3.98Å; F206-C210 VanDerWaalsContact CD2-SG 3.53Å; F206-C210 WeakPolarHBondContact CE2-O 3.49Å; F206-C210 CarbonylContact O-C 3.27Å; F206-C210 PolarHBondContact O-N 2.84Å; C210-E212 PolarHBondContact O-N 2.87Å; C210-R213 HydrophobicContact CB-CB 4.48Å; C210-R213 HydrophobicContact CB-CG 4.43Å; C210-R213 PolarHBondContact O-N 3.24Å
211	P	82.6	Confident	87.5	Confident	44 Å²	44	36.1 Å²	36.1	29%	0.286	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.9	179.1	27.2	-36.2	0	0	0	113.9
212	E	81.4	Confident	87.3	Confident	137 Å²	137	39.9 Å²	39.9	64%	0.64	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-28.8	175.5	-56.7	161.2	129.7	0	0	113.3	K180 C210 I214	K180-E212 IonicContact NZ-OE2 2.99Å; K180-E212 PolarHBondContact NZ-OE2 2.74Å; C210-E212 PolarHBondContact O-N 2.87Å; E212-I214 VanDerWaalsContact C-N 3.32Å; E212-I214 PolarHBondContact O-N 2.74Å
213	R	83	Confident	87	Confident	97 Å²	97	42.3 Å²	42.3	37%	0.366	20%	0.196	S	C	.	.			trans	-90.6	61.8	-169.6	-68.6	-58.7	-53.4	-76	-0.9	112.7	I184 F206 C210 D215 L216	I184-R213 HydrophobicContact CD1-CG 4.42Å; F206-R213 HydrophobicContact CE2-CB 4.49Å; F206-R213 WeakPolarHBondContact CE2-O 3.46Å; C210-R213 HydrophobicContact CB-CB 4.48Å; C210-R213 HydrophobicContact CB-CG 4.43Å; C210-R213 PolarHBondContact O-N 3.24Å; R213-D215 IonicContact CZ-OD2 3.42Å; R213-D215 IonicContact NE-OD2 2.67Å; R213-D215 PolarHBondContact NE-OD2 2.93Å; R213-D215 IonicContact NH2-OD2 3.19Å; R213-D215 PolarHBondContact NH2-OD2 3.16Å; R213-D215 PolarHBondContact O-N 2.82Å; R213-D215 VanDerWaalsContact O-N 3.09Å; R213-L216 HydrophobicContact CB-CD1 4.24Å; R213-L216 HydrophobicContact CB-CG 4.38Å; R213-L216 PolarHBondContact O-N 2.74Å
214	I	81.3	Confident	86.9	Confident	41 Å²	41	42.7 Å²	42.7	21%	0.21	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-28.5	-178.9	-51.9	-176.7	0	0	0	112.1	E212 L216 I217 H218 Y246 Q250	E212-I214 VanDerWaalsContact C-N 3.32Å; E212-I214 PolarHBondContact O-N 2.74Å; I214-L216 PolarHBondContact O-N 3.22Å; I214-L216 VanDerWaalsContact O-N 3.09Å; I214-I217 WeakPolarHBondContact O-CA 3.37Å; I214-I217 WeakPolarHBondContact O-CB 3.48Å; I214-I217 PolarHBondContact O-N 2.99Å; I214-H218 VanDerWaalsContact CG2-CE1 3.45Å; I214-H218 WeakPolarHBondContact CG2-CE1 3.29Å; I214-H218 PolarHBondContact O-N 3.42Å; I214-H218 VanDerWaalsContact O-N 3.15Å; I214-Y246 HydrophobicContact CG2-CD2 3.63Å; I214-Y246 HydrophobicContact CG2-CE2 3.68Å; I214-Q250 HydrophobicContact CG2-CG 4.27Å
215	D	82.6	Confident	86.8	Confident	74 Å²	74	40.5 Å²	40.5	40%	0.396	19%	0.187	S	C	.	.	H	α-helix	trans	-45.1	-41.2	174.6	-32.1	-41.2	0	0	0	114.2	R213 I217 H218	R213-D215 IonicContact CZ-OD2 3.42Å; R213-D215 IonicContact NE-OD2 2.67Å; R213-D215 PolarHBondContact NE-OD2 2.93Å; R213-D215 IonicContact NH2-OD2 3.19Å; R213-D215 PolarHBondContact NH2-OD2 3.16Å; R213-D215 PolarHBondContact O-N 2.82Å; R213-D215 VanDerWaalsContact O-N 3.09Å; D215-I217 PolarHBondContact O-N 3.25Å; D215-H218 PolarHBondContact O-N 3.17Å
216	L	84.3	Confident	86.6	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-69	-28.3	-177	-57.3	-179	0	0	0	111.8	I184 E188 L191 F206 R213 I214 N220	I184-L216 HydrophobicContact CG2-CD1 4.17Å; E188-L216 HydrophobicContact CB-CD2 3.97Å; E188-L216 HydrophobicContact CG-CD2 4.01Å; L191-L216 HydrophobicContact CD1-CB 3.86Å; F206-L216 HydrophobicContact CD2-CD1 4.38Å; F206-L216 HydrophobicContact CE2-CB 4.36Å; F206-L216 HydrophobicContact CE2-CD1 4.27Å; R213-L216 HydrophobicContact CB-CD1 4.24Å; R213-L216 HydrophobicContact CB-CG 4.38Å; R213-L216 PolarHBondContact O-N 2.74Å; I214-L216 PolarHBondContact O-N 3.22Å; I214-L216 VanDerWaalsContact O-N 3.09Å; L216-N220 PolarHBondContact O-ND2 2.73Å
217	I	87.2	Confident	86.4	Confident	1 Å²	1	46 Å²	46	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-83.8	-35.6	179.7	-52.1	-50	0	0	0	110.7	L191 F206 I214 D215 K219 N220 Y221 M242 Y246	L191-I217 HydrophobicContact CD1-CD1 4.05Å; L191-I217 HydrophobicContact CD2-CD1 4.45Å; F206-I217 HydrophobicContact CD1-CD1 3.98Å; F206-I217 HydrophobicContact CD1-CG1 4.35Å; F206-I217 HydrophobicContact CD2-CD1 4.14Å; F206-I217 HydrophobicContact CE1-CD1 3.83Å; F206-I217 HydrophobicContact CE1-CG1 3.68Å; F206-I217 HydrophobicContact CE2-CD1 3.99Å; F206-I217 HydrophobicContact CE2-CG1 4.01Å; F206-I217 HydrophobicContact CG-CD1 4.15Å; F206-I217 HydrophobicContact CZ-CD1 3.85Å; F206-I217 HydrophobicContact CZ-CG1 3.49Å; F206-I217 VanDerWaalsContact CZ-CG1 3.49Å; I214-I217 WeakPolarHBondContact O-CA 3.37Å; I214-I217 WeakPolarHBondContact O-CB 3.48Å; I214-I217 PolarHBondContact O-N 2.99Å; D215-I217 PolarHBondContact O-N 3.25Å; I217-K219 VanDerWaalsContact C-N 3.3Å; I217-K219 PolarHBondContact O-N 3.14Å; I217-N220 CarbonylContact O-C 3.55Å; I217-N220 PolarHBondContact O-N 3.42Å; I217-Y221 WeakPolarHBondContact O-CA 3.46Å; I217-Y221 WeakPolarHBondContact O-CB 3.38Å; I217-Y221 PolarHBondContact O-N 3.3Å; I217-M242 HydrophobicContact CD1-CE 3.61Å; I217-M242 HydrophobicContact CD1-SD 4.29Å; I217-M242 HydrophobicContact CG1-CE 3.95Å; I217-M242 HydrophobicContact CG1-SD 4Å; I217-M242 HydrophobicContact CG2-CE 3.77Å; I217-M242 HydrophobicContact CG2-SD 3.9Å; I217-Y246 HydrophobicContact CB-CD2 3.98Å; I217-Y246 HydrophobicContact CB-CE2 3.96Å; I217-Y246 HydrophobicContact CG2-CD2 3.55Å; I217-Y246 HydrophobicContact CG2-CE2 3.66Å; I217-Y246 HydrophobicContact CG2-CG 4.37Å
218	H	85.4	Confident	86.4	Confident	19 Å²	19	43.6 Å²	43.6	9%	0.088	21%	0.206	C	C	.	.	H	α-helix	trans	-51.6	-48.7	175.6	-64	-35.3	0	0	0	112.5	I214 D215 N220 Y246 Q250 V653	I214-H218 VanDerWaalsContact CG2-CE1 3.45Å; I214-H218 WeakPolarHBondContact CG2-CE1 3.29Å; I214-H218 PolarHBondContact O-N 3.42Å; I214-H218 VanDerWaalsContact O-N 3.15Å; D215-H218 PolarHBondContact O-N 3.17Å; H218-N220 PolarHBondContact O-N 2.91Å; H218-Y246 AromaticContact CE1-CE2 3.8Å; H218-Y246 AromaticContact ND1-CE2 3.39Å; H218-Y246 WeakPolarHBondContact ND1-CE2 3.5Å; H218-Y246 AromaticContact ND1-CZ 3.52Å; H218-Y246 PolarHBondContact ND1-OH 3.07Å; H218-Q250 VanDerWaalsContact CE1-CD 3.48Å; H218-Q250 PolarHBondContact CE1-OE1 2.92Å; H218-V653 HydrophobicContact CB-CG1 3.96Å; H218-V653 VanDerWaalsContact CD2-CG1 3.43Å; H218-V653 WeakPolarHBondContact CD2-CG1 3.27Å
219	K	83.9	Confident	86.5	Confident	107 Å²	107	42.5 Å²	42.5	47%	0.465	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-27	178.4	-54.7	-179.5	-171.8	178.9	0	113.4	E188 I217 V656	E188-K219 IonicContact OE1-NZ 3.61Å; E188-K219 PolarHBondContact OE1-NZ 2.88Å; I217-K219 VanDerWaalsContact C-N 3.3Å; I217-K219 PolarHBondContact O-N 3.14Å; K219-V656 HydrophobicContact CB-CG2 4.28Å; K219-V656 HydrophobicContact CG-CG2 4.17Å
220	N	87.1	Confident	86.6	Confident	17 Å²	17	47.7 Å²	47.7	9%	0.091	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-3.4	-170.9	-70.6	-74.9	0	0	0	113.9	L191 L216 I217 H218 R222 K223 L224	L191-N220 PolarHBondContact O-OD1 3.45Å; L191-N220 VanDerWaalsContact O-OD1 3.13Å; L216-N220 PolarHBondContact O-ND2 2.73Å; I217-N220 CarbonylContact O-C 3.55Å; I217-N220 PolarHBondContact O-N 3.42Å; H218-N220 PolarHBondContact O-N 2.91Å; N220-R222 PolarHBondContact O-N 3.47Å; N220-K223 WeakPolarHBondContact O-CB 3.5Å; N220-K223 PolarHBondContact O-N 3.5Å; N220-K223 VanDerWaalsContact O-N 3.15Å; N220-L224 HydrophobicContact CB-CD1 4.43Å; N220-L224 PolarHBondContact O-N 3.17Å
221	Y	88.5	Confident	86.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-55.1	-57.2	-168.5	177.5	-95.2	0	0	0	112.7	I217 K223 L224 C225 L243 Y246 F251 D301 L305	I217-Y221 WeakPolarHBondContact O-CA 3.46Å; I217-Y221 WeakPolarHBondContact O-CB 3.38Å; I217-Y221 PolarHBondContact O-N 3.3Å; Y221-K223 VanDerWaalsContact C-N 3.26Å; Y221-K223 PolarHBondContact O-N 2.95Å; Y221-L224 PolarHBondContact O-N 2.98Å; Y221-L224 VanDerWaalsContact O-N 3.13Å; Y221-C225 PolarHBondContact O-N 3.34Å; Y221-C225 PolarHBondContact O-SG 3.18Å; Y221-C225 VanDerWaalsContact O-SG 3.33Å; Y221-L243 HydrophobicContact CD2-CD2 3.69Å; Y221-L243 HydrophobicContact CE2-CD2 3.66Å; Y221-Y246 AromaticContact CD2-CD1 3.71Å; Y221-Y246 HydrophobicContact CD2-CD1 3.71Å; Y221-Y246 AromaticContact CD2-CE1 3.25Å; Y221-Y246 HydrophobicContact CD2-CE1 3.25Å; Y221-Y246 HydrophobicContact CD2-CE2 4.29Å; Y221-Y246 HydrophobicContact CD2-CG 4.41Å; Y221-Y246 AromaticContact CD2-CZ 3.58Å; Y221-Y246 AromaticContact CE2-CD1 3.46Å; Y221-Y246 HydrophobicContact CE2-CD1 3.46Å; Y221-Y246 VanDerWaalsContact CE2-CD1 3.46Å; Y221-Y246 AromaticContact CE2-CE1 3.25Å; Y221-Y246 HydrophobicContact CE2-CE1 3.25Å; Y221-Y246 HydrophobicContact CE2-CG 4.44Å; Y221-Y246 HydrophobicContact CG-CE1 4.09Å; Y221-F251 HydrophobicContact CE1-CZ 4.29Å; Y221-F251 AromaticContact CZ-CZ 3.85Å; Y221-F251 WeakPolarHBondContact OH-CE2 3.22Å; Y221-F251 WeakPolarHBondContact OH-CZ 3.14Å; Y221-D301 HydrophobicContact CD1-CB 4.33Å; Y221-D301 HydrophobicContact CE1-CB 3.78Å; Y221-D301 PolarHBondContact OH-O 3.09Å; Y221-L305 WeakPolarHBondContact OH-CB 3.19Å; Y221-L305 WeakPolarHBondContact OH-CD2 2.95Å
222	R	88.3	Confident	87.3	Confident	82 Å²	82	49.3 Å²	49.3	31%	0.309	23%	0.234	S	C	.	.	H	α-helix	trans	-61.3	-35	-179.4	-62.6	178.7	-176.6	145.3	5.4	112.6	N220 N226 D301 L304 R654 N655	N220-R222 PolarHBondContact O-N 3.47Å; R222-N226 WeakPolarHBondContact O-CB 3.33Å; R222-N226 VanDerWaalsContact O-CG 3.24Å; R222-N226 PolarHBondContact O-N 3.47Å; R222-N226 PolarHBondContact O-ND2 2.82Å; R222-D301 WeakPolarHBondContact CG-OD1 3.49Å; R222-D301 IonicContact CZ-OD1 2.71Å; R222-D301 IonicContact CZ-OD2 3.08Å; R222-D301 IonicContact NE-OD1 3.16Å; R222-D301 PolarHBondContact NE-OD1 3.43Å; R222-D301 IonicContact NE-OD2 2.69Å; R222-D301 PolarHBondContact NE-OD2 3.21Å; R222-D301 IonicContact NH2-OD1 2.76Å; R222-D301 IonicContact NH2-OD2 2.96Å; R222-D301 PolarHBondContact NH2-OD2 3.32Å; R222-L304 HydrophobicContact CB-CD2 4.18Å; R222-L304 HydrophobicContact CG-CD2 4.03Å; R222-R654 PolarHBondContact NH1-O 3.14Å; R222-R654 VanDerWaalsContact NH1-O 3.16Å; R222-N655 VanDerWaalsContact CZ-OD1 3.23Å; R222-N655 PolarHBondContact NH1-OD1 2.9Å; R222-N655 PolarHBondContact NH2-OD1 3.23Å
223	K	88.5	Confident	87.8	Confident	53 Å²	53	46.9 Å²	46.9	23%	0.23	22%	0.223	C	C	.	.	H	α-helix	trans	-65.6	-47.5	175.5	168.7	-169.6	167.6	-166	0	110.6	L191 A192 D193 N220 Y221 N226 L227	L191-K223 PolarHBondContact O-NZ 3.46Å; A192-K223 PolarHBondContact O-NZ 3.41Å; D193-K223 WeakPolarHBondContact O-CE 3.34Å; D193-K223 PolarHBondContact O-NZ 3.28Å; N220-K223 WeakPolarHBondContact O-CB 3.5Å; N220-K223 PolarHBondContact O-N 3.5Å; N220-K223 VanDerWaalsContact O-N 3.15Å; Y221-K223 VanDerWaalsContact C-N 3.26Å; Y221-K223 PolarHBondContact O-N 2.95Å; K223-N226 PolarHBondContact O-N 3.1Å; K223-L227 HydrophobicContact CG-CD1 3.77Å; K223-L227 HydrophobicContact CG-CG 4.42Å; K223-L227 WeakPolarHBondContact O-CB 3.25Å; K223-L227 VanDerWaalsContact O-CG 3.31Å; K223-L227 WeakPolarHBondContact O-CG 3.37Å; K223-L227 PolarHBondContact O-N 3.08Å
224	L	89.7	Confident	88.2	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-44.9	175.2	-69.2	172.5	0	0	0	111.4	V203 N220 Y221 N226 L227 L228 M242	V203-L224 HydrophobicContact CG2-CD1 4.26Å; V203-L224 HydrophobicContact CG2-CD2 4.11Å; N220-L224 HydrophobicContact CB-CD1 4.43Å; N220-L224 PolarHBondContact O-N 3.17Å; Y221-L224 PolarHBondContact O-N 2.98Å; Y221-L224 VanDerWaalsContact O-N 3.13Å; L224-N226 VanDerWaalsContact C-N 3.32Å; L224-N226 PolarHBondContact O-N 3.47Å; L224-L227 PolarHBondContact O-N 3.15Å; L224-L228 WeakPolarHBondContact O-CB 3.38Å; L224-L228 PolarHBondContact O-N 3.31Å; L224-L228 VanDerWaalsContact O-N 3.13Å; L224-M242 HydrophobicContact CD1-CE 3.97Å
225	C	89.9	Confident	88.7	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.007	23%	0.233	C	C	.	.	H	α-helix	trans	-60.9	-36.5	176.4	-65.8	0	0	0	0	113.3	Y221 L304 N308	Y221-C225 PolarHBondContact O-N 3.34Å; Y221-C225 PolarHBondContact O-SG 3.18Å; Y221-C225 VanDerWaalsContact O-SG 3.33Å; C225-L304 HydrophobicContact CB-CD2 4.27Å; C225-L304 HydrophobicContact CB-CG 4.24Å; C225-N308 WeakPolarHBondContact O-CB 3.49Å; C225-N308 PolarHBondContact O-ND2 3.11Å
226	N	89.7	Confident	89.3	Confident	86 Å²	86	47 Å²	47	46%	0.46	22%	0.217	S	C	.	.	H	α-helix	trans	-79.8	-39.5	179.5	-72.9	-24.1	0	0	0	112.9	R222 K223 L224 L228 N308	R222-N226 WeakPolarHBondContact O-CB 3.33Å; R222-N226 VanDerWaalsContact O-CG 3.24Å; R222-N226 PolarHBondContact O-N 3.47Å; R222-N226 PolarHBondContact O-ND2 2.82Å; K223-N226 PolarHBondContact O-N 3.1Å; L224-N226 VanDerWaalsContact C-N 3.32Å; L224-N226 PolarHBondContact O-N 3.47Å; N226-L228 VanDerWaalsContact C-N 3.27Å; N226-L228 PolarHBondContact O-N 2.87Å; N226-N308 PolarHBondContact OD1-ND2 3.37Å
227	L	89.4	Confident	89.7	Confident	37 Å²	37	49 Å²	49	19%	0.194	23%	0.229	C	C	.	.	H	α-helix	trans	-73.7	-15.3	178.9	-69.2	176.3	0	0	0	113.6	T196 K223 L224 I229 D230 V231	T196-L227 HydrophobicContact CG2-CB 4.45Å; T196-L227 HydrophobicContact CG2-CD2 4.03Å; K223-L227 HydrophobicContact CG-CD1 3.77Å; K223-L227 HydrophobicContact CG-CG 4.42Å; K223-L227 WeakPolarHBondContact O-CB 3.25Å; K223-L227 VanDerWaalsContact O-CG 3.31Å; K223-L227 WeakPolarHBondContact O-CG 3.37Å; K223-L227 PolarHBondContact O-N 3.08Å; L224-L227 PolarHBondContact O-N 3.15Å; L227-I229 PolarHBondContact O-N 2.95Å; L227-I229 VanDerWaalsContact O-N 3.07Å; L227-D230 PolarHBondContact O-N 3.46Å; L227-V231 WeakPolarHBondContact O-CG2 3.4Å; L227-V231 PolarHBondContact O-N 3.38Å
228	L	89.6	Confident	89.9	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-54.5	-32.4	-170.2	-173.5	63.5	0	0	0	114.4	L224 N226 D230 Q236 I239 I240 T309 L312	L224-L228 WeakPolarHBondContact O-CB 3.38Å; L224-L228 PolarHBondContact O-N 3.31Å; L224-L228 VanDerWaalsContact O-N 3.13Å; N226-L228 VanDerWaalsContact C-N 3.27Å; N226-L228 PolarHBondContact O-N 2.87Å; L228-D230 VanDerWaalsContact C-N 3.31Å; L228-D230 PolarHBondContact O-N 3.22Å; L228-Q236 HydrophobicContact CD1-CB 4.21Å; L228-Q236 HydrophobicContact CD1-CG 4.27Å; L228-Q236 WeakPolarHBondContact O-CG 3.34Å; L228-Q236 PolarHBondContact O-NE2 2.99Å; L228-I239 HydrophobicContact CD1-CB 3.88Å; L228-I239 HydrophobicContact CD1-CD1 4.38Å; L228-I239 HydrophobicContact CD1-CG2 3.73Å; L228-I240 HydrophobicContact CD1-CG1 4.32Å; L228-I240 HydrophobicContact CD2-CD1 4.32Å; L228-I240 HydrophobicContact CD2-CG1 3.96Å; L228-T309 HydrophobicContact CD2-CG2 3.63Å; L228-L312 HydrophobicContact CD2-CD1 3.75Å; L228-L312 HydrophobicContact CG-CD1 3.86Å
229	I	89.3	Confident	90.3	Very high	84 Å²	84	49.7 Å²	49.7	43%	0.431	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-69.3	-31.1	179.3	-60.1	175	0	0	0	111.4	L227 P311	L227-I229 PolarHBondContact O-N 2.95Å; L227-I229 VanDerWaalsContact O-N 3.07Å; I229-P311 HydrophobicContact CD1-CG 4.43Å
230	D	90.3	Very high	90.7	Very high	111 Å²	111	44.6 Å²	44.6	59%	0.594	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-96.7	4.1	-174.9	-56.6	-40.9	0	0	0	113.5	T196 L227 L228	T196-D230 VanDerWaalsContact CB-O 3.28Å; T196-D230 WeakPolarHBondContact CB-O 3.29Å; T196-D230 HydrophobicContact CG2-CB 3.77Å; T196-D230 PolarHBondContact OG1-O 3.03Å; L227-D230 PolarHBondContact O-N 3.46Å; L228-D230 VanDerWaalsContact C-N 3.31Å; L228-D230 PolarHBondContact O-N 3.22Å
231	V	91.5	Very high	90.9	Very high	8 Å²	8	45.3 Å²	45.3	5%	0.048	22%	0.218	C	C	.	.	S	Bend	trans	-90.9	149.2	176.3	173.6	0	0	0	0	110.3	T196 A199 L227 Q236 I239	T196-V231 HydrophobicContact CG2-CG2 4.35Å; A199-V231 HydrophobicContact CB-CG2 4.34Å; L227-V231 WeakPolarHBondContact O-CG2 3.4Å; L227-V231 PolarHBondContact O-N 3.38Å; V231-Q236 HydrophobicContact CB-CG 4.32Å; V231-Q236 HydrophobicContact CG1-CG 4.5Å; V231-Q236 WeakPolarHBondContact O-CG 3.43Å; V231-Q236 PolarHBondContact O-NE2 2.93Å; V231-I239 HydrophobicContact CG1-CD1 4.03Å; V231-I239 HydrophobicContact CG2-CD1 4.3Å
232	E	91.6	Very high	91	Very high	69 Å²	69	45.8 Å²	45.8	32%	0.322	22%	0.221	S	C	.	.			trans	-60	148.9	175.6	65.6	-175	-145.9	0	0	113.2	K163 W234 G235 Q236	K163-E232 IonicContact NZ-OE1 3.75Å; K163-E232 PolarHBondContact NZ-OE1 3.26Å; K163-E232 IonicContact NZ-OE2 2.65Å; K163-E232 PolarHBondContact NZ-OE2 3.38Å; E232-W234 VanDerWaalsContact C-N 3.3Å; E232-W234 PolarHBondContact O-N 2.93Å; E232-W234 VanDerWaalsContact O-N 3.13Å; E232-G235 CarbonylContact O-C 3.59Å; E232-G235 WeakPolarHBondContact O-CA 3.41Å; E232-G235 PolarHBondContact O-N 3.47Å; E232-Q236 PolarHBondContact O-N 3.24Å
233	E	92	Very high	91.2	Very high	86 Å²	86	41.9 Å²	41.9	40%	0.402	21%	0.206	S	C	.	.	H	α-helix	trans	-53.5	-41	-170.3	-56.2	-170.9	142.2	0	0	114	Q236 V237 S317 V320	E233-Q236 WeakPolarHBondContact O-CB 3.44Å; E233-Q236 PolarHBondContact O-N 3.42Å; E233-V237 PolarHBondContact O-N 3.15Å; E233-S317 VanDerWaalsContact CD-CB 3.44Å; E233-S317 WeakPolarHBondContact OE1-CB 3.44Å; E233-S317 WeakPolarHBondContact OE2-CB 3.29Å; E233-V320 HydrophobicContact CB-CG2 4.04Å
234	W	91.8	Very high	91.3	Very high	199 Å²	199	39.3 Å²	39.3	75%	0.754	20%	0.195	S	C	*	.	H	α-helix	trans	-64.2	-40.3	175.7	-58.3	105.8	0	0	0	112.5	E232 V237 V238	E232-W234 VanDerWaalsContact C-N 3.3Å; E232-W234 PolarHBondContact O-N 2.93Å; E232-W234 VanDerWaalsContact O-N 3.13Å; W234-V237 PolarHBondContact O-N 2.95Å; W234-V238 PolarHBondContact O-N 2.93Å
235	G	92.7	Very high	91.2	Very high	3 Å²	3	41.3 Å²	41.3	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-67.5	-36	174.4	0	0	0	0	0	112.5	E232 V237 V238 I239	E232-G235 CarbonylContact O-C 3.59Å; E232-G235 WeakPolarHBondContact O-CA 3.41Å; E232-G235 PolarHBondContact O-N 3.47Å; G235-V237 PolarHBondContact O-N 3.35Å; G235-V238 PolarHBondContact O-N 3.34Å; G235-I239 WeakPolarHBondContact O-CB 3.4Å; G235-I239 WeakPolarHBondContact O-CD1 3.45Å; G235-I239 WeakPolarHBondContact O-CG1 3.45Å; G235-I239 PolarHBondContact O-N 2.91Å
236	Q	93.8	Very high	91.1	Very high	14 Å²	14	41.6 Å²	41.6	7%	0.065	20%	0.203	C	C	.	.	H	α-helix	trans	-59.7	-46.5	175	-63.9	-177.9	5.2	0	0	111.4	L228 V231 E232 E233 V238 I239 I240 V320	L228-Q236 HydrophobicContact CD1-CB 4.21Å; L228-Q236 HydrophobicContact CD1-CG 4.27Å; L228-Q236 WeakPolarHBondContact O-CG 3.34Å; L228-Q236 PolarHBondContact O-NE2 2.99Å; V231-Q236 HydrophobicContact CB-CG 4.32Å; V231-Q236 HydrophobicContact CG1-CG 4.5Å; V231-Q236 WeakPolarHBondContact O-CG 3.43Å; V231-Q236 PolarHBondContact O-NE2 2.93Å; E232-Q236 PolarHBondContact O-N 3.24Å; E233-Q236 WeakPolarHBondContact O-CB 3.44Å; E233-Q236 PolarHBondContact O-N 3.42Å; Q236-V238 PolarHBondContact O-N 3.4Å; Q236-I239 PolarHBondContact O-N 3.43Å; Q236-I240 WeakPolarHBondContact O-CB 3.29Å; Q236-I240 WeakPolarHBondContact O-CD1 3.41Å; Q236-I240 WeakPolarHBondContact O-CG1 3.41Å; Q236-I240 PolarHBondContact O-N 3.13Å; Q236-V320 HydrophobicContact CB-CG2 4.16Å; Q236-V320 VanDerWaalsContact OE1-CG1 3.29Å
237	V	93.5	Very high	91	Very high	43 Å²	43	37.5 Å²	37.5	26%	0.261	18%	0.181	S	C	.	.	H	α-helix	trans	-59.3	-48.3	179	174	0	0	0	0	111.6	E233 W234 G235 I240 S241 A319 V320 A323	E233-V237 PolarHBondContact O-N 3.15Å; W234-V237 PolarHBondContact O-N 2.95Å; G235-V237 PolarHBondContact O-N 3.35Å; V237-I240 PolarHBondContact O-N 3.26Å; V237-S241 PolarHBondContact O-N 3.43Å; V237-A319 HydrophobicContact CG2-CB 3.9Å; V237-V320 HydrophobicContact CG2-CG2 3.98Å; V237-A323 HydrophobicContact CG1-CB 4.32Å; V237-A323 HydrophobicContact CG2-CB 4.45Å
238	V	92.1	Very high	90.8	Very high	34 Å²	34	37.4 Å²	37.4	21%	0.206	18%	0.178	C	C	.	.	H	α-helix	trans	-64.5	-45.5	179.5	175	0	0	0	0	111.5	V203 M204 W234 G235 Q236 I240 S241 M242	V203-V238 HydrophobicContact CG1-CG1 4.2Å; M204-V238 HydrophobicContact CB-CG1 3.99Å; W234-V238 PolarHBondContact O-N 2.93Å; G235-V238 PolarHBondContact O-N 3.34Å; Q236-V238 PolarHBondContact O-N 3.4Å; V238-I240 VanDerWaalsContact C-N 3.29Å; V238-I240 PolarHBondContact O-N 3.14Å; V238-S241 WeakPolarHBondContact O-CB 3.05Å; V238-S241 PolarHBondContact O-N 3Å; V238-M242 PolarHBondContact O-N 2.86Å
239	I	93.2	Very high	90.5	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-62.5	-38.7	177.6	-65.6	166.8	0	0	0	110.6	V203 L228 V231 G235 Q236 L243	V203-I239 HydrophobicContact CB-CG1 4Å; V203-I239 HydrophobicContact CG1-CG1 4.16Å; V203-I239 HydrophobicContact CG2-CG1 4.04Å; L228-I239 HydrophobicContact CD1-CB 3.88Å; L228-I239 HydrophobicContact CD1-CD1 4.38Å; L228-I239 HydrophobicContact CD1-CG2 3.73Å; V231-I239 HydrophobicContact CG1-CD1 4.03Å; V231-I239 HydrophobicContact CG2-CD1 4.3Å; G235-I239 WeakPolarHBondContact O-CB 3.4Å; G235-I239 WeakPolarHBondContact O-CD1 3.45Å; G235-I239 WeakPolarHBondContact O-CG1 3.45Å; G235-I239 PolarHBondContact O-N 2.91Å; Q236-I239 PolarHBondContact O-N 3.43Å; I239-L243 HydrophobicContact CG2-CD1 3.52Å; I239-L243 HydrophobicContact CG2-CG 4.07Å; I239-L243 VanDerWaalsContact O-CB 3.24Å; I239-L243 WeakPolarHBondContact O-CB 3.43Å; I239-L243 WeakPolarHBondContact O-CG 3.17Å; I239-L243 PolarHBondContact O-N 3.39Å
240	I	93.4	Very high	90.1	Very high	1 Å²	1	36 Å²	36	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-68	-38.7	176	-67.6	161.6	0	0	0	111.6	L228 Q236 V237 V238 T244 T309 L312 A323 V324 L327	L228-I240 HydrophobicContact CD1-CG1 4.32Å; L228-I240 HydrophobicContact CD2-CD1 4.32Å; L228-I240 HydrophobicContact CD2-CG1 3.96Å; Q236-I240 WeakPolarHBondContact O-CB 3.29Å; Q236-I240 WeakPolarHBondContact O-CD1 3.41Å; Q236-I240 WeakPolarHBondContact O-CG1 3.41Å; Q236-I240 PolarHBondContact O-N 3.13Å; V237-I240 PolarHBondContact O-N 3.26Å; V238-I240 VanDerWaalsContact C-N 3.29Å; V238-I240 PolarHBondContact O-N 3.14Å; I240-T244 WeakPolarHBondContact O-CB 3.41Å; I240-T244 PolarHBondContact O-N 3.23Å; I240-T244 PolarHBondContact O-OG1 3.24Å; I240-T309 HydrophobicContact CG1-CG2 4.46Å; I240-L312 HydrophobicContact CD1-CD1 4.13Å; I240-A323 HydrophobicContact CB-CB 4.2Å; I240-A323 HydrophobicContact CD1-CB 4.39Å; I240-A323 HydrophobicContact CG2-CB 3.87Å; I240-A323 WeakPolarHBondContact CG2-O 3.35Å; I240-V324 HydrophobicContact CD1-CG2 3.71Å; I240-L327 HydrophobicContact CG2-CB 3.97Å; I240-L327 HydrophobicContact CG2-CD1 4.33Å; I240-L327 HydrophobicContact CG2-CD2 4.28Å; I240-L327 HydrophobicContact CG2-CG 4.43Å
241	S	90.9	Very high	89.8	Confident	31 Å²	31	30.8 Å²	30.8	22%	0.217	14%	0.144	C	C	.	.	H	α-helix	trans	-56.1	-56.8	172.4	178.9	0	0	0	0	111	E207 V237 V238 L243 T244 R245	E207-S241 PolarHBondContact OE1-OG 3.02Å; V237-S241 PolarHBondContact O-N 3.43Å; V238-S241 WeakPolarHBondContact O-CB 3.05Å; V238-S241 PolarHBondContact O-N 3Å; S241-L243 PolarHBondContact O-N 3.28Å; S241-T244 WeakPolarHBondContact O-CB 3.49Å; S241-T244 PolarHBondContact O-N 3.35Å; S241-R245 PolarHBondContact O-N 2.99Å; S241-R245 VanDerWaalsContact O-N 3.09Å
242	M	90.9	Very high	89.2	Confident	10 Å²	10	32.8 Å²	32.8	5%	0.049	15%	0.154	C	C	.	.	H	α-helix	trans	-61.8	-44	-178.7	-172.6	-81.1	-79	0	0	111.5	V203 F206 I217 L224 V238 T244 R245 Y246	V203-M242 HydrophobicContact CG1-CB 3.77Å; V203-M242 HydrophobicContact CG1-CE 3.57Å; V203-M242 HydrophobicContact CG1-CG 3.98Å; V203-M242 HydrophobicContact CG2-CE 4.2Å; F206-M242 HydrophobicContact CD1-CG 4.13Å; F206-M242 HydrophobicContact CE1-CG 4.06Å; F206-M242 HydrophobicContact CE1-SD 4.32Å; I217-M242 HydrophobicContact CD1-CE 3.61Å; I217-M242 HydrophobicContact CD1-SD 4.29Å; I217-M242 HydrophobicContact CG1-CE 3.95Å; I217-M242 HydrophobicContact CG1-SD 4Å; I217-M242 HydrophobicContact CG2-CE 3.77Å; I217-M242 HydrophobicContact CG2-SD 3.9Å; L224-M242 HydrophobicContact CD1-CE 3.97Å; V238-M242 PolarHBondContact O-N 2.86Å; M242-T244 VanDerWaalsContact C-N 3.28Å; M242-T244 PolarHBondContact O-N 2.81Å; M242-R245 PolarHBondContact O-N 3.46Å; M242-Y246 WeakPolarHBondContact O-CB 3.42Å; M242-Y246 PolarHBondContact O-N 2.94Å
243	L	91.3	Very high	88.3	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.3	-26.3	176.3	-68.6	174.4	0	0	0	112.9	Y221 I239 S241 A247 L305	Y221-L243 HydrophobicContact CD2-CD2 3.69Å; Y221-L243 HydrophobicContact CE2-CD2 3.66Å; I239-L243 HydrophobicContact CG2-CD1 3.52Å; I239-L243 HydrophobicContact CG2-CG 4.07Å; I239-L243 VanDerWaalsContact O-CB 3.24Å; I239-L243 WeakPolarHBondContact O-CB 3.43Å; I239-L243 WeakPolarHBondContact O-CG 3.17Å; I239-L243 PolarHBondContact O-N 3.39Å; S241-L243 PolarHBondContact O-N 3.28Å; L243-A247 WeakPolarHBondContact O-CB 3.43Å; L243-A247 PolarHBondContact O-N 2.79Å; L243-L305 HydrophobicContact CB-CD1 4.17Å; L243-L305 HydrophobicContact CB-CD2 4.29Å; L243-L305 HydrophobicContact CD1-CD1 3.85Å
244	T	89.9	Confident	87.2	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-68	-46.3	170.9	-52.4	0	0	0	0	110.9	I240 S241 M242 A247 R248 L327 H330 L641	I240-T244 WeakPolarHBondContact O-CB 3.41Å; I240-T244 PolarHBondContact O-N 3.23Å; I240-T244 PolarHBondContact O-OG1 3.24Å; S241-T244 WeakPolarHBondContact O-CB 3.49Å; S241-T244 PolarHBondContact O-N 3.35Å; M242-T244 VanDerWaalsContact C-N 3.28Å; M242-T244 PolarHBondContact O-N 2.81Å; T244-A247 PolarHBondContact O-N 2.71Å; T244-R248 PolarHBondContact O-N 3.09Å; T244-R248 VanDerWaalsContact O-N 3.14Å; T244-L327 HydrophobicContact CG2-CD1 4.4Å; T244-L327 WeakPolarHBondContact OG1-CD1 3.45Å; T244-H330 HydrophobicContact CG2-CB 4.47Å; T244-L641 HydrophobicContact CG2-CD2 4.06Å
245	R	88	Confident	85.9	Confident	49 Å²	49	19 Å²	19	19%	0.185	10%	0.103	C	C	.	.	H	α-helix	trans	-64.9	-43.9	177.7	-173.5	176.4	-67	-77.2	-8.7	111.5	S241 M242 R248 T249 Q639 E640 P642	S241-R245 PolarHBondContact O-N 2.99Å; S241-R245 VanDerWaalsContact O-N 3.09Å; M242-R245 PolarHBondContact O-N 3.46Å; R245-R248 PolarHBondContact O-N 3.06Å; R245-T249 PolarHBondContact O-N 2.84Å; R245-T249 PolarHBondContact O-OG1 2.68Å; R245-Q639 PolarHBondContact NH2-O 3.2Å; R245-E640 PolarHBondContact NH1-O 2.98Å; R245-E640 PolarHBondContact NH2-O 3.02Å; R245-P642 HydrophobicContact CG-CG 4.07Å
246	Y	88.3	Confident	84.1	Confident	7 Å²	7	23.1 Å²	23.1	3%	0.027	12%	0.122	C	C	.	.	H	α-helix	trans	-58.6	-50.4	172.9	176.5	-79.3	0	0	0	111.6	I214 I217 H218 Y221 M242 R248 T249 Q250 F251 R654	I214-Y246 HydrophobicContact CG2-CD2 3.63Å; I214-Y246 HydrophobicContact CG2-CE2 3.68Å; I217-Y246 HydrophobicContact CB-CD2 3.98Å; I217-Y246 HydrophobicContact CB-CE2 3.96Å; I217-Y246 HydrophobicContact CG2-CD2 3.55Å; I217-Y246 HydrophobicContact CG2-CE2 3.66Å; I217-Y246 HydrophobicContact CG2-CG 4.37Å; H218-Y246 AromaticContact CE1-CE2 3.8Å; H218-Y246 AromaticContact ND1-CE2 3.39Å; H218-Y246 WeakPolarHBondContact ND1-CE2 3.5Å; H218-Y246 AromaticContact ND1-CZ 3.52Å; H218-Y246 PolarHBondContact ND1-OH 3.07Å; Y221-Y246 AromaticContact CD2-CD1 3.71Å; Y221-Y246 HydrophobicContact CD2-CD1 3.71Å; Y221-Y246 AromaticContact CD2-CE1 3.25Å; Y221-Y246 HydrophobicContact CD2-CE1 3.25Å; Y221-Y246 HydrophobicContact CD2-CE2 4.29Å; Y221-Y246 HydrophobicContact CD2-CG 4.41Å; Y221-Y246 AromaticContact CD2-CZ 3.58Å; Y221-Y246 AromaticContact CE2-CD1 3.46Å; Y221-Y246 HydrophobicContact CE2-CD1 3.46Å; Y221-Y246 VanDerWaalsContact CE2-CD1 3.46Å; Y221-Y246 AromaticContact CE2-CE1 3.25Å; Y221-Y246 HydrophobicContact CE2-CE1 3.25Å; Y221-Y246 HydrophobicContact CE2-CG 4.44Å; Y221-Y246 HydrophobicContact CG-CE1 4.09Å; M242-Y246 WeakPolarHBondContact O-CB 3.42Å; M242-Y246 PolarHBondContact O-N 2.94Å; Y246-R248 PolarHBondContact O-N 3.39Å; Y246-T249 PolarHBondContact O-N 3.49Å; Y246-T249 PolarHBondContact O-OG1 3.34Å; Y246-T249 VanDerWaalsContact O-OG1 3.13Å; Y246-Q250 HydrophobicContact CD1-CB 4.12Å; Y246-Q250 HydrophobicContact CD1-CG 4.14Å; Y246-Q250 HydrophobicContact CD2-CG 4.22Å; Y246-Q250 HydrophobicContact CE1-CB 3.87Å; Y246-Q250 HydrophobicContact CE1-CG 3.99Å; Y246-Q250 HydrophobicContact CE2-CG 4.09Å; Y246-Q250 HydrophobicContact CG-CG 4.25Å; Y246-Q250 VanDerWaalsContact O-CB 3.22Å; Y246-Q250 WeakPolarHBondContact O-CB 3.39Å; Y246-Q250 VanDerWaalsContact O-CG 3.27Å; Y246-Q250 WeakPolarHBondContact O-CG 3.45Å; Y246-Q250 PolarHBondContact O-N 2.82Å; Y246-Q250 VanDerWaalsContact O-N 3.08Å; Y246-F251 HydrophobicContact CE1-CE2 4.37Å; Y246-F251 HydrophobicContact CE1-CZ 4.43Å; Y246-R654 PolarHBondContact OH-NE 3.38Å
247	A	86.7	Confident	82	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.3	-32.6	-176.4	0	0	0	0	0	112.3	L243 T244 F251 L305 L331	L243-A247 WeakPolarHBondContact O-CB 3.43Å; L243-A247 PolarHBondContact O-N 2.79Å; T244-A247 PolarHBondContact O-N 2.71Å; A247-F251 HydrophobicContact CB-CD2 3.75Å; A247-F251 HydrophobicContact CB-CE2 3.87Å; A247-F251 WeakPolarHBondContact O-CD2 3.27Å; A247-F251 PolarHBondContact O-N 3Å; A247-L305 HydrophobicContact CB-CD2 4.19Å; A247-L331 HydrophobicContact CB-CD1 3.44Å; A247-L331 VanDerWaalsContact CB-CD1 3.44Å; A247-L331 HydrophobicContact CB-CD2 3.75Å; A247-L331 HydrophobicContact CB-CG 4.27Å
248	R	85.3	Confident	79.8	Confident	34 Å²	34	25.9 Å²	25.9	13%	0.128	13%	0.134	C	C	.	.	H	α-helix	trans	-65.8	-33.9	172.6	-79.4	-52.3	-163.4	93.8	-14.7	114.3	T244 R245 Y246 H330 L331 L641 P642 W644 P645	T244-R248 PolarHBondContact O-N 3.09Å; T244-R248 VanDerWaalsContact O-N 3.14Å; R245-R248 PolarHBondContact O-N 3.06Å; Y246-R248 PolarHBondContact O-N 3.39Å; R248-H330 PolarHBondContact NE-O 2.83Å; R248-H330 PolarHBondContact NH2-O 3.49Å; R248-L331 HydrophobicContact CG-CD2 3.98Å; R248-L641 HydrophobicContact CG-CD2 4.31Å; R248-P642 HydrophobicContact CB-CB 4.45Å; R248-P642 PolarHBondContact NH1-O 2.68Å; R248-P642 VanDerWaalsContact NH1-O 3.16Å; R248-W644 VanDerWaalsContact CD-CE2 3.48Å; R248-P645 WeakPolarHBondContact O-CD 3.42Å
249	T	83.5	Confident	77.3	Confident	37 Å²	37	26.8 Å²	26.8	23%	0.227	14%	0.142	C	C	.	.	H	α-helix	trans	-91	-7.1	179.2	57	0	0	0	0	114.3	R245 Y246 P642	R245-T249 PolarHBondContact O-N 2.84Å; R245-T249 PolarHBondContact O-OG1 2.68Å; Y246-T249 PolarHBondContact O-N 3.49Å; Y246-T249 PolarHBondContact O-OG1 3.34Å; Y246-T249 VanDerWaalsContact O-OG1 3.13Å; T249-P642 HydrophobicContact CG2-CB 3.48Å; T249-P642 VanDerWaalsContact CG2-CB 3.48Å; T249-P642 HydrophobicContact CG2-CG 3.64Å
250	Q	81.9	Confident	74.6	Confident	18 Å²	18	31.9 Å²	31.9	8%	0.084	17%	0.169	C	C	.	.	H	α-helix	trans	-126.9	-9.7	-165.6	-66.9	-61	-48.9	0	0	116.1	I214 H218 Y246 R654	I214-Q250 HydrophobicContact CG2-CG 4.27Å; H218-Q250 VanDerWaalsContact CE1-CD 3.48Å; H218-Q250 PolarHBondContact CE1-OE1 2.92Å; Y246-Q250 HydrophobicContact CD1-CB 4.12Å; Y246-Q250 HydrophobicContact CD1-CG 4.14Å; Y246-Q250 HydrophobicContact CD2-CG 4.22Å; Y246-Q250 HydrophobicContact CE1-CB 3.87Å; Y246-Q250 HydrophobicContact CE1-CG 3.99Å; Y246-Q250 HydrophobicContact CE2-CG 4.09Å; Y246-Q250 HydrophobicContact CG-CG 4.25Å; Y246-Q250 VanDerWaalsContact O-CB 3.22Å; Y246-Q250 WeakPolarHBondContact O-CB 3.39Å; Y246-Q250 VanDerWaalsContact O-CG 3.27Å; Y246-Q250 WeakPolarHBondContact O-CG 3.45Å; Y246-Q250 PolarHBondContact O-N 2.82Å; Y246-Q250 VanDerWaalsContact O-N 3.08Å; Q250-R654 PolarHBondContact O-NH2 2.74Å
251	F	83.1	Confident	72.2	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.009	20%	0.202	C	C	.	.	S	Bend	trans	-127	155.7	174.6	-54	-69.4	0	0	0	110.1	Y221 Y246 A247 D299 D301 H302 P645 R654	Y221-F251 HydrophobicContact CE1-CZ 4.29Å; Y221-F251 AromaticContact CZ-CZ 3.85Å; Y221-F251 WeakPolarHBondContact OH-CE2 3.22Å; Y221-F251 WeakPolarHBondContact OH-CZ 3.14Å; Y246-F251 HydrophobicContact CE1-CE2 4.37Å; Y246-F251 HydrophobicContact CE1-CZ 4.43Å; A247-F251 HydrophobicContact CB-CD2 3.75Å; A247-F251 HydrophobicContact CB-CE2 3.87Å; A247-F251 WeakPolarHBondContact O-CD2 3.27Å; A247-F251 PolarHBondContact O-N 3Å; F251-D299 HydrophobicContact CD1-CB 3.85Å; F251-D299 VanDerWaalsContact CD1-OD2 3.29Å; F251-D299 WeakPolarHBondContact CD1-OD2 3.44Å; F251-D299 HydrophobicContact CE1-CB 4.08Å; F251-D299 VanDerWaalsContact CE1-OD2 3.27Å; F251-D299 WeakPolarHBondContact CE1-OD2 3.43Å; F251-D301 HydrophobicContact CE1-CB 4.03Å; F251-D301 HydrophobicContact CZ-CB 4.09Å; F251-H302 HydrophobicContact CD1-CB 3.83Å; F251-H302 HydrophobicContact CD2-CB 3.9Å; F251-H302 AromaticContact CD2-CG 3.75Å; F251-H302 AromaticContact CD2-ND1 3.89Å; F251-H302 HydrophobicContact CE1-CB 3.8Å; F251-H302 HydrophobicContact CE2-CB 3.92Å; F251-H302 HydrophobicContact CG-CB 3.87Å; F251-H302 AromaticContact CG-CG 3.93Å; F251-H302 AromaticContact CG-ND1 3.81Å; F251-H302 HydrophobicContact CZ-CB 3.87Å; F251-P645 WeakPolarHBondContact O-CD 3.48Å; F251-P645 WeakPolarHBondContact O-CG 3.35Å; F251-R654 VanDerWaalsContact CE1-NH1 3.26Å
252	L	79.2	Confident	69.9	Low	50 Å²	50	42.8 Å²	42.8	26%	0.262	22%	0.219	S	C	.	.			trans	-72.7	150.3	169.4	-60.2	177.4	0	0	0	110.9	P254 Y296 P645 E646 A648	L252-P254 VanDerWaalsContact O-CD 3.26Å; L252-P254 WeakPolarHBondContact O-CD 3.24Å; L252-Y296 HydrophobicContact CB-CE2 4.27Å; L252-Y296 PolarHBondContact O-OH 3.19Å; L252-P645 VanDerWaalsContact CD2-O 3.31Å; L252-P645 WeakPolarHBondContact CD2-O 3.34Å; L252-E646 WeakPolarHBondContact CD2-O 3.16Å; L252-A648 HydrophobicContact CD2-CB 4.47Å; L252-A648 HydrophobicContact CG-CB 4.15Å
253	S	72.9	Confident	67.2	Low	13 Å²	13	50 Å²	50	9%	0.091	25%	0.253	C	S	.	.			trans	-59.4	117.9	176.2	179.1	0	0	0	0	111.9	T255 Q256 W644	S253-T255 PolarHBondContact O-N 3.12Å; S253-Q256 PolarHBondContact O-N 2.91Å; S253-W644 PolarHBondContact OG-NE1 3.41Å
254	P	69.6	Low	64.5	Low	13 Å²	13	54.1 Å²	54.1	8%	0.084	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-4.8	178.2	-23.9	36.6	0	0	0	114.9	L252 Y296 L331 P333	L252-P254 VanDerWaalsContact O-CD 3.26Å; L252-P254 WeakPolarHBondContact O-CD 3.24Å; P254-Y296 HydrophobicContact CB-CE1 3.96Å; P254-Y296 HydrophobicContact CG-CE1 4.47Å; P254-L331 WeakPolarHBondContact CG-O 3.44Å; P254-P333 HydrophobicContact CB-CG 3.98Å
255	T	63.2	Low	61.9	Low	38 Å²	38	58.4 Å²	58.4	23%	0.233	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-16	-177.1	-39.1	0	0	0	0	113.3	S253 N257 E258 S259 K334	S253-T255 PolarHBondContact O-N 3.12Å; T255-N257 VanDerWaalsContact C-N 3.31Å; T255-N257 PolarHBondContact O-N 3.38Å; T255-E258 HydrophobicContact CG2-CB 4.44Å; T255-E258 WeakPolarHBondContact O-CB 3.04Å; T255-E258 PolarHBondContact O-N 3.06Å; T255-S259 PolarHBondContact O-N 3.46Å; T255-K334 HydrophobicContact CG2-CG 4.47Å
256	Q	55.7	Low	59.5	Low	90 Å²	90	64.6 Å²	64.6	42%	0.421	33%	0.334	S	S	.	.	H	α-helix	trans	-59.9	-33.7	-171.9	-90	168.2	-12.4	0	0	114.4	S253 S259	S253-Q256 PolarHBondContact O-N 2.91Å; Q256-S259 PolarHBondContact O-OG 3.49Å; Q256-S259 VanDerWaalsContact O-OG 3.1Å
257	N	48.4	Very low	57.1	Low	58 Å²	58	72.5 Å²	72.5	31%	0.31	37%	0.369	S	S	.	.	H	α-helix	trans	-86.1	-13.3	176.1	-77.9	12.5	0	0	0	113.4	T255	T255-N257 VanDerWaalsContact C-N 3.31Å; T255-N257 PolarHBondContact O-N 3.38Å
258	E	48.3	Very low	54.8	Low	57 Å²	57	76.8 Å²	76.8	27%	0.266	40%	0.404	S	S	.	.	H	α-helix	trans	-80.4	-36	-177.7	-142.8	174	-150.8	0	0	110.8	T255 L260 L261 E262 K334	T255-E258 HydrophobicContact CG2-CB 4.44Å; T255-E258 WeakPolarHBondContact O-CB 3.04Å; T255-E258 PolarHBondContact O-N 3.06Å; E258-L260 VanDerWaalsContact C-N 3.3Å; E258-L260 PolarHBondContact O-N 3.08Å; E258-L261 PolarHBondContact O-N 3.43Å; E258-L261 VanDerWaalsContact O-N 3.16Å; E258-E262 PolarHBondContact O-N 2.99Å; E258-K334 WeakPolarHBondContact OE2-CB 3.44Å; E258-K334 WeakPolarHBondContact OE2-CD 3.29Å; E258-K334 VanDerWaalsContact OE2-CE 3.23Å; E258-K334 WeakPolarHBondContact OE2-CE 3.29Å; E258-K334 WeakPolarHBondContact OE2-CG 3.35Å; E258-K334 IonicContact OE2-NZ 3.67Å; E258-K334 PolarHBondContact OE2-NZ 3.49Å
259	S	39.1	Very low	52.3	Low	53 Å²	53	83 Å²	83	37%	0.371	43%	0.433	S	S	.	.	H	α-helix	trans	-62.3	-34.7	171.4	38.5	0	0	0	0	113	T255 Q256 L261 E262 E263	T255-S259 PolarHBondContact O-N 3.46Å; Q256-S259 PolarHBondContact O-OG 3.49Å; Q256-S259 VanDerWaalsContact O-OG 3.1Å; S259-L261 PolarHBondContact O-N 2.86Å; S259-E262 PolarHBondContact O-N 3.2Å; S259-E263 PolarHBondContact O-N 3.16Å; S259-E263 VanDerWaalsContact O-N 3.13Å
260	L	38	Very low	50.2	Low	109 Å²	109	90.7 Å²	90.7	57%	0.571	46%	0.459	S	S	*	.	H	α-helix	trans	-71.5	-15.5	176.2	-67.9	172.8	0	0	0	113.5	E258	E258-L260 VanDerWaalsContact C-N 3.3Å; E258-L260 PolarHBondContact O-N 3.08Å
261	L	42.2	Very low	47.8	Very low	134 Å²	134	93.3 Å²	93.3	70%	0.702	49%	0.49	S	S	*	.	H	α-helix	trans	-92.3	-37.2	172.8	-66.8	168.6	0	0	0	111.3	E258 S259 E263 N264	E258-L261 PolarHBondContact O-N 3.43Å; E258-L261 VanDerWaalsContact O-N 3.16Å; S259-L261 PolarHBondContact O-N 2.86Å; L261-E263 VanDerWaalsContact C-N 3.32Å; L261-E263 PolarHBondContact O-N 3.11Å; L261-N264 PolarHBondContact O-N 3.46Å
262	E	42.8	Very low	45.3	Very low	126 Å²	126	98.1 Å²	98.1	59%	0.589	52%	0.524	S	S	*	.	H	α-helix	trans	-66.1	-29.1	175.7	-74	173	163.6	0	0	113.2	E258 S259 P265 K334	E258-E262 PolarHBondContact O-N 2.99Å; S259-E262 PolarHBondContact O-N 3.2Å; E262-P265 WeakPolarHBondContact O-CD 3.47Å; E262-K334 IonicContact OE1-NZ 3.8Å; E262-K334 PolarHBondContact OE1-NZ 3.03Å; E262-K334 IonicContact OE2-NZ 2.89Å; E262-K334 PolarHBondContact OE2-NZ 3.09Å
263	E	33.5	Very low	43.2	Very low	161 Å²	161	105 Å²	105	75%	0.752	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-10.2	179.8	-77.4	-171.7	160.7	0	0	115.5	S259 L261	S259-E263 PolarHBondContact O-N 3.16Å; S259-E263 VanDerWaalsContact O-N 3.13Å; L261-E263 VanDerWaalsContact C-N 3.32Å; L261-E263 PolarHBondContact O-N 3.11Å
264	N	35.7	Very low	41.1	Very low	87 Å²	87	113.6 Å²	113.6	47%	0.465	59%	0.594	S	S	.	*			trans	-137.8	38.4	-170.1	-158.1	37.6	0	0	0	117.9	L261	L261-N264 PolarHBondContact O-N 3.46Å
265	P	34.8	Very low	39.3	Very low	91 Å²	91	120.8 Å²	120.8	59%	0.591	63%	0.632	S	S	*	*	S	Bend	trans	-69	-30.1	175.5	29.2	-34.8	0	0	0	113.4	E262 K267	E262-P265 WeakPolarHBondContact O-CD 3.47Å; P265-K267 PolarHBondContact O-N 3.35Å
266	E	36.8	Very low	37.8	Very low	178 Å²	178	128 Å²	128	83%	0.832	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-77.8	-20.6	-169.8	-62.4	-168.6	150.7	0	0	114.6
267	K	39.3	Very low	36.8	Very low	173 Å²	173	127.7 Å²	127.7	75%	0.752	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-87.4	-12.5	179	-75.6	-174.2	174.8	176	0	114.7	P265 F269	P265-K267 PolarHBondContact O-N 3.35Å; K267-F269 VanDerWaalsContact C-N 3.31Å; K267-F269 PolarHBondContact O-N 2.78Å
268	A	37.8	Very low	35.8	Very low	90 Å²	90	135.1 Å²	135.1	74%	0.744	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-82.3	-4.6	-177.6	0	0	0	0	0	114.2
269	F	32.9	Very low	34.6	Very low	166 Å²	166	135.8 Å²	135.8	73%	0.728	73%	0.727	S	S	*	*	S	Bend	trans	-112.3	-16.1	-168.2	-165.9	-105.5	0	0	0	115.5	K267	K267-F269 VanDerWaalsContact C-N 3.31Å; K267-F269 PolarHBondContact O-N 2.78Å
270	Y	38.9	Very low	34.4	Very low	198 Å²	198	139.9 Å²	139.9	78%	0.776	75%	0.752	S	S	*	*			trans	-126.2	51.9	177.8	-85.9	-79.1	0	0	0	111.9
271	G	31.3	Very low	33.8	Very low	72 Å²	72	138.5 Å²	138.5	74%	0.742	76%	0.764	S	S	*	*			trans	-97.9	56.1	167.9	0	0	0	0	0	111.6
272	S	30.4	Very low	33	Very low	104 Å²	104	138 Å²	138	73%	0.727	77%	0.772	S	S	*	*			trans	-68.4	132.5	-179.1	51.9	0	0	0	0	112
273	E	35.1	Very low	32.6	Very low	195 Å²	195	141.2 Å²	141.2	91%	0.911	79%	0.787	S	S	*	*			trans	-71.1	120.9	176.2	-55.7	174.5	129.2	0	0	111.1
274	E	30.2	Very low	32.2	Very low	192 Å²	192	143 Å²	143	90%	0.897	80%	0.796	S	S	*	*			trans	-140.9	141.7	156	-78.4	-160.6	154.1	0	0	110.4
275	D	30.2	Very low	31.7	Very low	165 Å²	165	143.2 Å²	143.2	88%	0.882	81%	0.81	S	S	*	*			trans	-49.7	161.7	-162.6	-74.2	-64.7	0	0	0	120.4
276	E	32.8	Very low	31.6	Very low	189 Å²	189	143.9 Å²	143.9	88%	0.883	82%	0.823	S	S	*	*			trans	-61.1	144.5	161.6	-67.1	-160.7	157.8	0	0	112.9
277	A	34.3	Very low	31.2	Very low	83 Å²	83	142.1 Å²	142.1	69%	0.686	82%	0.824	S	S	*	*				163	122.3	101.6	0	0	0	0	0	113.3
278	K	26.9	Very low	30.7	Very low	214 Å²	214	138.5 Å²	138.5	93%	0.93	83%	0.827	S	S	*	*			trans	175.6	135.2	135.2	-102.1	157.1	-171.4	165.3	0	114.7
279	G	24.2	Very low	30.3	Very low	72 Å²	72	139 Å²	139	74%	0.742	83%	0.83	S	S	*	*			trans	89	135.5	130.2	0	0	0	0	0	117.1
280	P	34.3	Very low	30.2	Very low	138 Å²	138	138.9 Å²	138.9	90%	0.896	84%	0.837	S	S	*	*			trans	-96.6	151.3	-179.3	36.6	-33.9	0	0	0	113.9
281	G	26.1	Very low	30.1	Very low	80 Å²	80	134.5 Å²	134.5	83%	0.825	83%	0.833	S	S	*	*			trans	114.6	87	137.7	0	0	0	0	0	118.9
282	S	25	Very low	30.4	Very low	123 Å²	123	136.1 Å²	136.1	86%	0.86	84%	0.839	S	S	*	*			trans	-160.2	127.4	138.4	56.2	0	0	0	0	109.8
283	E	33	Very low	30.6	Very low	195 Å²	195	141.5 Å²	141.5	91%	0.911	84%	0.843	S	S	*	*			trans	-81.3	138.6	178.8	-57	172.7	123.2	0	0	111
284	E	26	Very low	30.5	Very low	198 Å²	198	141 Å²	141	93%	0.925	84%	0.838	S	S	*	*			trans	-153.7	162.6	155.5	-129.5	169.1	-142.1	0	0	113.3
285	A	25.8	Very low	31.2	Very low	92 Å²	92	137.4 Å²	137.4	76%	0.76	83%	0.831	S	S	*	*			trans	-48.8	147.2	-157.1	0	0	0	0	0	118.9
286	A	33.3	Very low	32.3	Very low	105 Å²	105	133.1 Å²	133.1	87%	0.868	80%	0.803	S	S	*	*			trans	-62.4	135	179.6	0	0	0	0	0	114.5
287	T	26.7	Very low	33.6	Very low	140 Å²	140	130.4 Å²	130.4	86%	0.859	80%	0.8	S	S	*	*			trans	-120.8	135.6	149.4	48.9	0	0	0	0	108.6
288	A	29.5	Very low	35.3	Very low	97 Å²	97	127.7 Å²	127.7	80%	0.802	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-78	132.3	-174.5	0	0	0	0	0	111	L290	A288-L290 PolarHBondContact O-N 3.49Å
289	A	29.7	Very low	37.8	Very low	100 Å²	100	118.9 Å²	118.9	83%	0.826	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-64.1	124.2	178.5	0	0	0	0	0	111.3
290	L	30.1	Very low	40.5	Very low	165 Å²	165	120.4 Å²	120.4	86%	0.864	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-70.7	131.6	171.7	-73	167.9	0	0	0	109.6	A288	A288-L290 PolarHBondContact O-N 3.49Å
291	P	38.3	Very low	42.9	Very low	106 Å²	106	114.2 Å²	114.2	69%	0.688	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-69.8	140.3	179.4	28.7	-34.5	0	0	0	110.9	R293	P291-R293 PolarHBondContact O-N 2.96Å
292	A	36	Very low	45.8	Very low	106 Å²	106	110.4 Å²	110.4	88%	0.876	65%	0.653	S	S	*	*			trans	-57.1	111.1	176.4	0	0	0	0	0	110.6
293	R	35.5	Very low	48.8	Very low	217 Å²	217	110.5 Å²	110.5	82%	0.819	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-73.5	128.5	-178.6	-73.3	-176.7	169.4	-171.9	-5.2	110	P291	P291-R293 PolarHBondContact O-N 2.96Å
294	K	33.7	Very low	51.4	Low	184 Å²	184	102.3 Å²	102.3	80%	0.8	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-61.9	153	178.3	-63.8	177.7	-179.7	177.8	0	111
295	P	44	Very low	54.5	Low	116 Å²	116	92.9 Å²	92.9	75%	0.753	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-52.1	142	169.9	-25.9	34.9	0	0	0	111.8	V297	P295-V297 PolarHBondContact O-N 3.08Å; P295-V297 VanDerWaalsContact O-N 3.07Å
296	Y	53.3	Low	57.6	Low	76 Å²	76	88.6 Å²	88.6	30%	0.298	52%	0.517	S	S	.	.			trans	-71.2	104.9	-178.4	174.7	-100.8	0	0	0	110.6	L252 P254 M298	L252-Y296 HydrophobicContact CB-CE2 4.27Å; L252-Y296 PolarHBondContact O-OH 3.19Å; P254-Y296 HydrophobicContact CB-CE1 3.96Å; P254-Y296 HydrophobicContact CG-CE1 4.47Å; Y296-M298 HydrophobicContact CD1-CB 4.26Å; Y296-M298 HydrophobicContact CE1-CB 3.6Å; Y296-M298 HydrophobicContact CE1-CG 3.79Å
297	V	59.7	Low	60.3	Low	132 Å²	132	91.2 Å²	91.2	80%	0.8	50%	0.504	S	S	*	.			trans	-85.6	111.6	167.3	-177.9	0	0	0	0	107.7	P295	P295-V297 PolarHBondContact O-N 3.08Å; P295-V297 VanDerWaalsContact O-N 3.07Å
298	M	70.4	Confident	63.4	Low	26 Å²	26	85.3 Å²	85.3	13%	0.128	47%	0.468	C	S	.	.			trans	-68.4	132.9	-177.7	-166.9	-96.5	-156.2	0	0	111.1	Y296 H302 R303 L306	Y296-M298 HydrophobicContact CD1-CB 4.26Å; Y296-M298 HydrophobicContact CE1-CB 3.6Å; Y296-M298 HydrophobicContact CE1-CG 3.79Å; M298-H302 HydrophobicContact CE-CB 3.77Å; M298-H302 HydrophobicContact SD-CB 3.86Å; M298-R303 HydrophobicContact CE-CB 4.5Å; M298-R303 HydrophobicContact SD-CB 3.65Å; M298-R303 HydrophobicContact SD-CG 4.3Å; M298-R303 PolarHBondContact SD-N 3.19Å; M298-L306 HydrophobicContact CE-CD1 3.58Å; M298-L306 HydrophobicContact CE-CG 4.44Å
299	D	78.8	Confident	66.3	Low	28 Å²	28	80.7 Å²	80.7	15%	0.15	43%	0.429	C	S	.	.			trans	-52.8	127.1	-173.9	-175	-33	0	0	0	111.6	F251 D301 H302 R303 R654	F251-D299 HydrophobicContact CD1-CB 3.85Å; F251-D299 VanDerWaalsContact CD1-OD2 3.29Å; F251-D299 WeakPolarHBondContact CD1-OD2 3.44Å; F251-D299 HydrophobicContact CE1-CB 4.08Å; F251-D299 VanDerWaalsContact CE1-OD2 3.27Å; F251-D299 WeakPolarHBondContact CE1-OD2 3.43Å; D299-D301 PolarHBondContact O-N 3.24Å; D299-D301 VanDerWaalsContact O-N 3.14Å; D299-D301 WeakPolarHBondContact OD1-CB 3.37Å; D299-D301 PolarHBondContact OD1-N 3.03Å; D299-H302 HydrophobicContact CB-CB 4.06Å; D299-H302 WeakPolarHBondContact O-CB 3.44Å; D299-H302 PolarHBondContact O-N 2.62Å; D299-R303 PolarHBondContact O-N 3.29Å; D299-R654 IonicContact OD1-NH1 3.94Å; D299-R654 IonicContact OD2-CZ 3.92Å; D299-R654 IonicContact OD2-NH1 3.58Å; D299-R654 PolarHBondContact OD2-NH1 3.36Å
300	P	82.3	Confident	69.3	Low	105 Å²	105	81.1 Å²	81.1	68%	0.682	41%	0.413	S	S	*	.	H	α-helix	trans	-51.3	-34.5	177.1	-28.9	36	0	0	0	114.7	R303 L304	P300-R303 PolarHBondContact O-N 2.86Å; P300-L304 WeakPolarHBondContact O-CB 3.38Å; P300-L304 PolarHBondContact O-N 3.22Å
301	D	83.9	Confident	72.3	Confident	8 Å²	8	76.4 Å²	76.4	4%	0.043	39%	0.392	C	S	.	.	H	α-helix	trans	-73.5	-35.1	177.3	-84	-30	0	0	0	112.3	Y221 R222 F251 D299 L304 L305 R654	Y221-D301 HydrophobicContact CD1-CB 4.33Å; Y221-D301 HydrophobicContact CE1-CB 3.78Å; Y221-D301 PolarHBondContact OH-O 3.09Å; R222-D301 WeakPolarHBondContact CG-OD1 3.49Å; R222-D301 IonicContact CZ-OD1 2.71Å; R222-D301 IonicContact CZ-OD2 3.08Å; R222-D301 IonicContact NE-OD1 3.16Å; R222-D301 PolarHBondContact NE-OD1 3.43Å; R222-D301 IonicContact NE-OD2 2.69Å; R222-D301 PolarHBondContact NE-OD2 3.21Å; R222-D301 IonicContact NH2-OD1 2.76Å; R222-D301 IonicContact NH2-OD2 2.96Å; R222-D301 PolarHBondContact NH2-OD2 3.32Å; F251-D301 HydrophobicContact CE1-CB 4.03Å; F251-D301 HydrophobicContact CZ-CB 4.09Å; D299-D301 PolarHBondContact O-N 3.24Å; D299-D301 VanDerWaalsContact O-N 3.14Å; D299-D301 WeakPolarHBondContact OD1-CB 3.37Å; D299-D301 PolarHBondContact OD1-N 3.03Å; D301-L304 WeakPolarHBondContact O-CB 3.17Å; D301-L304 PolarHBondContact O-N 3.32Å; D301-L305 PolarHBondContact O-N 2.99Å; D301-R654 WeakPolarHBondContact OD2-CD 3.49Å
302	H	86.1	Confident	74.9	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-67.6	-39.8	171.4	-166.7	176.8	0	0	0	110.3	F251 M298 D299 L304 L305 L306	F251-H302 HydrophobicContact CD1-CB 3.83Å; F251-H302 HydrophobicContact CD2-CB 3.9Å; F251-H302 AromaticContact CD2-CG 3.75Å; F251-H302 AromaticContact CD2-ND1 3.89Å; F251-H302 HydrophobicContact CE1-CB 3.8Å; F251-H302 HydrophobicContact CE2-CB 3.92Å; F251-H302 HydrophobicContact CG-CB 3.87Å; F251-H302 AromaticContact CG-CG 3.93Å; F251-H302 AromaticContact CG-ND1 3.81Å; F251-H302 HydrophobicContact CZ-CB 3.87Å; M298-H302 HydrophobicContact CE-CB 3.77Å; M298-H302 HydrophobicContact SD-CB 3.86Å; D299-H302 HydrophobicContact CB-CB 4.06Å; D299-H302 WeakPolarHBondContact O-CB 3.44Å; D299-H302 PolarHBondContact O-N 2.62Å; H302-L304 VanDerWaalsContact C-N 3.34Å; H302-L304 PolarHBondContact O-N 2.98Å; H302-L305 PolarHBondContact O-N 2.74Å; H302-L306 PolarHBondContact O-N 2.92Å
303	R	87.9	Confident	77.6	Confident	124 Å²	124	67.2 Å²	67.2	47%	0.468	32%	0.322	S	S	.	.	H	α-helix	trans	-68.8	-31.2	176.4	-157.7	154.6	-175.8	70.7	-0.5	112.5	M298 D299 P300 R307 E336	M298-R303 HydrophobicContact CE-CB 4.5Å; M298-R303 HydrophobicContact SD-CB 3.65Å; M298-R303 HydrophobicContact SD-CG 4.3Å; M298-R303 PolarHBondContact SD-N 3.19Å; D299-R303 PolarHBondContact O-N 3.29Å; P300-R303 PolarHBondContact O-N 2.86Å; R303-R307 VanDerWaalsContact O-CB 3.28Å; R303-R307 WeakPolarHBondContact O-CB 3.37Å; R303-R307 PolarHBondContact O-N 3.15Å; R303-E336 IonicContact CZ-OE1 3.97Å; R303-E336 VanDerWaalsContact CZ-OE1 3.29Å; R303-E336 IonicContact NH1-OE1 3.25Å; R303-E336 PolarHBondContact NH1-OE1 2.94Å; R303-E336 IonicContact NH1-OE2 2.76Å; R303-E336 IonicContact NH2-OE1 3.5Å; R303-E336 PolarHBondContact NH2-OE1 2.76Å
304	L	88.8	Confident	80.3	Confident	23 Å²	23	64.8 Å²	64.8	12%	0.12	32%	0.32	C	S	.	.	H	α-helix	trans	-60.2	-46.3	172.2	178.1	64	0	0	0	111.7	R222 C225 P300 D301 H302 R307 N308	R222-L304 HydrophobicContact CB-CD2 4.18Å; R222-L304 HydrophobicContact CG-CD2 4.03Å; C225-L304 HydrophobicContact CB-CD2 4.27Å; C225-L304 HydrophobicContact CB-CG 4.24Å; P300-L304 WeakPolarHBondContact O-CB 3.38Å; P300-L304 PolarHBondContact O-N 3.22Å; D301-L304 WeakPolarHBondContact O-CB 3.17Å; D301-L304 PolarHBondContact O-N 3.32Å; H302-L304 VanDerWaalsContact C-N 3.34Å; H302-L304 PolarHBondContact O-N 2.98Å; L304-R307 PolarHBondContact O-N 3.41Å; L304-N308 WeakPolarHBondContact O-CB 3.35Å; L304-N308 VanDerWaalsContact O-CG 3.32Å; L304-N308 PolarHBondContact O-N 3.08Å; L304-N308 PolarHBondContact O-OD1 3.29Å
305	L	90.4	Very high	83.1	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-47.4	178.5	175.7	58.6	0	0	0	112.3	Y221 L243 A247 D301 H302 T309 L327 L331	Y221-L305 WeakPolarHBondContact OH-CB 3.19Å; Y221-L305 WeakPolarHBondContact OH-CD2 2.95Å; L243-L305 HydrophobicContact CB-CD1 4.17Å; L243-L305 HydrophobicContact CB-CD2 4.29Å; L243-L305 HydrophobicContact CD1-CD1 3.85Å; A247-L305 HydrophobicContact CB-CD2 4.19Å; D301-L305 PolarHBondContact O-N 2.99Å; H302-L305 PolarHBondContact O-N 2.74Å; L305-T309 HydrophobicContact CD1-CG2 4.04Å; L305-T309 WeakPolarHBondContact O-CB 3.13Å; L305-T309 WeakPolarHBondContact O-CG2 3.42Å; L305-T309 PolarHBondContact O-N 3.44Å; L305-T309 VanDerWaalsContact O-N 3.07Å; L305-T309 PolarHBondContact O-OG1 3.34Å; L305-L327 HydrophobicContact CD1-CD2 4.42Å; L305-L327 HydrophobicContact CD2-CD1 4.22Å; L305-L327 HydrophobicContact CG-CD2 4.41Å; L305-L331 HydrophobicContact CD2-CD1 4.21Å
306	L	90.6	Very high	85.3	Confident	1 Å²	1	63 Å²	63	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-64.9	-43.7	176.5	-63	-178.5	0	0	0	111.5	M298 H302 N308 T309 K310 Y328 A332	M298-L306 HydrophobicContact CE-CD1 3.58Å; M298-L306 HydrophobicContact CE-CG 4.44Å; H302-L306 PolarHBondContact O-N 2.92Å; L306-N308 PolarHBondContact O-N 3.04Å; L306-T309 PolarHBondContact O-N 3.02Å; L306-T309 PolarHBondContact O-OG1 3.33Å; L306-K310 PolarHBondContact O-N 3.44Å; L306-Y328 HydrophobicContact CD2-CD2 4.4Å; L306-Y328 HydrophobicContact CD2-CE2 4.27Å; L306-Y328 PolarHBondContact O-OH 2.81Å; L306-Y328 VanDerWaalsContact O-OH 3.05Å; L306-A332 HydrophobicContact CD1-CB 3.82Å; L306-A332 HydrophobicContact CD2-CB 4.03Å
307	R	90.7	Very high	87.2	Confident	161 Å²	161	60.6 Å²	60.6	61%	0.608	29%	0.291	S	S	*	.	H	α-helix	trans	-58.8	-45.8	178.6	-173.6	-174	70.8	-178.8	2.5	112.2	R303 L304	R303-R307 VanDerWaalsContact O-CB 3.28Å; R303-R307 WeakPolarHBondContact O-CB 3.37Å; R303-R307 PolarHBondContact O-N 3.15Å; L304-R307 PolarHBondContact O-N 3.41Å
308	N	90.8	Very high	88.8	Confident	16 Å²	16	55.4 Å²	55.4	9%	0.086	26%	0.262	C	S	.	.	H	α-helix	trans	-80.2	-21.5	-174.6	-66.7	12.5	0	0	0	112.9	C225 N226 L304 L306 P311	C225-N308 WeakPolarHBondContact O-CB 3.49Å; C225-N308 PolarHBondContact O-ND2 3.11Å; N226-N308 PolarHBondContact OD1-ND2 3.37Å; L304-N308 WeakPolarHBondContact O-CB 3.35Å; L304-N308 VanDerWaalsContact O-CG 3.32Å; L304-N308 PolarHBondContact O-N 3.08Å; L304-N308 PolarHBondContact O-OD1 3.29Å; L306-N308 PolarHBondContact O-N 3.04Å; N308-P311 WeakPolarHBondContact O-CD 3.39Å
309	T	92.2	Very high	89.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-85.3	-23.6	173.2	52.4	0	0	0	0	113.5	L228 I240 L305 L306 P311 L312 L327	L228-T309 HydrophobicContact CD2-CG2 3.63Å; I240-T309 HydrophobicContact CG1-CG2 4.46Å; L305-T309 HydrophobicContact CD1-CG2 4.04Å; L305-T309 WeakPolarHBondContact O-CB 3.13Å; L305-T309 WeakPolarHBondContact O-CG2 3.42Å; L305-T309 PolarHBondContact O-N 3.44Å; L305-T309 VanDerWaalsContact O-N 3.07Å; L305-T309 PolarHBondContact O-OG1 3.34Å; L306-T309 PolarHBondContact O-N 3.02Å; L306-T309 PolarHBondContact O-OG1 3.33Å; T309-P311 VanDerWaalsContact C-CD 3.41Å; T309-L312 VanDerWaalsContact O-CB 3.32Å; T309-L312 WeakPolarHBondContact O-CB 3.46Å; T309-L312 PolarHBondContact O-N 2.97Å; T309-L327 HydrophobicContact CG2-CD2 3.53Å
310	K	92.7	Very high	90.6	Very high	109 Å²	109	54.9 Å²	54.9	47%	0.474	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-49.3	-41.5	178	-167	172.6	-179.2	172.7	0	115.4	L306 L312 Y328	L306-K310 PolarHBondContact O-N 3.44Å; K310-L312 VanDerWaalsContact C-N 3.3Å; K310-L312 PolarHBondContact O-N 2.88Å; K310-Y328 WeakPolarHBondContact CB-OH 3.48Å
311	P	92.9	Very high	91.2	Very high	65 Å²	65	49.9 Å²	49.9	42%	0.422	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-65.9	-30.9	177.5	-20.8	34.5	0	0	0	113.2	I229 N308 T309 L313 Q314	I229-P311 HydrophobicContact CD1-CG 4.43Å; N308-P311 WeakPolarHBondContact O-CD 3.39Å; T309-P311 VanDerWaalsContact C-CD 3.41Å; P311-L313 PolarHBondContact O-N 3.15Å; P311-L313 VanDerWaalsContact O-N 3.16Å; P311-Q314 WeakPolarHBondContact O-CB 3.47Å; P311-Q314 PolarHBondContact O-N 3.26Å
312	L	92.8	Very high	91.6	Very high	11 Å²	11	50.4 Å²	50.4	6%	0.058	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-67.8	-16	-175.8	-57.3	177.1	0	0	0	112.9	L228 I240 T309 K310 Q314 S315 V320 V324	L228-L312 HydrophobicContact CD2-CD1 3.75Å; L228-L312 HydrophobicContact CG-CD1 3.86Å; I240-L312 HydrophobicContact CD1-CD1 4.13Å; T309-L312 VanDerWaalsContact O-CB 3.32Å; T309-L312 WeakPolarHBondContact O-CB 3.46Å; T309-L312 PolarHBondContact O-N 2.97Å; K310-L312 VanDerWaalsContact C-N 3.3Å; K310-L312 PolarHBondContact O-N 2.88Å; L312-Q314 PolarHBondContact O-N 2.71Å; L312-S315 VanDerWaalsContact O-CB 3.26Å; L312-S315 WeakPolarHBondContact O-CB 3.26Å; L312-S315 PolarHBondContact O-N 3.24Å; L312-S315 PolarHBondContact O-OG 3.29Å; L312-V320 HydrophobicContact CB-CG1 3.93Å; L312-V324 HydrophobicContact CB-CG2 3.81Å; L312-V324 HydrophobicContact CD1-CG2 4.44Å
313	L	92.7	Very high	91.9	Very high	9 Å²	9	50.7 Å²	50.7	5%	0.047	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-61.3	-15.9	166.4	-68.4	174	0	0	0	113.4	P311 V321 V324 V339 I340 A343 R346	P311-L313 PolarHBondContact O-N 3.15Å; P311-L313 VanDerWaalsContact O-N 3.16Å; L313-V321 HydrophobicContact CD2-CG1 4.47Å; L313-V324 HydrophobicContact CD1-CG1 4.47Å; L313-V324 HydrophobicContact CD2-CB 3.91Å; L313-V324 HydrophobicContact CD2-CG1 3.61Å; L313-V324 HydrophobicContact CG-CB 4.43Å; L313-V324 HydrophobicContact CG-CG1 3.74Å; L313-V339 HydrophobicContact CD1-CG1 3.89Å; L313-I340 HydrophobicContact CD1-CG2 4.34Å; L313-I340 HydrophobicContact CD2-CG2 4.34Å; L313-A343 HydrophobicContact CB-CB 4.04Å; L313-A343 HydrophobicContact CD2-CB 4Å; L313-R346 PolarHBondContact O-NH2 3Å
314	Q	92.3	Very high	92.2	Very high	166 Å²	166	44.8 Å²	44.8	78%	0.776	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-95.6	-2.2	174.4	-54.8	-170.1	9	0	0	113.6	P311 L312	P311-Q314 WeakPolarHBondContact O-CB 3.47Å; P311-Q314 PolarHBondContact O-N 3.26Å; L312-Q314 PolarHBondContact O-N 2.71Å
315	S	92	Very high	92.3	Very high	22 Å²	22	43.7 Å²	43.7	15%	0.154	21%	0.21	C	C	.	.			trans	-60.6	158.1	-178.4	62.8	0	0	0	0	113.4	L312 S317 V320 V321 R346	L312-S315 VanDerWaalsContact O-CB 3.26Å; L312-S315 WeakPolarHBondContact O-CB 3.26Å; L312-S315 PolarHBondContact O-N 3.24Å; L312-S315 PolarHBondContact O-OG 3.29Å; S315-S317 PolarHBondContact OG-O 3.45Å; S315-V320 WeakPolarHBondContact OG-CG1 2.98Å; S315-V321 WeakPolarHBondContact OG-CG2 3.32Å; S315-R346 PolarHBondContact O-NH1 3.32Å; S315-R346 PolarHBondContact O-NH2 3.2Å
316	R	90.1	Very high	92.4	Very high	239 Å²	239	44.9 Å²	44.9	90%	0.902	22%	0.216	S	C	*	.	S	Bend	trans	-74.5	-39.3	177.2	-65.4	-177.6	-179.4	-177.1	0.4	111.3	A318	R316-A318 PolarHBondContact O-N 3.06Å
317	S	92.9	Very high	92.4	Very high	27 Å²	27	44.9 Å²	44.9	19%	0.189	22%	0.215	C	C	.	.			trans	-67	119.6	178.2	-170.4	0	0	0	0	113.3	E233 S315 A319 V320 V321	E233-S317 VanDerWaalsContact CD-CB 3.44Å; E233-S317 WeakPolarHBondContact OE1-CB 3.44Å; E233-S317 WeakPolarHBondContact OE2-CB 3.29Å; S315-S317 PolarHBondContact OG-O 3.45Å; S317-A319 PolarHBondContact O-N 3.2Å; S317-V320 PolarHBondContact O-N 3.37Å; S317-V321 WeakPolarHBondContact O-CG2 3.16Å; S317-V321 PolarHBondContact O-N 2.73Å
318	A	93.3	Very high	92.4	Very high	23 Å²	23	37.2 Å²	37.2	19%	0.19	19%	0.187	C	C	.	.	H	α-helix	trans	-61.9	-32.4	175.3	0	0	0	0	0	112.5	R316 V321 M322 L347 V354	R316-A318 PolarHBondContact O-N 3.06Å; A318-V321 PolarHBondContact O-N 2.92Å; A318-M322 WeakPolarHBondContact O-CB 3.36Å; A318-M322 WeakPolarHBondContact O-CG 3.29Å; A318-M322 PolarHBondContact O-N 3.46Å; A318-L347 HydrophobicContact CB-CD1 4.29Å; A318-L347 HydrophobicContact CB-CD2 3.96Å; A318-V354 HydrophobicContact CB-CG1 3.61Å; A318-V354 HydrophobicContact CB-CG2 4.38Å
319	A	92.6	Very high	92.3	Very high	43 Å²	43	37.1 Å²	37.1	36%	0.355	19%	0.185	S	C	.	.	H	α-helix	trans	-64.8	-43.3	179.4	0	0	0	0	0	112	V237 S317 M322 A323	V237-A319 HydrophobicContact CG2-CB 3.9Å; S317-A319 PolarHBondContact O-N 3.2Å; A319-M322 PolarHBondContact O-N 2.87Å; A319-A323 WeakPolarHBondContact O-CB 3.3Å; A319-A323 PolarHBondContact O-N 3.29Å
320	V	94.3	Very high	92.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.6	-48.7	175.4	175.3	0	0	0	0	110.6	E233 Q236 V237 L312 S315 S317 M322 A323 V324	E233-V320 HydrophobicContact CB-CG2 4.04Å; Q236-V320 HydrophobicContact CB-CG2 4.16Å; Q236-V320 VanDerWaalsContact OE1-CG1 3.29Å; V237-V320 HydrophobicContact CG2-CG2 3.98Å; L312-V320 HydrophobicContact CB-CG1 3.93Å; S315-V320 WeakPolarHBondContact OG-CG1 2.98Å; S317-V320 PolarHBondContact O-N 3.37Å; V320-M322 VanDerWaalsContact C-N 3.29Å; V320-M322 PolarHBondContact O-N 2.57Å; V320-A323 PolarHBondContact O-N 2.87Å; V320-V324 VanDerWaalsContact O-CG2 3.32Å; V320-V324 WeakPolarHBondContact O-CG2 3.14Å; V320-V324 PolarHBondContact O-N 2.71Å
321	V	94.4	Very high	91.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.3	-40.4	178.1	179.2	0	0	0	0	111.5	L313 S315 S317 A318 V324 A325 A343 R346 L347	L313-V321 HydrophobicContact CD2-CG1 4.47Å; S315-V321 WeakPolarHBondContact OG-CG2 3.32Å; S317-V321 WeakPolarHBondContact O-CG2 3.16Å; S317-V321 PolarHBondContact O-N 2.73Å; A318-V321 PolarHBondContact O-N 2.92Å; V321-V324 PolarHBondContact O-N 2.94Å; V321-A325 WeakPolarHBondContact O-CB 3.39Å; V321-A325 PolarHBondContact O-N 2.88Å; V321-A343 HydrophobicContact CG1-CB 3.93Å; V321-R346 VanDerWaalsContact CG2-NH2 3.34Å; V321-L347 HydrophobicContact CB-CD1 4Å; V321-L347 HydrophobicContact CB-CD2 4.43Å; V321-L347 HydrophobicContact CG1-CD1 3.78Å; V321-L347 HydrophobicContact CG1-CG 4.2Å; V321-L347 HydrophobicContact CG2-CD2 4.43Å
322	M	92.5	Very high	91.4	Very high	19 Å²	19	30.3 Å²	30.3	9%	0.094	15%	0.15	C	C	.	.	H	α-helix	trans	-66.7	-43.8	176.8	-77	-56.1	-52.9	0	0	112.7	A318 A319 V320 V324 A325 Q326 L344 L347 V358 N361	A318-M322 WeakPolarHBondContact O-CB 3.36Å; A318-M322 WeakPolarHBondContact O-CG 3.29Å; A318-M322 PolarHBondContact O-N 3.46Å; A319-M322 PolarHBondContact O-N 2.87Å; V320-M322 VanDerWaalsContact C-N 3.29Å; V320-M322 PolarHBondContact O-N 2.57Å; M322-V324 VanDerWaalsContact C-N 3.32Å; M322-V324 PolarHBondContact O-N 3.45Å; M322-A325 PolarHBondContact O-N 2.62Å; M322-A325 VanDerWaalsContact O-N 3.17Å; M322-Q326 WeakPolarHBondContact O-CB 3.41Å; M322-Q326 PolarHBondContact O-N 3.16Å; M322-L344 HydrophobicContact CE-CD2 4.43Å; M322-L344 HydrophobicContact SD-CD2 3.5Å; M322-L344 WeakPolarHBondContact SD-CD2 3.31Å; M322-L347 HydrophobicContact CG-CD1 4.23Å; M322-L347 HydrophobicContact SD-CD1 4.25Å; M322-V358 HydrophobicContact CG-CG2 4.38Å; M322-V358 HydrophobicContact SD-CB 4.49Å; M322-V358 HydrophobicContact SD-CG2 3.81Å; M322-N361 HydrophobicContact CE-CB 3.71Å
323	A	92.7	Very high	91	Very high	5 Å²	5	31 Å²	31	4%	0.041	16%	0.155	C	C	.	.	H	α-helix	trans	-61.1	-40.1	176.2	0	0	0	0	0	111.8	V237 I240 A319 V320 Q326 L327	V237-A323 HydrophobicContact CG1-CB 4.32Å; V237-A323 HydrophobicContact CG2-CB 4.45Å; I240-A323 HydrophobicContact CB-CB 4.2Å; I240-A323 HydrophobicContact CD1-CB 4.39Å; I240-A323 HydrophobicContact CG2-CB 3.87Å; I240-A323 WeakPolarHBondContact CG2-O 3.35Å; A319-A323 WeakPolarHBondContact O-CB 3.3Å; A319-A323 PolarHBondContact O-N 3.29Å; V320-A323 PolarHBondContact O-N 2.87Å; A323-Q326 WeakPolarHBondContact O-CB 3.13Å; A323-Q326 PolarHBondContact O-N 2.86Å; A323-L327 WeakPolarHBondContact O-CB 3.44Å; A323-L327 PolarHBondContact O-N 3.24Å
324	V	93.9	Very high	90.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69.3	-38	174.4	-176.6	0	0	0	0	111.5	I240 L312 L313 V320 V321 M322 Q326 L327 Y328	I240-V324 HydrophobicContact CD1-CG2 3.71Å; L312-V324 HydrophobicContact CB-CG2 3.81Å; L312-V324 HydrophobicContact CD1-CG2 4.44Å; L313-V324 HydrophobicContact CD1-CG1 4.47Å; L313-V324 HydrophobicContact CD2-CB 3.91Å; L313-V324 HydrophobicContact CD2-CG1 3.61Å; L313-V324 HydrophobicContact CG-CB 4.43Å; L313-V324 HydrophobicContact CG-CG1 3.74Å; V320-V324 VanDerWaalsContact O-CG2 3.32Å; V320-V324 WeakPolarHBondContact O-CG2 3.14Å; V320-V324 PolarHBondContact O-N 2.71Å; V321-V324 PolarHBondContact O-N 2.94Å; M322-V324 VanDerWaalsContact C-N 3.32Å; M322-V324 PolarHBondContact O-N 3.45Å; V324-Q326 VanDerWaalsContact C-N 3.34Å; V324-Q326 PolarHBondContact O-N 2.78Å; V324-L327 WeakPolarHBondContact O-CB 3.29Å; V324-L327 PolarHBondContact O-N 2.91Å; V324-Y328 HydrophobicContact CG1-CD2 3.66Å; V324-Y328 HydrophobicContact CG1-CE2 3.81Å; V324-Y328 WeakPolarHBondContact O-CB 3.39Å; V324-Y328 WeakPolarHBondContact O-CD2 3.48Å; V324-Y328 PolarHBondContact O-N 3.3Å
325	A	92.5	Very high	89.7	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64	-39.4	175.9	0	0	0	0	0	112.2	V321 M322 F329 I340 L344 M365	V321-A325 WeakPolarHBondContact O-CB 3.39Å; V321-A325 PolarHBondContact O-N 2.88Å; M322-A325 PolarHBondContact O-N 2.62Å; M322-A325 VanDerWaalsContact O-N 3.17Å; A325-F329 VanDerWaalsContact O-CB 3.24Å; A325-F329 WeakPolarHBondContact O-CB 3.16Å; A325-F329 PolarHBondContact O-N 2.85Å; A325-I340 HydrophobicContact CB-CB 4.35Å; A325-I340 HydrophobicContact CB-CD1 4.22Å; A325-L344 HydrophobicContact CB-CD1 4.34Å; A325-L344 HydrophobicContact CB-CD2 3.84Å; A325-L344 HydrophobicContact CB-CG 4.29Å; A325-M365 HydrophobicContact CB-CE 4.38Å
326	Q	90.8	Very high	89.1	Confident	27 Å²	27	31.2 Å²	31.2	13%	0.126	17%	0.167	C	C	.	.	H	α-helix	trans	-62.2	-50	171.8	172.2	-174.3	-11.6	0	0	111.4	M322 A323 V324 Y328 F329 H330 Q623 L624	M322-Q326 WeakPolarHBondContact O-CB 3.41Å; M322-Q326 PolarHBondContact O-N 3.16Å; A323-Q326 WeakPolarHBondContact O-CB 3.13Å; A323-Q326 PolarHBondContact O-N 2.86Å; V324-Q326 VanDerWaalsContact C-N 3.34Å; V324-Q326 PolarHBondContact O-N 2.78Å; Q326-Y328 PolarHBondContact O-N 2.9Å; Q326-F329 PolarHBondContact O-N 2.84Å; Q326-H330 PolarHBondContact O-CD2 2.86Å; Q326-H330 PolarHBondContact O-N 2.89Å; Q326-Q623 HydrophobicContact CG-CG 4.47Å; Q326-Q623 VanDerWaalsContact NE2-CD 3.26Å; Q326-L624 WeakPolarHBondContact CG-O 3.25Å; Q326-L624 PolarHBondContact NE2-O 2.95Å; Q326-L624 PolarHBondContact OE1-O 3.35Å
327	L	91.6	Very high	88.8	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-53	-53.5	174.2	-178.9	80.9	0	0	0	111.5	I240 T244 L305 T309 A323 V324 F329 H330 L331	I240-L327 HydrophobicContact CG2-CB 3.97Å; I240-L327 HydrophobicContact CG2-CD1 4.33Å; I240-L327 HydrophobicContact CG2-CD2 4.28Å; I240-L327 HydrophobicContact CG2-CG 4.43Å; T244-L327 HydrophobicContact CG2-CD1 4.4Å; T244-L327 WeakPolarHBondContact OG1-CD1 3.45Å; L305-L327 HydrophobicContact CD1-CD2 4.42Å; L305-L327 HydrophobicContact CD2-CD1 4.22Å; L305-L327 HydrophobicContact CG-CD2 4.41Å; T309-L327 HydrophobicContact CG2-CD2 3.53Å; A323-L327 WeakPolarHBondContact O-CB 3.44Å; A323-L327 PolarHBondContact O-N 3.24Å; V324-L327 WeakPolarHBondContact O-CB 3.29Å; V324-L327 PolarHBondContact O-N 2.91Å; L327-F329 PolarHBondContact O-N 2.74Å; L327-H330 PolarHBondContact O-N 3.49Å; L327-L331 HydrophobicContact CD1-CD1 3.38Å; L327-L331 HydrophobicContact CD1-CG 4.36Å; L327-L331 HydrophobicContact CG-CD1 4.01Å; L327-L331 VanDerWaalsContact O-CB 3.29Å; L327-L331 WeakPolarHBondContact O-CB 3.41Å; L327-L331 WeakPolarHBondContact O-CG 3.46Å; L327-L331 PolarHBondContact O-N 2.95Å
328	Y	90.7	Very high	88.4	Confident	1 Å²	1	20.4 Å²	20.4	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-62.4	-41.7	179.1	-94.7	-101.4	0	0	0	112.6	L306 K310 V324 Q326 H330 A332 I340	L306-Y328 HydrophobicContact CD2-CD2 4.4Å; L306-Y328 HydrophobicContact CD2-CE2 4.27Å; L306-Y328 PolarHBondContact O-OH 2.81Å; L306-Y328 VanDerWaalsContact O-OH 3.05Å; K310-Y328 WeakPolarHBondContact CB-OH 3.48Å; V324-Y328 HydrophobicContact CG1-CD2 3.66Å; V324-Y328 HydrophobicContact CG1-CE2 3.81Å; V324-Y328 WeakPolarHBondContact O-CB 3.39Å; V324-Y328 WeakPolarHBondContact O-CD2 3.48Å; V324-Y328 PolarHBondContact O-N 3.3Å; Q326-Y328 PolarHBondContact O-N 2.9Å; Y328-H330 VanDerWaalsContact C-N 3.34Å; Y328-H330 PolarHBondContact O-N 2.83Å; Y328-A332 HydrophobicContact CD1-CB 3.74Å; Y328-A332 HydrophobicContact CE1-CB 4.31Å; Y328-A332 HydrophobicContact CG-CB 4.29Å; Y328-A332 WeakPolarHBondContact O-CB 3.48Å; Y328-A332 PolarHBondContact O-N 2.93Å; Y328-I340 HydrophobicContact CD1-CG2 4.12Å; Y328-I340 HydrophobicContact CG-CG2 3.82Å
329	F	88.8	Confident	88.1	Confident	14 Å²	14	22.2 Å²	22.2	6%	0.061	14%	0.143	C	C	.	.	H	α-helix	trans	-65.5	-35.8	179.6	-175.8	-97.6	0	0	0	112.9	A325 Q326 L327 M365 K368 L624	A325-F329 VanDerWaalsContact O-CB 3.24Å; A325-F329 WeakPolarHBondContact O-CB 3.16Å; A325-F329 PolarHBondContact O-N 2.85Å; Q326-F329 PolarHBondContact O-N 2.84Å; L327-F329 PolarHBondContact O-N 2.74Å; F329-M365 HydrophobicContact CB-CE 4.05Å; F329-M365 HydrophobicContact CD2-CB 4.42Å; F329-M365 HydrophobicContact CD2-CE 4.25Å; F329-M365 HydrophobicContact CD2-CG 3.75Å; F329-M365 HydrophobicContact CD2-SD 4.26Å; F329-M365 HydrophobicContact CE2-CB 4.01Å; F329-M365 HydrophobicContact CE2-CG 3.69Å; F329-M365 HydrophobicContact CG-CE 4.19Å; F329-M365 HydrophobicContact CG-CG 4.39Å; F329-M365 HydrophobicContact CZ-CG 4.29Å; F329-K368 HydrophobicContact CE1-CD 4.27Å; F329-K368 HydrophobicContact CZ-CB 4.17Å; F329-K368 HydrophobicContact CZ-CD 3.79Å; F329-L624 HydrophobicContact CD1-CD1 3.88Å; F329-L624 HydrophobicContact CD1-CD2 3.76Å; F329-L624 HydrophobicContact CD1-CG 4.4Å; F329-L624 HydrophobicContact CE1-CD1 3.6Å; F329-L624 HydrophobicContact CE1-CD2 3.79Å; F329-L624 HydrophobicContact CE1-CG 4.37Å; F329-L624 HydrophobicContact CG-CD2 4.16Å; F329-L624 HydrophobicContact CZ-CD2 4.21Å
330	H	87.5	Confident	88	Confident	27 Å²	27	20.2 Å²	20.2	13%	0.125	13%	0.126	C	C	.	.	H	α-helix	trans	-90.5	-20.5	-177.8	-72.9	-70	0	0	0	115	T244 R248 Q326 L327 Y328 L624 L641 W644	T244-H330 HydrophobicContact CG2-CB 4.47Å; R248-H330 PolarHBondContact NE-O 2.83Å; R248-H330 PolarHBondContact NH2-O 3.49Å; Q326-H330 PolarHBondContact O-CD2 2.86Å; Q326-H330 PolarHBondContact O-N 2.89Å; L327-H330 PolarHBondContact O-N 3.49Å; Y328-H330 VanDerWaalsContact C-N 3.34Å; Y328-H330 PolarHBondContact O-N 2.83Å; H330-L624 PolarHBondContact NE2-N 3.29Å; H330-L641 HydrophobicContact CB-CD1 4.13Å; H330-W644 WeakPolarHBondContact O-CZ2 3.39Å
331	L	86.3	Confident	87.9	Confident	3 Å²	3	20.2 Å²	20.2	2%	0.016	13%	0.126	C	C	.	.	H	α-helix	trans	-119.8	-36.1	-174.9	-58.5	-177.3	0	0	0	116	A247 R248 P254 L305 L327 W644	A247-L331 HydrophobicContact CB-CD1 3.44Å; A247-L331 VanDerWaalsContact CB-CD1 3.44Å; A247-L331 HydrophobicContact CB-CD2 3.75Å; A247-L331 HydrophobicContact CB-CG 4.27Å; R248-L331 HydrophobicContact CG-CD2 3.98Å; P254-L331 WeakPolarHBondContact CG-O 3.44Å; L305-L331 HydrophobicContact CD2-CD1 4.21Å; L327-L331 HydrophobicContact CD1-CD1 3.38Å; L327-L331 HydrophobicContact CD1-CG 4.36Å; L327-L331 HydrophobicContact CG-CD1 4.01Å; L327-L331 VanDerWaalsContact O-CB 3.29Å; L327-L331 WeakPolarHBondContact O-CB 3.41Å; L327-L331 WeakPolarHBondContact O-CG 3.46Å; L327-L331 PolarHBondContact O-N 2.95Å; L331-W644 HydrophobicContact CB-CH2 4.48Å; L331-W644 HydrophobicContact CD2-CH2 3.56Å; L331-W644 HydrophobicContact CD2-CZ2 4.25Å; L331-W644 HydrophobicContact CD2-CZ3 4.11Å
332	A	85.1	Confident	87.8	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.008	16%	0.158	C	C	.	.	S	Bend	trans	-81.6	148.1	-165.2	0	0	0	0	0	113.2	L306 Y328 V337	L306-A332 HydrophobicContact CD1-CB 3.82Å; L306-A332 HydrophobicContact CD2-CB 4.03Å; Y328-A332 HydrophobicContact CD1-CB 3.74Å; Y328-A332 HydrophobicContact CE1-CB 4.31Å; Y328-A332 HydrophobicContact CG-CB 4.29Å; Y328-A332 WeakPolarHBondContact O-CB 3.48Å; Y328-A332 PolarHBondContact O-N 2.93Å; A332-V337 HydrophobicContact CB-CG2 4.09Å; A332-V337 WeakPolarHBondContact O-CG2 3.42Å
333	P	83.3	Confident	87.8	Confident	26 Å²	26	26.9 Å²	26.9	17%	0.169	16%	0.157	C	C	.	.			trans	-55.5	149.6	177	-23.1	32.4	0	0	0	112.3	P254 A335 E336 V337	P254-P333 HydrophobicContact CB-CG 3.98Å; P333-A335 PolarHBondContact O-N 2.72Å; P333-E336 PolarHBondContact O-N 2.89Å; P333-V337 WeakPolarHBondContact O-CG2 3.34Å; P333-V337 PolarHBondContact O-N 3.07Å
334	K	78.5	Confident	87.8	Confident	62 Å²	62	26.7 Å²	26.7	27%	0.27	16%	0.155	S	C	.	.	H	α-helix	trans	-48.2	-44.9	-172.4	-75.9	-179.2	-160.6	145.7	0	113.3	T255 E258 E262 E336 V337	T255-K334 HydrophobicContact CG2-CG 4.47Å; E258-K334 WeakPolarHBondContact OE2-CB 3.44Å; E258-K334 WeakPolarHBondContact OE2-CD 3.29Å; E258-K334 VanDerWaalsContact OE2-CE 3.23Å; E258-K334 WeakPolarHBondContact OE2-CE 3.29Å; E258-K334 WeakPolarHBondContact OE2-CG 3.35Å; E258-K334 IonicContact OE2-NZ 3.67Å; E258-K334 PolarHBondContact OE2-NZ 3.49Å; E262-K334 IonicContact OE1-NZ 3.8Å; E262-K334 PolarHBondContact OE1-NZ 3.03Å; E262-K334 IonicContact OE2-NZ 2.89Å; E262-K334 PolarHBondContact OE2-NZ 3.09Å; K334-E336 PolarHBondContact O-N 3.26Å; K334-V337 PolarHBondContact O-N 2.96Å
335	A	79.8	Confident	87.8	Confident	89 Å²	89	27.2 Å²	27.2	74%	0.736	16%	0.158	S	C	*	.	H	α-helix	trans	-60.8	-37.9	179.8	0	0	0	0	0	114.6	P333	P333-A335 PolarHBondContact O-N 2.72Å
336	E	80.3	Confident	87.8	Confident	49 Å²	49	31.2 Å²	31.2	23%	0.229	17%	0.173	C	C	.	.	H	α-helix	trans	-82.5	-19.2	-175.5	-68.9	-163	-155.8	0	0	113.4	R303 P333 K334 G338 V339	R303-E336 IonicContact CZ-OE1 3.97Å; R303-E336 VanDerWaalsContact CZ-OE1 3.29Å; R303-E336 IonicContact NH1-OE1 3.25Å; R303-E336 PolarHBondContact NH1-OE1 2.94Å; R303-E336 IonicContact NH1-OE2 2.76Å; R303-E336 IonicContact NH2-OE1 3.5Å; R303-E336 PolarHBondContact NH2-OE1 2.76Å; P333-E336 PolarHBondContact O-N 2.89Å; K334-E336 PolarHBondContact O-N 3.26Å; E336-G338 VanDerWaalsContact C-N 3.26Å; E336-G338 PolarHBondContact O-N 3.05Å; E336-V339 WeakPolarHBondContact O-CB 3.33Å; E336-V339 VanDerWaalsContact O-CG2 3.31Å; E336-V339 WeakPolarHBondContact O-CG2 3.33Å; E336-V339 PolarHBondContact O-N 3.35Å
337	V	82.6	Confident	87.9	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.5	-26.6	-177.2	-166.8	0	0	0	0	112.5	A332 P333 K334 V339 I340 M372	A332-V337 HydrophobicContact CB-CG2 4.09Å; A332-V337 WeakPolarHBondContact O-CG2 3.42Å; P333-V337 WeakPolarHBondContact O-CG2 3.34Å; P333-V337 PolarHBondContact O-N 3.07Å; K334-V337 PolarHBondContact O-N 2.96Å; V337-V339 PolarHBondContact O-N 3.18Å; V337-I340 HydrophobicContact CG1-CD1 3.77Å; V337-I340 HydrophobicContact CG1-CG1 4.41Å; V337-I340 WeakPolarHBondContact O-CG1 3.46Å; V337-I340 PolarHBondContact O-N 3.4Å; V337-I340 VanDerWaalsContact O-N 3.08Å; V337-M372 HydrophobicContact CB-CE 4.26Å; V337-M372 HydrophobicContact CG1-CE 3.51Å
338	G	84.4	Confident	87.9	Confident	39 Å²	39	30.5 Å²	30.5	40%	0.402	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-22.7	177.4	0	0	0	0	0	114.5	E336 I340 A341	E336-G338 VanDerWaalsContact C-N 3.26Å; E336-G338 PolarHBondContact O-N 3.05Å; G338-I340 PolarHBondContact O-N 3.4Å; G338-A341 WeakPolarHBondContact O-CB 3.34Å; G338-A341 PolarHBondContact O-N 3.05Å
339	V	87.4	Confident	87.9	Confident	62 Å²	62	40.6 Å²	40.6	38%	0.376	21%	0.208	S	C	.	.	H	α-helix	trans	-59.8	-32	176.9	179.2	0	0	0	0	112.5	L313 E336 V337 A341	L313-V339 HydrophobicContact CD1-CG1 3.89Å; E336-V339 WeakPolarHBondContact O-CB 3.33Å; E336-V339 VanDerWaalsContact O-CG2 3.31Å; E336-V339 WeakPolarHBondContact O-CG2 3.33Å; E336-V339 PolarHBondContact O-N 3.35Å; V337-V339 PolarHBondContact O-N 3.18Å; V339-A341 VanDerWaalsContact C-N 3.31Å; V339-A341 PolarHBondContact O-N 3.31Å
340	I	91.5	Very high	88	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-72.5	-24.3	-176.3	79.5	-172.8	0	0	0	112.8	L313 A325 Y328 V337 G338 K342 A343 L344 M365 M372	L313-I340 HydrophobicContact CD1-CG2 4.34Å; L313-I340 HydrophobicContact CD2-CG2 4.34Å; A325-I340 HydrophobicContact CB-CB 4.35Å; A325-I340 HydrophobicContact CB-CD1 4.22Å; Y328-I340 HydrophobicContact CD1-CG2 4.12Å; Y328-I340 HydrophobicContact CG-CG2 3.82Å; V337-I340 HydrophobicContact CG1-CD1 3.77Å; V337-I340 HydrophobicContact CG1-CG1 4.41Å; V337-I340 WeakPolarHBondContact O-CG1 3.46Å; V337-I340 PolarHBondContact O-N 3.4Å; V337-I340 VanDerWaalsContact O-N 3.08Å; G338-I340 PolarHBondContact O-N 3.4Å; I340-K342 VanDerWaalsContact C-N 3.33Å; I340-K342 PolarHBondContact O-N 2.99Å; I340-A343 WeakPolarHBondContact O-CB 3.28Å; I340-A343 PolarHBondContact O-N 3.07Å; I340-L344 HydrophobicContact CD1-CD1 4.26Å; I340-L344 HydrophobicContact CG1-CD1 4Å; I340-L344 PolarHBondContact O-N 3.39Å; I340-M365 HydrophobicContact CD1-CE 4.02Å; I340-M365 HydrophobicContact CD1-SD 3.95Å; I340-M372 HydrophobicContact CD1-CE 4.49Å; I340-M372 HydrophobicContact CD1-SD 4.04Å; I340-M372 HydrophobicContact CG1-SD 3.92Å
341	A	91.4	Very high	88.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.4	-44.8	-174.7	0	0	0	0	0	112.2	G338 V339 A343 L344 V345 M372 F373 Y376	G338-A341 WeakPolarHBondContact O-CB 3.34Å; G338-A341 PolarHBondContact O-N 3.05Å; V339-A341 VanDerWaalsContact C-N 3.31Å; V339-A341 PolarHBondContact O-N 3.31Å; A341-A343 VanDerWaalsContact C-N 3.29Å; A341-A343 PolarHBondContact O-N 2.92Å; A341-L344 PolarHBondContact O-N 3.28Å; A341-V345 WeakPolarHBondContact O-CB 3.38Å; A341-V345 VanDerWaalsContact O-CG2 3.27Å; A341-V345 WeakPolarHBondContact O-CG2 3.49Å; A341-V345 PolarHBondContact O-N 3.08Å; A341-M372 HydrophobicContact CB-CG 3.85Å; A341-M372 VanDerWaalsContact CB-O 3.26Å; A341-M372 WeakPolarHBondContact CB-O 3.24Å; A341-F373 HydrophobicContact CB-CD1 4.1Å; A341-F373 HydrophobicContact CB-CE1 4.02Å; A341-Y376 HydrophobicContact CB-CD2 4.03Å; A341-Y376 HydrophobicContact CB-CE2 3.79Å
342	K	91.7	Very high	88.5	Confident	152 Å²	152	49.8 Å²	49.8	66%	0.661	26%	0.261	S	S	*	.	H	α-helix	trans	-62.8	-33.7	176.9	-171.2	176.3	178.6	179	0	112.6	I340 R346	I340-K342 VanDerWaalsContact C-N 3.33Å; I340-K342 PolarHBondContact O-N 2.99Å; K342-R346 PolarHBondContact O-N 3.3Å
343	A	92.7	Very high	88.9	Confident	8 Å²	8	55.5 Å²	55.5	7%	0.066	29%	0.287	C	S	.	.	H	α-helix	trans	-76.3	-42.7	179.3	0	0	0	0	0	111.8	L313 V321 I340 A341 R346 L347	L313-A343 HydrophobicContact CB-CB 4.04Å; L313-A343 HydrophobicContact CD2-CB 4Å; V321-A343 HydrophobicContact CG1-CB 3.93Å; I340-A343 WeakPolarHBondContact O-CB 3.28Å; I340-A343 PolarHBondContact O-N 3.07Å; A341-A343 VanDerWaalsContact C-N 3.29Å; A341-A343 PolarHBondContact O-N 2.92Å; A343-R346 WeakPolarHBondContact O-CB 3.26Å; A343-R346 PolarHBondContact O-N 3.3Å; A343-L347 PolarHBondContact O-N 2.96Å
344	L	93	Very high	89.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-44	174.7	-65	172.3	0	0	0	111.3	M322 A325 I340 A341 R346 L347 L348 V358 V362 M365 F373	M322-L344 HydrophobicContact CE-CD2 4.43Å; M322-L344 HydrophobicContact SD-CD2 3.5Å; M322-L344 WeakPolarHBondContact SD-CD2 3.31Å; A325-L344 HydrophobicContact CB-CD1 4.34Å; A325-L344 HydrophobicContact CB-CD2 3.84Å; A325-L344 HydrophobicContact CB-CG 4.29Å; I340-L344 HydrophobicContact CD1-CD1 4.26Å; I340-L344 HydrophobicContact CG1-CD1 4Å; I340-L344 PolarHBondContact O-N 3.39Å; A341-L344 PolarHBondContact O-N 3.28Å; L344-R346 PolarHBondContact O-N 2.84Å; L344-L347 WeakPolarHBondContact O-CB 3.33Å; L344-L347 PolarHBondContact O-N 3.42Å; L344-L348 PolarHBondContact O-N 2.76Å; L344-V358 HydrophobicContact CB-CG1 4.31Å; L344-V358 HydrophobicContact CD2-CG1 4.29Å; L344-V362 HydrophobicContact CB-CG2 4.14Å; L344-V362 HydrophobicContact CD1-CG2 4.09Å; L344-M365 HydrophobicContact CD1-CE 4.21Å; L344-M365 HydrophobicContact CD1-SD 3.65Å; L344-F373 HydrophobicContact CB-CE1 4.43Å; L344-F373 HydrophobicContact CD1-CE1 4.16Å; L344-F373 HydrophobicContact CD1-CZ 3.88Å
345	V	93	Very high	90	Very high	11 Å²	11	54.2 Å²	54.2	7%	0.067	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-27.7	175.4	171.6	0	0	0	0	112.5	A341 L348 F373 Y376 F380	A341-V345 WeakPolarHBondContact O-CB 3.38Å; A341-V345 VanDerWaalsContact O-CG2 3.27Å; A341-V345 WeakPolarHBondContact O-CG2 3.49Å; A341-V345 PolarHBondContact O-N 3.08Å; V345-L348 HydrophobicContact CG2-CD1 4.45Å; V345-L348 WeakPolarHBondContact O-CB 3.43Å; V345-L348 PolarHBondContact O-N 3.33Å; V345-F373 HydrophobicContact CG2-CD1 4.5Å; V345-Y376 HydrophobicContact CG1-CD1 4.37Å; V345-Y376 HydrophobicContact CG2-CD2 4.31Å; V345-Y376 HydrophobicContact CG2-CG 4Å; V345-F380 HydrophobicContact CG2-CE2 4.29Å; V345-F380 HydrophobicContact CG2-CZ 3.93Å
346	R	93	Very high	90.7	Very high	84 Å²	84	54 Å²	54	32%	0.317	26%	0.263	S	S	.	.	H	α-helix	trans	-65.7	-40.6	170.5	175	179.4	66.3	97.4	-10.4	111.9	L313 S315 V321 K342 A343 L344 L348 R349	L313-R346 PolarHBondContact O-NH2 3Å; S315-R346 PolarHBondContact O-NH1 3.32Å; S315-R346 PolarHBondContact O-NH2 3.2Å; V321-R346 VanDerWaalsContact CG2-NH2 3.34Å; K342-R346 PolarHBondContact O-N 3.3Å; A343-R346 WeakPolarHBondContact O-CB 3.26Å; A343-R346 PolarHBondContact O-N 3.3Å; L344-R346 PolarHBondContact O-N 2.84Å; R346-L348 PolarHBondContact O-N 2.91Å; R346-R349 PolarHBondContact O-N 3.46Å
347	L	93.1	Very high	91.3	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-67.8	-18.7	178.2	-59.3	-179.4	0	0	0	113.2	A318 V321 M322 A343 L344 R349 S350 V354 V358	A318-L347 HydrophobicContact CB-CD1 4.29Å; A318-L347 HydrophobicContact CB-CD2 3.96Å; V321-L347 HydrophobicContact CB-CD1 4Å; V321-L347 HydrophobicContact CB-CD2 4.43Å; V321-L347 HydrophobicContact CG1-CD1 3.78Å; V321-L347 HydrophobicContact CG1-CG 4.2Å; V321-L347 HydrophobicContact CG2-CD2 4.43Å; M322-L347 HydrophobicContact CG-CD1 4.23Å; M322-L347 HydrophobicContact SD-CD1 4.25Å; A343-L347 PolarHBondContact O-N 2.96Å; L344-L347 WeakPolarHBondContact O-CB 3.33Å; L344-L347 PolarHBondContact O-N 3.42Å; L347-R349 PolarHBondContact O-N 3.37Å; L347-S350 WeakPolarHBondContact O-CB 3.4Å; L347-S350 PolarHBondContact O-N 3.48Å; L347-S350 PolarHBondContact O-OG 3.49Å; L347-V354 HydrophobicContact CB-CG1 4.38Å; L347-V358 HydrophobicContact CB-CG1 4.3Å; L347-V358 HydrophobicContact CB-CG2 3.75Å; L347-V358 HydrophobicContact CD1-CG2 3.61Å; L347-V358 HydrophobicContact CG-CG2 4.36Å
348	L	91.6	Very high	91.8	Very high	11 Å²	11	54.2 Å²	54.2	6%	0.058	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	0.1	173.3	-57	-177.9	0	0	0	114.1	L344 V345 R346 V358 L359 F380	L344-L348 PolarHBondContact O-N 2.76Å; V345-L348 HydrophobicContact CG2-CD1 4.45Å; V345-L348 WeakPolarHBondContact O-CB 3.43Å; V345-L348 PolarHBondContact O-N 3.33Å; R346-L348 PolarHBondContact O-N 2.91Å; L348-V358 HydrophobicContact CD2-CB 4.26Å; L348-V358 HydrophobicContact CD2-CG1 3.73Å; L348-V358 HydrophobicContact CG-CG1 4.49Å; L348-L359 HydrophobicContact CD1-CD2 4.2Å; L348-L359 HydrophobicContact CD2-CD1 4.35Å; L348-L359 HydrophobicContact CD2-CD2 3.65Å; L348-L359 HydrophobicContact CD2-CG 3.61Å; L348-F380 HydrophobicContact CD1-CD1 4.03Å; L348-F380 HydrophobicContact CD1-CE1 3.58Å; L348-F380 HydrophobicContact CD1-CZ 4.19Å
349	R	91	Very high	92.2	Very high	214 Å²	214	52.3 Å²	52.3	81%	0.808	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-2.8	173.5	-57.5	179.3	-177	162.2	0.3	113.4	R346 L347	R346-R349 PolarHBondContact O-N 3.46Å; L347-R349 PolarHBondContact O-N 3.37Å
350	S	90.8	Very high	92.4	Very high	46 Å²	46	49.5 Å²	49.5	32%	0.322	23%	0.231	S	C	.	.	S	Bend	trans	-80.3	-175	175.2	-60	0	0	0	0	111.7	L347 Q355	L347-S350 WeakPolarHBondContact O-CB 3.4Å; L347-S350 PolarHBondContact O-N 3.48Å; L347-S350 PolarHBondContact O-OG 3.49Å; S350-Q355 PolarHBondContact O-NE2 3.37Å
351	H	91.8	Very high	92.4	Very high	147 Å²	147	49.6 Å²	49.6	68%	0.681	23%	0.232	S	C	*	.			trans	-58.9	160	177	-55.7	-88.4	0	0	0	113.1	E353 V354 Q355	H351-E353 VanDerWaalsContact CB-OE2 3.23Å; H351-E353 WeakPolarHBondContact CB-OE2 3.46Å; H351-E353 PolarHBondContact O-N 2.93Å; H351-V354 PolarHBondContact O-N 3.28Å; H351-V354 VanDerWaalsContact O-N 3.16Å; H351-Q355 PolarHBondContact O-N 3.43Å
352	S	92.4	Very high	92.4	Very high	43 Å²	43	49.6 Å²	49.6	30%	0.301	23%	0.232	S	C	.	.	H	α-helix	trans	-54.7	-35.2	-173.6	16.7	0	0	0	0	113.7	Q355 Y356 I390	S352-Q355 PolarHBondContact O-N 3.19Å; S352-Y356 WeakPolarHBondContact O-CB 3.43Å; S352-Y356 PolarHBondContact O-N 2.63Å; S352-I390 WeakPolarHBondContact O-CD1 3.43Å
353	E	92.8	Very high	92.3	Very high	122 Å²	122	42.3 Å²	42.3	57%	0.57	20%	0.2	S	C	*	.	H	α-helix	trans	-72.8	-40.5	-175	-52.8	63.2	-125.6	0	0	109.5	H351 Y356 V357	H351-E353 VanDerWaalsContact CB-OE2 3.23Å; H351-E353 WeakPolarHBondContact CB-OE2 3.46Å; H351-E353 PolarHBondContact O-N 2.93Å; E353-Y356 PolarHBondContact O-N 3.28Å; E353-V357 WeakPolarHBondContact O-CG2 3.36Å; E353-V357 PolarHBondContact O-N 3.43Å; E353-V357 VanDerWaalsContact O-N 3.16Å
354	V	92.9	Very high	92.2	Very high	39 Å²	39	42 Å²	42	24%	0.236	20%	0.197	C	C	.	.	H	α-helix	trans	-66.9	-45.4	171.7	-179.6	0	0	0	0	110.3	A318 L347 H351 Y356 V357 V358	A318-V354 HydrophobicContact CB-CG1 3.61Å; A318-V354 HydrophobicContact CB-CG2 4.38Å; L347-V354 HydrophobicContact CB-CG1 4.38Å; H351-V354 PolarHBondContact O-N 3.28Å; H351-V354 VanDerWaalsContact O-N 3.16Å; V354-Y356 VanDerWaalsContact C-N 3.3Å; V354-Y356 PolarHBondContact O-N 3.15Å; V354-V357 PolarHBondContact O-N 3.41Å; V354-V358 HydrophobicContact CG1-CG2 4.07Å; V354-V358 WeakPolarHBondContact O-CB 3.26Å; V354-V358 WeakPolarHBondContact O-CG2 3.44Å; V354-V358 PolarHBondContact O-N 3.15Å
355	Q	93.3	Very high	92	Very high	22 Å²	22	42 Å²	42	10%	0.103	20%	0.197	C	C	.	.	H	α-helix	trans	-56.9	-43.9	176	-71.4	-177.4	52.8	0	0	111.5	S350 H351 S352 V358 L359 I390	S350-Q355 PolarHBondContact O-NE2 3.37Å; H351-Q355 PolarHBondContact O-N 3.43Å; S352-Q355 PolarHBondContact O-N 3.19Å; Q355-V358 PolarHBondContact O-N 3.4Å; Q355-L359 VanDerWaalsContact O-CB 3.27Å; Q355-L359 WeakPolarHBondContact O-CB 3.44Å; Q355-L359 WeakPolarHBondContact O-CD1 3.5Å; Q355-L359 WeakPolarHBondContact O-CG 3.42Å; Q355-L359 PolarHBondContact O-N 3.43Å; Q355-I390 HydrophobicContact CB-CD1 3.9Å
356	Y	93.2	Very high	91.7	Very high	84 Å²	84	41.5 Å²	41.5	33%	0.329	19%	0.194	S	C	.	.	H	α-helix	trans	-60.3	-53	178.7	178.5	-104.6	0	0	0	112	S352 E353 V354 V358 L359 Q360 Q389 L393 L630	S352-Y356 WeakPolarHBondContact O-CB 3.43Å; S352-Y356 PolarHBondContact O-N 2.63Å; E353-Y356 PolarHBondContact O-N 3.28Å; V354-Y356 VanDerWaalsContact C-N 3.3Å; V354-Y356 PolarHBondContact O-N 3.15Å; Y356-V358 PolarHBondContact O-N 2.89Å; Y356-L359 PolarHBondContact O-N 2.68Å; Y356-Q360 WeakPolarHBondContact O-CB 3.4Å; Y356-Q360 PolarHBondContact O-N 2.89Å; Y356-Q389 HydrophobicContact CD2-CB 4.12Å; Y356-Q389 HydrophobicContact CE2-CB 4Å; Y356-L393 HydrophobicContact CD2-CD1 3.33Å; Y356-L393 HydrophobicContact CE2-CD1 3.62Å; Y356-L393 HydrophobicContact CG-CD1 4.19Å; Y356-L630 HydrophobicContact CD1-CD1 4.38Å; Y356-L630 HydrophobicContact CE1-CD1 3.75Å; Y356-L630 HydrophobicContact CE1-CG 4.48Å
357	V	93	Very high	91.4	Very high	52 Å²	52	40 Å²	40	32%	0.315	19%	0.192	S	C	.	.	H	α-helix	trans	-64.9	-37.9	179.3	175.5	0	0	0	0	112	E353 V354 N361	E353-V357 WeakPolarHBondContact O-CG2 3.36Å; E353-V357 PolarHBondContact O-N 3.43Å; E353-V357 VanDerWaalsContact O-N 3.16Å; V354-V357 PolarHBondContact O-N 3.41Å; V357-N361 PolarHBondContact O-N 3.35Å; V357-N361 PolarHBondContact O-ND2 3.19Å
358	V	93.7	Very high	90.9	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-66.9	-47.4	176.7	172.6	0	0	0	0	110.8	M322 L344 L347 L348 V354 Q355 Y356 Q360 N361 V362	M322-V358 HydrophobicContact CG-CG2 4.38Å; M322-V358 HydrophobicContact SD-CB 4.49Å; M322-V358 HydrophobicContact SD-CG2 3.81Å; L344-V358 HydrophobicContact CB-CG1 4.31Å; L344-V358 HydrophobicContact CD2-CG1 4.29Å; L347-V358 HydrophobicContact CB-CG1 4.3Å; L347-V358 HydrophobicContact CB-CG2 3.75Å; L347-V358 HydrophobicContact CD1-CG2 3.61Å; L347-V358 HydrophobicContact CG-CG2 4.36Å; L348-V358 HydrophobicContact CD2-CB 4.26Å; L348-V358 HydrophobicContact CD2-CG1 3.73Å; L348-V358 HydrophobicContact CG-CG1 4.49Å; V354-V358 HydrophobicContact CG1-CG2 4.07Å; V354-V358 WeakPolarHBondContact O-CB 3.26Å; V354-V358 WeakPolarHBondContact O-CG2 3.44Å; V354-V358 PolarHBondContact O-N 3.15Å; Q355-V358 PolarHBondContact O-N 3.4Å; Y356-V358 PolarHBondContact O-N 2.89Å; V358-Q360 PolarHBondContact O-N 2.96Å; V358-N361 PolarHBondContact O-N 2.87Å; V358-V362 HydrophobicContact CG1-CG2 4.23Å; V358-V362 WeakPolarHBondContact O-CG2 3.16Å; V358-V362 PolarHBondContact O-N 3.36Å
359	L	93.3	Very high	90.3	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.8	-35.9	-179.5	-73.6	167.1	0	0	0	112.8	L348 Q355 Y356 N361 V362 A363 F380 I390 L393 K394	L348-L359 HydrophobicContact CD1-CD2 4.2Å; L348-L359 HydrophobicContact CD2-CD1 4.35Å; L348-L359 HydrophobicContact CD2-CD2 3.65Å; L348-L359 HydrophobicContact CD2-CG 3.61Å; Q355-L359 VanDerWaalsContact O-CB 3.27Å; Q355-L359 WeakPolarHBondContact O-CB 3.44Å; Q355-L359 WeakPolarHBondContact O-CD1 3.5Å; Q355-L359 WeakPolarHBondContact O-CG 3.42Å; Q355-L359 PolarHBondContact O-N 3.43Å; Y356-L359 PolarHBondContact O-N 2.68Å; L359-N361 VanDerWaalsContact C-N 3.27Å; L359-N361 PolarHBondContact O-N 2.93Å; L359-V362 PolarHBondContact O-N 3.37Å; L359-A363 WeakPolarHBondContact O-CB 3.37Å; L359-A363 PolarHBondContact O-N 3.41Å; L359-F380 HydrophobicContact CD2-CD1 3.91Å; L359-F380 HydrophobicContact CD2-CE1 3.97Å; L359-I390 HydrophobicContact CD1-CG2 3.77Å; L359-L393 HydrophobicContact CB-CB 3.91Å; L359-L393 HydrophobicContact CB-CD1 4.04Å; L359-L393 HydrophobicContact CB-CG 4.41Å; L359-L393 HydrophobicContact CD1-CB 4.27Å; L359-K394 HydrophobicContact CD1-CG 3.95Å; L359-K394 HydrophobicContact CD2-CG 4.21Å
360	Q	91.7	Very high	89.7	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.009	20%	0.202	C	C	.	.	H	α-helix	trans	-53.5	-46.3	171.3	-177.4	85.1	-8.7	0	0	111.5	Y356 V358 T364 R619 H629 L630	Y356-Q360 WeakPolarHBondContact O-CB 3.4Å; Y356-Q360 PolarHBondContact O-N 2.89Å; V358-Q360 PolarHBondContact O-N 2.96Å; Q360-T364 PolarHBondContact O-N 3.27Å; Q360-T364 PolarHBondContact O-OG1 3.1Å; Q360-R619 VanDerWaalsContact NE2-NH2 3.14Å; Q360-H629 PolarHBondContact NE2-O 3.28Å; Q360-L630 HydrophobicContact CB-CD1 4.16Å; Q360-L630 HydrophobicContact CG-CD1 3.71Å; Q360-L630 PolarHBondContact NE2-O 3.07Å
361	N	90.9	Very high	89.1	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.011	21%	0.212	C	C	.	.	H	α-helix	trans	-71.8	-43.9	179.3	-77.4	-76.3	0	0	0	111.8	M322 V357 V358 L359 A363 T364 M365 L624 G625 H629	M322-N361 HydrophobicContact CE-CB 3.71Å; V357-N361 PolarHBondContact O-N 3.35Å; V357-N361 PolarHBondContact O-ND2 3.19Å; V358-N361 PolarHBondContact O-N 2.87Å; L359-N361 VanDerWaalsContact C-N 3.27Å; L359-N361 PolarHBondContact O-N 2.93Å; N361-A363 VanDerWaalsContact C-N 3.28Å; N361-A363 PolarHBondContact O-N 3.21Å; N361-T364 PolarHBondContact O-N 2.88Å; N361-M365 WeakPolarHBondContact O-CG 3.43Å; N361-M365 PolarHBondContact O-N 3.49Å; N361-L624 WeakPolarHBondContact OD1-CB 3.21Å; N361-G625 PolarHBondContact OD1-N 3.3Å; N361-H629 PolarHBondContact OD1-CE1 3.25Å; N361-H629 PolarHBondContact OD1-ND1 2.87Å
362	V	92.1	Very high	88.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.7	-37.6	174.9	172.5	0	0	0	0	111.7	L344 V358 L359 T364 M365 S366 F373 F380 V397	L344-V362 HydrophobicContact CB-CG2 4.14Å; L344-V362 HydrophobicContact CD1-CG2 4.09Å; V358-V362 HydrophobicContact CG1-CG2 4.23Å; V358-V362 WeakPolarHBondContact O-CG2 3.16Å; V358-V362 PolarHBondContact O-N 3.36Å; L359-V362 PolarHBondContact O-N 3.37Å; V362-T364 PolarHBondContact O-N 2.82Å; V362-M365 PolarHBondContact O-N 3.31Å; V362-S366 VanDerWaalsContact O-CB 3.3Å; V362-S366 WeakPolarHBondContact O-CB 3.46Å; V362-S366 PolarHBondContact O-N 3.38Å; V362-S366 PolarHBondContact O-OG 3.49Å; V362-F373 HydrophobicContact CB-CZ 4.26Å; V362-F373 HydrophobicContact CG1-CD1 4.06Å; V362-F373 HydrophobicContact CG1-CD2 4.08Å; V362-F373 HydrophobicContact CG1-CE1 3.88Å; V362-F373 HydrophobicContact CG1-CE2 3.91Å; V362-F373 HydrophobicContact CG1-CG 4.16Å; V362-F373 HydrophobicContact CG1-CZ 3.81Å; V362-F373 HydrophobicContact CG2-CE1 3.94Å; V362-F373 HydrophobicContact CG2-CZ 3.87Å; V362-F380 HydrophobicContact CG1-CE1 3.76Å; V362-F380 HydrophobicContact CG1-CZ 3.89Å; V362-V397 HydrophobicContact CG1-CG1 4.07Å; V362-V397 HydrophobicContact CG1-CG2 4Å
363	A	90.1	Very high	88.7	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-57.9	-49.9	174.8	0	0	0	0	0	111.2	L359 N361 S366 I367 V397 F616	L359-A363 WeakPolarHBondContact O-CB 3.37Å; L359-A363 PolarHBondContact O-N 3.41Å; N361-A363 VanDerWaalsContact C-N 3.28Å; N361-A363 PolarHBondContact O-N 3.21Å; A363-S366 PolarHBondContact O-N 3.15Å; A363-S366 PolarHBondContact O-OG 2.69Å; A363-I367 PolarHBondContact O-N 2.89Å; A363-V397 HydrophobicContact CB-CG2 4.03Å; A363-F616 HydrophobicContact CB-CD1 4.17Å; A363-F616 HydrophobicContact CB-CE1 4.45Å
364	T	88.7	Confident	88.4	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.1	-42.4	177.8	-55.8	0	0	0	0	111.9	Q360 N361 V362 S366 I367 K368 D620 L624 H629	Q360-T364 PolarHBondContact O-N 3.27Å; Q360-T364 PolarHBondContact O-OG1 3.1Å; N361-T364 PolarHBondContact O-N 2.88Å; V362-T364 PolarHBondContact O-N 2.82Å; T364-S366 VanDerWaalsContact C-N 3.28Å; T364-S366 PolarHBondContact O-N 3.14Å; T364-I367 PolarHBondContact O-N 3.36Å; T364-K368 PolarHBondContact O-N 2.96Å; T364-D620 WeakPolarHBondContact CG2-OD1 3.37Å; T364-L624 HydrophobicContact CG2-CD1 4.34Å; T364-L624 HydrophobicContact CG2-CG 4.49Å; T364-H629 WeakPolarHBondContact CB-NE2 3.32Å; T364-H629 PolarHBondContact OG1-CE1 2.91Å; T364-H629 PolarHBondContact OG1-NE2 3.49Å
365	M	88.9	Confident	88.2	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-60	-37.8	174	-67	-177.7	178.5	0	0	112.2	A325 F329 I340 L344 N361 V362 K368 R369 M372 F373 L624	A325-M365 HydrophobicContact CB-CE 4.38Å; F329-M365 HydrophobicContact CB-CE 4.05Å; F329-M365 HydrophobicContact CD2-CB 4.42Å; F329-M365 HydrophobicContact CD2-CE 4.25Å; F329-M365 HydrophobicContact CD2-CG 3.75Å; F329-M365 HydrophobicContact CD2-SD 4.26Å; F329-M365 HydrophobicContact CE2-CB 4.01Å; F329-M365 HydrophobicContact CE2-CG 3.69Å; F329-M365 HydrophobicContact CG-CE 4.19Å; F329-M365 HydrophobicContact CG-CG 4.39Å; F329-M365 HydrophobicContact CZ-CG 4.29Å; I340-M365 HydrophobicContact CD1-CE 4.02Å; I340-M365 HydrophobicContact CD1-SD 3.95Å; L344-M365 HydrophobicContact CD1-CE 4.21Å; L344-M365 HydrophobicContact CD1-SD 3.65Å; N361-M365 WeakPolarHBondContact O-CG 3.43Å; N361-M365 PolarHBondContact O-N 3.49Å; V362-M365 PolarHBondContact O-N 3.31Å; M365-K368 PolarHBondContact O-N 2.89Å; M365-R369 PolarHBondContact O-N 3.38Å; M365-M372 HydrophobicContact SD-SD 4.44Å; M365-F373 HydrophobicContact CB-CE2 3.82Å; M365-F373 HydrophobicContact CB-CZ 4.36Å; M365-F373 HydrophobicContact SD-CZ 4.19Å; M365-L624 HydrophobicContact CE-CD2 3.58Å; M365-L624 HydrophobicContact CG-CD2 3.46Å; M365-L624 VanDerWaalsContact CG-CD2 3.46Å; M365-L624 HydrophobicContact SD-CD2 4.38Å
366	S	88.3	Confident	88.1	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-68.6	-31.7	179.8	75	0	0	0	0	113.3	V362 A363 T364 R370 N400	V362-S366 VanDerWaalsContact O-CB 3.3Å; V362-S366 WeakPolarHBondContact O-CB 3.46Å; V362-S366 PolarHBondContact O-N 3.38Å; V362-S366 PolarHBondContact O-OG 3.49Å; A363-S366 PolarHBondContact O-N 3.15Å; A363-S366 PolarHBondContact O-OG 2.69Å; T364-S366 VanDerWaalsContact C-N 3.28Å; T364-S366 PolarHBondContact O-N 3.14Å; S366-R370 WeakPolarHBondContact O-CA 3.46Å; S366-R370 WeakPolarHBondContact O-CG 3.42Å; S366-R370 PolarHBondContact O-N 3.2Å; S366-N400 VanDerWaalsContact OG-CB 3.24Å; S366-N400 WeakPolarHBondContact OG-CB 3.14Å; S366-N400 PolarHBondContact OG-ND2 2.93Å; S366-N400 VanDerWaalsContact OG-ND2 3.14Å
367	I	86.1	Confident	88	Confident	53 Å²	53	34.6 Å²	34.6	27%	0.272	18%	0.178	S	C	.	.	H	α-helix	trans	-63.9	-51.9	174.4	-65.9	169.8	0	0	0	109.7	A363 T364 N400 F616	A363-I367 PolarHBondContact O-N 2.89Å; T364-I367 PolarHBondContact O-N 3.36Å; I367-N400 WeakPolarHBondContact CG1-ND2 3.38Å; I367-F616 HydrophobicContact CD1-CB 4.29Å
368	K	82.1	Confident	87.9	Confident	98 Å²	98	40.1 Å²	40.1	43%	0.426	20%	0.198	S	C	.	.	H	α-helix	trans	-72.8	-31.8	-179.1	-83.5	173.9	172	144.1	0	114.5	F329 T364 M365 D620	F329-K368 HydrophobicContact CE1-CD 4.27Å; F329-K368 HydrophobicContact CZ-CB 4.17Å; F329-K368 HydrophobicContact CZ-CD 3.79Å; T364-K368 PolarHBondContact O-N 2.96Å; M365-K368 PolarHBondContact O-N 2.89Å; K368-D620 WeakPolarHBondContact CD-OD1 3.44Å; K368-D620 WeakPolarHBondContact CE-OD1 3.27Å; K368-D620 VanDerWaalsContact NZ-CB 3.32Å; K368-D620 VanDerWaalsContact NZ-CG 3.29Å; K368-D620 PolarHBondContact NZ-O 2.77Å; K368-D620 IonicContact NZ-OD1 2.71Å; K368-D620 PolarHBondContact NZ-OD1 3.44Å
369	R	79	Confident	87.8	Confident	67 Å²	67	42.5 Å²	42.5	25%	0.253	22%	0.215	S	C	.	.			trans	-146.3	68.9	-173.2	-60.7	-168.7	-169.1	-170.2	9.4	113.1	M365 G371 M372	M365-R369 PolarHBondContact O-N 3.38Å; R369-G371 PolarHBondContact O-N 3.18Å; R369-M372 HydrophobicContact CB-CE 4.18Å; R369-M372 WeakPolarHBondContact O-CB 3.15Å; R369-M372 PolarHBondContact O-N 3.48Å
370	R	77.8	Confident	87.9	Confident	108 Å²	108	42.5 Å²	42.5	41%	0.408	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-46.5	-48.9	-176.1	-63.8	-178.8	-172.6	-167.9	4.2	114.8	S366 M372 F373 N400 L401	S366-R370 WeakPolarHBondContact O-CA 3.46Å; S366-R370 WeakPolarHBondContact O-CG 3.42Å; S366-R370 PolarHBondContact O-N 3.2Å; R370-M372 PolarHBondContact O-N 3.36Å; R370-F373 PolarHBondContact O-N 3.09Å; R370-N400 VanDerWaalsContact CD-O 3.26Å; R370-N400 WeakPolarHBondContact CD-O 3.37Å; R370-N400 WeakPolarHBondContact CG-O 3.46Å; R370-L401 WeakPolarHBondContact O-CD2 3.39Å
371	G	79.1	Confident	88	Confident	52 Å²	52	45.4 Å²	45.4	54%	0.536	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-59.6	-16.7	-175.1	0	0	0	0	0	115.7	R369 F373	R369-G371 PolarHBondContact O-N 3.18Å; G371-F373 VanDerWaalsContact C-N 3.3Å; G371-F373 PolarHBondContact O-N 3.09Å
372	M	86.1	Confident	88.1	Confident	22 Å²	22	46.3 Å²	46.3	11%	0.108	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-60.7	-34.3	-179.9	-176.2	-178.4	-52.7	0	0	113.6	V337 I340 A341 M365 R369 R370	V337-M372 HydrophobicContact CB-CE 4.26Å; V337-M372 HydrophobicContact CG1-CE 3.51Å; I340-M372 HydrophobicContact CD1-CE 4.49Å; I340-M372 HydrophobicContact CD1-SD 4.04Å; I340-M372 HydrophobicContact CG1-SD 3.92Å; A341-M372 HydrophobicContact CB-CG 3.85Å; A341-M372 VanDerWaalsContact CB-O 3.26Å; A341-M372 WeakPolarHBondContact CB-O 3.24Å; M365-M372 HydrophobicContact SD-SD 4.44Å; R369-M372 HydrophobicContact CB-CE 4.18Å; R369-M372 WeakPolarHBondContact O-CB 3.15Å; R369-M372 PolarHBondContact O-N 3.48Å; R370-M372 PolarHBondContact O-N 3.36Å
373	F	90.1	Very high	88.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-3.1	-172.3	-61.8	-79.5	0	0	0	114.2	A341 L344 V345 V362 M365 R370 G371 Y376 L377 F380 L401	A341-F373 HydrophobicContact CB-CD1 4.1Å; A341-F373 HydrophobicContact CB-CE1 4.02Å; L344-F373 HydrophobicContact CB-CE1 4.43Å; L344-F373 HydrophobicContact CD1-CE1 4.16Å; L344-F373 HydrophobicContact CD1-CZ 3.88Å; V345-F373 HydrophobicContact CG2-CD1 4.5Å; V362-F373 HydrophobicContact CB-CZ 4.26Å; V362-F373 HydrophobicContact CG1-CD1 4.06Å; V362-F373 HydrophobicContact CG1-CD2 4.08Å; V362-F373 HydrophobicContact CG1-CE1 3.88Å; V362-F373 HydrophobicContact CG1-CE2 3.91Å; V362-F373 HydrophobicContact CG1-CG 4.16Å; V362-F373 HydrophobicContact CG1-CZ 3.81Å; V362-F373 HydrophobicContact CG2-CE1 3.94Å; V362-F373 HydrophobicContact CG2-CZ 3.87Å; M365-F373 HydrophobicContact CB-CE2 3.82Å; M365-F373 HydrophobicContact CB-CZ 4.36Å; M365-F373 HydrophobicContact SD-CZ 4.19Å; R370-F373 PolarHBondContact O-N 3.09Å; G371-F373 VanDerWaalsContact C-N 3.3Å; G371-F373 PolarHBondContact O-N 3.09Å; F373-Y376 CarbonylContact O-C 3.58Å; F373-Y376 WeakPolarHBondContact O-CA 3.44Å; F373-Y376 PolarHBondContact O-N 3.44Å; F373-L377 PolarHBondContact O-N 3.26Å; F373-F380 HydrophobicContact CB-CE2 4.01Å; F373-F380 HydrophobicContact CB-CZ 4.3Å; F373-F380 HydrophobicContact CD1-CE2 4.26Å; F373-F380 AromaticContact CD1-CZ 3.83Å; F373-F380 HydrophobicContact CD1-CZ 3.83Å; F373-F380 HydrophobicContact CG-CE2 4.48Å; F373-F380 HydrophobicContact CG-CZ 4.29Å; F373-L401 HydrophobicContact CB-CD1 3.73Å; F373-L401 HydrophobicContact CB-CD2 3.97Å; F373-L401 HydrophobicContact CB-CG 4.5Å
374	E	86.2	Confident	87.9	Confident	70 Å²	70	57.1 Å²	57.1	33%	0.327	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-56.3	-41.5	179.7	-177.2	160	-143.1	0	0	113.9	Y376 L377 N403 N406	E374-Y376 PolarHBondContact O-N 3.46Å; E374-L377 PolarHBondContact O-N 3.34Å; E374-N403 PolarHBondContact OE1-ND2 3.48Å; E374-N403 PolarHBondContact OE2-ND2 2.81Å; E374-N406 PolarHBondContact OE1-ND2 3.28Å; E374-N406 VanDerWaalsContact OE1-ND2 3.1Å
375	P	88.7	Confident	88	Confident	105 Å²	105	62.5 Å²	62.5	68%	0.682	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-61.2	-18.9	173.7	-23.9	35.1	0	0	0	114.3
376	Y	90.4	Very high	88.1	Confident	75 Å²	75	62.8 Å²	62.8	29%	0.294	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-106.6	8	-174.1	-62	-64.2	0	0	0	113.9	A341 V345 F373 E374 K378 S379	A341-Y376 HydrophobicContact CB-CD2 4.03Å; A341-Y376 HydrophobicContact CB-CE2 3.79Å; V345-Y376 HydrophobicContact CG1-CD1 4.37Å; V345-Y376 HydrophobicContact CG2-CD2 4.31Å; V345-Y376 HydrophobicContact CG2-CG 4Å; F373-Y376 CarbonylContact O-C 3.58Å; F373-Y376 WeakPolarHBondContact O-CA 3.44Å; F373-Y376 PolarHBondContact O-N 3.44Å; E374-Y376 PolarHBondContact O-N 3.46Å; Y376-K378 VanDerWaalsContact C-N 3.27Å; Y376-K378 PolarHBondContact O-N 3.43Å; Y376-S379 WeakPolarHBondContact O-CA 3.34Å; Y376-S379 WeakPolarHBondContact O-CB 3.35Å; Y376-S379 PolarHBondContact O-N 3.4Å; Y376-S379 PolarHBondContact O-OG 2.72Å
377	L	91.3	Very high	88.3	Confident	18 Å²	18	65.4 Å²	65.4	9%	0.094	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-42.5	-46.6	-174	-169.7	72	0	0	0	114.3	F373 E374 S379 F380 Y381 L398 L401 N406 V410	F373-L377 PolarHBondContact O-N 3.26Å; E374-L377 PolarHBondContact O-N 3.34Å; L377-S379 PolarHBondContact O-N 2.71Å; L377-S379 VanDerWaalsContact O-N 3.12Å; L377-F380 PolarHBondContact O-N 2.99Å; L377-Y381 HydrophobicContact CG-CE1 4.26Å; L377-L398 HydrophobicContact CD1-CD2 3.68Å; L377-L398 HydrophobicContact CG-CD2 4.2Å; L377-L401 HydrophobicContact CD1-CB 4.02Å; L377-L401 HydrophobicContact CD1-CD1 4.18Å; L377-N406 HydrophobicContact CD2-CB 4.33Å; L377-V410 HydrophobicContact CD2-CG2 4.22Å
378	K	92	Very high	88.6	Confident	169 Å²	169	65.1 Å²	65.1	74%	0.735	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-58.7	-23.4	178.6	-63.6	179.9	-179.4	177.4	0	114.3	Y376 F380 Y381	Y376-K378 VanDerWaalsContact C-N 3.27Å; Y376-K378 PolarHBondContact O-N 3.43Å; K378-F380 VanDerWaalsContact C-N 3.29Å; K378-Y381 HydrophobicContact CB-CE2 4.37Å; K378-Y381 HydrophobicContact CG-CE2 4.15Å; K378-Y381 PolarHBondContact O-N 3.32Å
379	S	91.6	Very high	89	Confident	51 Å²	51	66 Å²	66	36%	0.357	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-74.7	-22	178.5	-40	0	0	0	0	112.5	Y376 L377	Y376-S379 WeakPolarHBondContact O-CA 3.34Å; Y376-S379 WeakPolarHBondContact O-CB 3.35Å; Y376-S379 PolarHBondContact O-N 3.4Å; Y376-S379 PolarHBondContact O-OG 2.72Å; L377-S379 PolarHBondContact O-N 2.71Å; L377-S379 VanDerWaalsContact O-N 3.12Å
380	F	94.3	Very high	89.7	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-91.8	-0	178.6	-59.7	-76.9	0	0	0	112.9	V345 L348 L359 V362 F373 L377 K378 K394 V397 L398 L401	V345-F380 HydrophobicContact CG2-CE2 4.29Å; V345-F380 HydrophobicContact CG2-CZ 3.93Å; L348-F380 HydrophobicContact CD1-CD1 4.03Å; L348-F380 HydrophobicContact CD1-CE1 3.58Å; L348-F380 HydrophobicContact CD1-CZ 4.19Å; L359-F380 HydrophobicContact CD2-CD1 3.91Å; L359-F380 HydrophobicContact CD2-CE1 3.97Å; V362-F380 HydrophobicContact CG1-CE1 3.76Å; V362-F380 HydrophobicContact CG1-CZ 3.89Å; F373-F380 HydrophobicContact CB-CE2 4.01Å; F373-F380 HydrophobicContact CB-CZ 4.3Å; F373-F380 HydrophobicContact CD1-CE2 4.26Å; F373-F380 AromaticContact CD1-CZ 3.83Å; F373-F380 HydrophobicContact CD1-CZ 3.83Å; F373-F380 HydrophobicContact CG-CE2 4.48Å; F373-F380 HydrophobicContact CG-CZ 4.29Å; L377-F380 PolarHBondContact O-N 2.99Å; K378-F380 VanDerWaalsContact C-N 3.29Å; F380-K394 WeakPolarHBondContact O-CB 3.43Å; F380-K394 WeakPolarHBondContact O-CD 3.24Å; F380-V397 HydrophobicContact CB-CG1 4.48Å; F380-V397 HydrophobicContact CD1-CB 4.29Å; F380-V397 HydrophobicContact CD1-CG1 3.7Å; F380-V397 HydrophobicContact CD2-CG1 4.21Å; F380-V397 HydrophobicContact CE1-CG1 3.91Å; F380-V397 HydrophobicContact CE2-CG1 4.41Å; F380-V397 HydrophobicContact CG-CG1 3.86Å; F380-V397 HydrophobicContact CZ-CG1 4.27Å; F380-L398 HydrophobicContact CB-CD2 3.87Å; F380-L398 HydrophobicContact CB-CG 4.1Å; F380-L401 HydrophobicContact CD2-CD1 4.33Å; F380-L401 HydrophobicContact CE2-CD1 4.43Å
381	Y	94.2	Very high	90.4	Very high	62 Å²	62	59 Å²	59	24%	0.243	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-61.4	146.4	174.6	-68	1.4	0	0	0	111.1	L377 K378 K394 L398 E413	L377-Y381 HydrophobicContact CG-CE1 4.26Å; K378-Y381 HydrophobicContact CB-CE2 4.37Å; K378-Y381 HydrophobicContact CG-CE2 4.15Å; K378-Y381 PolarHBondContact O-N 3.32Å; Y381-K394 PolarHBondContact O-NZ 3.35Å; Y381-L398 HydrophobicContact CD1-CD2 4.09Å; Y381-L398 HydrophobicContact CE1-CD2 4.28Å; Y381-E413 HydrophobicContact CD1-CG 4.48Å; Y381-E413 HydrophobicContact CE1-CG 4.23Å; Y381-E413 HydrophobicContact CE2-CG 4.33Å
382	I	93.9	Very high	91.1	Very high	22 Å²	22	59 Å²	59	11%	0.113	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-96.7	126	-166.5	-60	177.9	0	0	0	109.9	K391 K394 L395 Y417 F425	I382-K391 VanDerWaalsContact CD1-O 3.26Å; I382-K391 WeakPolarHBondContact CD1-O 3.35Å; I382-K391 HydrophobicContact CG2-CB 3.89Å; I382-K391 HydrophobicContact CG2-CD 3.86Å; I382-K391 HydrophobicContact CG2-CG 3.63Å; I382-K394 HydrophobicContact CD1-CB 3.97Å; I382-K394 HydrophobicContact CG1-CB 3.65Å; I382-K394 HydrophobicContact CG1-CD 3.94Å; I382-K394 HydrophobicContact CG1-CG 4.47Å; I382-L395 HydrophobicContact CD1-CB 3.95Å; I382-Y417 HydrophobicContact CB-CE1 4.14Å; I382-Y417 HydrophobicContact CB-CE2 4.1Å; I382-Y417 HydrophobicContact CD1-CD2 3.95Å; I382-Y417 HydrophobicContact CD1-CE2 3.63Å; I382-Y417 HydrophobicContact CG1-CE2 3.94Å; I382-Y417 PolarHBondContact N-OH 3.38Å; I382-F425 HydrophobicContact CB-CZ 4.46Å; I382-F425 HydrophobicContact CD1-CE2 3.56Å; I382-F425 HydrophobicContact CD1-CZ 3.53Å; I382-F425 HydrophobicContact CG2-CE1 4.42Å; I382-F425 HydrophobicContact CG2-CZ 3.97Å
383	R	90.7	Very high	91.4	Very high	117 Å²	117	58.1 Å²	58.1	44%	0.442	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-92.2	149.4	175.5	-59.1	170.8	-66.8	-137.8	-2.7	109.4	T385 D386 K391	R383-T385 PolarHBondContact O-N 3.38Å; R383-D386 IonicContact CZ-OD1 2.73Å; R383-D386 PolarHBondContact N-OD2 3.15Å; R383-D386 IonicContact NE-OD1 3.29Å; R383-D386 PolarHBondContact NE-OD1 2.94Å; R383-D386 IonicContact NE-OD2 3.14Å; R383-D386 IonicContact NH2-OD1 3.18Å; R383-D386 PolarHBondContact NH2-OD1 3.23Å; R383-D386 IonicContact NH2-OD2 2.68Å; R383-D386 PolarHBondContact O-N 2.93Å; R383-D386 VanDerWaalsContact O-N 3.14Å; R383-K391 WeakPolarHBondContact O-CE 3.5Å
384	S	86.7	Confident	91.6	Very high	109 Å²	109	58.4 Å²	58.4	76%	0.762	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-38.4	172.4	47.1	0	0	0	0	112.2	D386 K391	S384-D386 VanDerWaalsContact C-N 3.35Å; S384-D386 PolarHBondContact O-N 2.99Å; S384-K391 WeakPolarHBondContact O-CE 3.27Å; S384-K391 PolarHBondContact O-NZ 3.12Å
385	T	89.9	Confident	92	Very high	113 Å²	113	55.2 Å²	55.2	69%	0.693	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-11.6	179.9	53.7	0	0	0	0	115.6	R383	R383-T385 PolarHBondContact O-N 3.38Å
386	D	91.2	Very high	92.1	Very high	7 Å²	7	50.6 Å²	50.6	4%	0.037	26%	0.26	C	S	.	.	S	Bend	trans	-72.3	133.8	179.4	-65.4	-28.7	0	0	0	110.3	R383 S384 I390 K391 K394	R383-D386 IonicContact CZ-OD1 2.73Å; R383-D386 PolarHBondContact N-OD2 3.15Å; R383-D386 IonicContact NE-OD1 3.29Å; R383-D386 PolarHBondContact NE-OD1 2.94Å; R383-D386 IonicContact NE-OD2 3.14Å; R383-D386 IonicContact NH2-OD1 3.18Å; R383-D386 PolarHBondContact NH2-OD1 3.23Å; R383-D386 IonicContact NH2-OD2 2.68Å; R383-D386 PolarHBondContact O-N 2.93Å; R383-D386 VanDerWaalsContact O-N 3.14Å; S384-D386 VanDerWaalsContact C-N 3.35Å; S384-D386 PolarHBondContact O-N 2.99Å; D386-I390 HydrophobicContact CB-CG2 4.12Å; D386-K391 HydrophobicContact CB-CG 4.08Å; D386-K391 VanDerWaalsContact O-CE 3.26Å; D386-K391 WeakPolarHBondContact O-CE 3.32Å; D386-K391 WeakPolarHBondContact O-CG 3.43Å; D386-K391 PolarHBondContact O-NZ 2.98Å; D386-K394 IonicContact OD1-NZ 2.72Å; D386-K394 IonicContact OD2-NZ 3.96Å; D386-K394 PolarHBondContact OD2-NZ 3.14Å
387	P	92.9	Very high	92.3	Very high	56 Å²	56	47 Å²	47	36%	0.364	25%	0.246	S	C	.	.			trans	-53.3	146	171.5	-28.8	33.8	0	0	0	113.4	Q389 I390 K391	P387-Q389 VanDerWaalsContact C-N 3.26Å; P387-Q389 PolarHBondContact O-N 3.21Å; P387-Q389 VanDerWaalsContact O-N 3.15Å; P387-I390 HydrophobicContact CB-CD1 4.45Å; P387-I390 HydrophobicContact CG-CD1 4.18Å; P387-I390 CarbonylContact O-C 3.53Å; P387-I390 WeakPolarHBondContact O-CA 3.42Å; P387-I390 WeakPolarHBondContact O-CB 3.33Å; P387-I390 PolarHBondContact O-N 3.46Å; P387-K391 PolarHBondContact O-N 3.21Å
388	T	91.6	Very high	92.4	Very high	46 Å²	46	46.2 Å²	46.2	28%	0.282	24%	0.241	S	C	.	.	H	α-helix	trans	-52.1	-40	-175.1	-56.2	0	0	0	0	113.6	I390 K391 I392 D422	T388-I390 VanDerWaalsContact C-N 3.31Å; T388-I390 PolarHBondContact O-N 2.68Å; T388-K391 WeakPolarHBondContact O-CB 3.34Å; T388-K391 PolarHBondContact O-N 3.32Å; T388-I392 HydrophobicContact CG2-CD1 3.97Å; T388-I392 WeakPolarHBondContact O-CG1 3.42Å; T388-I392 PolarHBondContact O-N 3.43Å; T388-D422 WeakPolarHBondContact CB-OD2 3.3Å; T388-D422 WeakPolarHBondContact CG2-OD2 3.46Å; T388-D422 PolarHBondContact OG1-OD2 3.35Å
389	Q	91	Very high	92.4	Very high	116 Å²	116	38.3 Å²	38.3	54%	0.542	21%	0.208	S	C	.	.	H	α-helix	trans	-62.8	-37.8	176.5	-57.7	80.3	-0	0	0	111.9	Y356 P387 L393	Y356-Q389 HydrophobicContact CD2-CB 4.12Å; Y356-Q389 HydrophobicContact CE2-CB 4Å; P387-Q389 VanDerWaalsContact C-N 3.26Å; P387-Q389 PolarHBondContact O-N 3.21Å; P387-Q389 VanDerWaalsContact O-N 3.15Å; Q389-L393 WeakPolarHBondContact O-CB 3.35Å; Q389-L393 WeakPolarHBondContact O-CG 3.37Å; Q389-L393 PolarHBondContact O-N 3.23Å; Q389-L393 VanDerWaalsContact O-N 3.09Å
390	I	93.8	Very high	92.3	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-73.7	-37.2	175.5	-66.2	178	0	0	0	110.7	S352 Q355 L359 D386 P387 T388 L393 K394	S352-I390 WeakPolarHBondContact O-CD1 3.43Å; Q355-I390 HydrophobicContact CB-CD1 3.9Å; L359-I390 HydrophobicContact CD1-CG2 3.77Å; D386-I390 HydrophobicContact CB-CG2 4.12Å; P387-I390 HydrophobicContact CB-CD1 4.45Å; P387-I390 HydrophobicContact CG-CD1 4.18Å; P387-I390 CarbonylContact O-C 3.53Å; P387-I390 WeakPolarHBondContact O-CA 3.42Å; P387-I390 WeakPolarHBondContact O-CB 3.33Å; P387-I390 PolarHBondContact O-N 3.46Å; T388-I390 VanDerWaalsContact C-N 3.31Å; T388-I390 PolarHBondContact O-N 2.68Å; I390-L393 PolarHBondContact O-N 3.11Å; I390-K394 HydrophobicContact CG2-CD 4.34Å; I390-K394 WeakPolarHBondContact O-CB 3.38Å; I390-K394 WeakPolarHBondContact O-CG 3.31Å; I390-K394 PolarHBondContact O-N 3.18Å
391	K	93.6	Very high	92.1	Very high	24 Å²	24	36.9 Å²	36.9	10%	0.104	20%	0.196	C	C	.	.	H	α-helix	trans	-58.8	-49.2	172.4	-59.1	-162.3	170.1	88.2	0	111.2	I382 R383 S384 D386 P387 T388 L393 K394 L395 F425	I382-K391 VanDerWaalsContact CD1-O 3.26Å; I382-K391 WeakPolarHBondContact CD1-O 3.35Å; I382-K391 HydrophobicContact CG2-CB 3.89Å; I382-K391 HydrophobicContact CG2-CD 3.86Å; I382-K391 HydrophobicContact CG2-CG 3.63Å; R383-K391 WeakPolarHBondContact O-CE 3.5Å; S384-K391 WeakPolarHBondContact O-CE 3.27Å; S384-K391 PolarHBondContact O-NZ 3.12Å; D386-K391 HydrophobicContact CB-CG 4.08Å; D386-K391 VanDerWaalsContact O-CE 3.26Å; D386-K391 WeakPolarHBondContact O-CE 3.32Å; D386-K391 WeakPolarHBondContact O-CG 3.43Å; D386-K391 PolarHBondContact O-NZ 2.98Å; P387-K391 PolarHBondContact O-N 3.21Å; T388-K391 WeakPolarHBondContact O-CB 3.34Å; T388-K391 PolarHBondContact O-N 3.32Å; K391-L393 PolarHBondContact O-N 3.38Å; K391-K394 PolarHBondContact O-N 3.37Å; K391-L395 VanDerWaalsContact O-CB 3.31Å; K391-L395 WeakPolarHBondContact O-CB 3.47Å; K391-L395 PolarHBondContact O-N 2.99Å; K391-F425 HydrophobicContact CB-CD2 3.6Å; K391-F425 HydrophobicContact CB-CE2 3.74Å; K391-F425 HydrophobicContact CB-CG 4.03Å; K391-F425 HydrophobicContact CB-CZ 4.25Å; K391-F425 HydrophobicContact CD-CD1 3.77Å; K391-F425 HydrophobicContact CD-CD2 4.36Å; K391-F425 HydrophobicContact CD-CE1 3.99Å; K391-F425 HydrophobicContact CD-CG 3.97Å; K391-F425 HydrophobicContact CD-CZ 4.4Å
392	I	93	Very high	91.9	Very high	53 Å²	53	34.2 Å²	34.2	27%	0.272	19%	0.187	S	C	.	.	H	α-helix	trans	-62.2	-43.4	178.8	-67.6	165.4	0	0	0	111.3	T388 L395 E396 A428	T388-I392 HydrophobicContact CG2-CD1 3.97Å; T388-I392 WeakPolarHBondContact O-CG1 3.42Å; T388-I392 PolarHBondContact O-N 3.43Å; I392-L395 WeakPolarHBondContact O-CB 3.36Å; I392-L395 PolarHBondContact O-N 2.7Å; I392-E396 PolarHBondContact O-N 3.25Å; I392-A428 HydrophobicContact CG1-CB 4.27Å
393	L	92.7	Very high	91.7	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-63.6	-45.5	176.9	-82.9	168.7	0	0	0	113.2	Y356 L359 Q389 I390 K391 L395 E396 V397 F616	Y356-L393 HydrophobicContact CD2-CD1 3.33Å; Y356-L393 HydrophobicContact CE2-CD1 3.62Å; Y356-L393 HydrophobicContact CG-CD1 4.19Å; L359-L393 HydrophobicContact CB-CB 3.91Å; L359-L393 HydrophobicContact CB-CD1 4.04Å; L359-L393 HydrophobicContact CB-CG 4.41Å; L359-L393 HydrophobicContact CD1-CB 4.27Å; Q389-L393 WeakPolarHBondContact O-CB 3.35Å; Q389-L393 WeakPolarHBondContact O-CG 3.37Å; Q389-L393 PolarHBondContact O-N 3.23Å; Q389-L393 VanDerWaalsContact O-N 3.09Å; I390-L393 PolarHBondContact O-N 3.11Å; K391-L393 PolarHBondContact O-N 3.38Å; L393-L395 VanDerWaalsContact C-N 3.31Å; L393-L395 PolarHBondContact O-N 2.92Å; L393-E396 PolarHBondContact O-N 3.09Å; L393-V397 WeakPolarHBondContact O-CG2 3.28Å; L393-V397 PolarHBondContact O-N 3.17Å; L393-V397 VanDerWaalsContact O-N 3.1Å; L393-F616 HydrophobicContact CD2-CE1 3.45Å; L393-F616 VanDerWaalsContact CD2-CE1 3.45Å; L393-F616 HydrophobicContact CD2-CZ 3.48Å; L393-F616 VanDerWaalsContact CD2-CZ 3.48Å; L393-F616 HydrophobicContact CG-CZ 4.38Å
394	K	94.2	Very high	91.5	Very high	5 Å²	5	35.8 Å²	35.8	2%	0.022	20%	0.2	C	C	.	.	H	α-helix	trans	-59.7	-42.5	174.5	-82.1	-179.1	170.2	-168.9	0	111.8	L359 F380 Y381 I382 D386 I390 K391 V397 L398	L359-K394 HydrophobicContact CD1-CG 3.95Å; L359-K394 HydrophobicContact CD2-CG 4.21Å; F380-K394 WeakPolarHBondContact O-CB 3.43Å; F380-K394 WeakPolarHBondContact O-CD 3.24Å; Y381-K394 PolarHBondContact O-NZ 3.35Å; I382-K394 HydrophobicContact CD1-CB 3.97Å; I382-K394 HydrophobicContact CG1-CB 3.65Å; I382-K394 HydrophobicContact CG1-CD 3.94Å; I382-K394 HydrophobicContact CG1-CG 4.47Å; D386-K394 IonicContact OD1-NZ 2.72Å; D386-K394 IonicContact OD2-NZ 3.96Å; D386-K394 PolarHBondContact OD2-NZ 3.14Å; I390-K394 HydrophobicContact CG2-CD 4.34Å; I390-K394 WeakPolarHBondContact O-CB 3.38Å; I390-K394 WeakPolarHBondContact O-CG 3.31Å; I390-K394 PolarHBondContact O-N 3.18Å; K391-K394 PolarHBondContact O-N 3.37Å; K394-V397 PolarHBondContact O-N 3.36Å; K394-L398 WeakPolarHBondContact O-CG 3.36Å; K394-L398 PolarHBondContact O-N 3.47Å
395	L	94.4	Very high	91.6	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-42.9	177.2	176.8	72.2	0	0	0	112	I382 K391 I392 L393 L398 T399 F414 Y417 F425 A428 T429 A432	I382-L395 HydrophobicContact CD1-CB 3.95Å; K391-L395 VanDerWaalsContact O-CB 3.31Å; K391-L395 WeakPolarHBondContact O-CB 3.47Å; K391-L395 PolarHBondContact O-N 2.99Å; I392-L395 WeakPolarHBondContact O-CB 3.36Å; I392-L395 PolarHBondContact O-N 2.7Å; L393-L395 VanDerWaalsContact C-N 3.31Å; L393-L395 PolarHBondContact O-N 2.92Å; L395-L398 PolarHBondContact O-N 3.08Å; L395-T399 WeakPolarHBondContact O-CB 3.45Å; L395-T399 PolarHBondContact O-N 3.11Å; L395-T399 PolarHBondContact O-OG1 3.2Å; L395-F414 HydrophobicContact CD1-CD1 3.93Å; L395-F414 HydrophobicContact CD1-CE1 3.49Å; L395-F414 VanDerWaalsContact CD1-CE1 3.49Å; L395-F414 HydrophobicContact CD1-CE2 4.37Å; L395-F414 HydrophobicContact CD1-CZ 3.73Å; L395-Y417 HydrophobicContact CD1-CD2 4.5Å; L395-F425 HydrophobicContact CB-CE2 4.24Å; L395-F425 HydrophobicContact CD2-CD2 4.45Å; L395-F425 HydrophobicContact CD2-CE2 4.15Å; L395-A428 VanDerWaalsContact CD2-C 3.43Å; L395-A428 HydrophobicContact CD2-CB 3.74Å; L395-T429 HydrophobicContact CD1-CG2 4.42Å; L395-A432 HydrophobicContact CD1-CB 3.81Å; L395-A432 HydrophobicContact CD2-CB 4.15Å; L395-A432 HydrophobicContact CG-CB 3.93Å
396	E	91.7	Very high	91.7	Very high	7 Å²	7	31.6 Å²	31.6	3%	0.033	17%	0.169	C	C	.	.	H	α-helix	trans	-61.7	-45.5	175.6	-166.4	73	-147.3	0	0	111	I392 L393 T399 N400 R435 S614 F616	I392-E396 PolarHBondContact O-N 3.25Å; L393-E396 PolarHBondContact O-N 3.09Å; E396-T399 WeakPolarHBondContact O-CB 3.41Å; E396-T399 PolarHBondContact O-N 3.14Å; E396-T399 VanDerWaalsContact O-N 3.15Å; E396-N400 PolarHBondContact O-N 2.83Å; E396-N400 PolarHBondContact O-ND2 3.16Å; E396-R435 IonicContact OE1-CZ 2.81Å; E396-R435 IonicContact OE1-NH1 3.49Å; E396-R435 PolarHBondContact OE1-NH1 3.19Å; E396-R435 IonicContact OE2-CZ 2.68Å; E396-R435 IonicContact OE2-NH1 2.65Å; E396-R435 PolarHBondContact OE2-NH1 2.71Å; E396-R435 IonicContact OE2-NH2 3.59Å; E396-S614 WeakPolarHBondContact OE1-CB 3.43Å; E396-F616 HydrophobicContact CB-CD2 4.29Å; E396-F616 HydrophobicContact CB-CE2 4.18Å; E396-F616 HydrophobicContact CG-CB 4.48Å; E396-F616 HydrophobicContact CG-CD2 3.5Å; E396-F616 HydrophobicContact CG-CE2 3.89Å; E396-F616 HydrophobicContact CG-CG 4.02Å
397	V	92.7	Very high	91.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.2	-47.3	175	175.4	0	0	0	0	111.3	V362 A363 F380 L393 K394 T399 N400 L401	V362-V397 HydrophobicContact CG1-CG1 4.07Å; V362-V397 HydrophobicContact CG1-CG2 4Å; A363-V397 HydrophobicContact CB-CG2 4.03Å; F380-V397 HydrophobicContact CB-CG1 4.48Å; F380-V397 HydrophobicContact CD1-CB 4.29Å; F380-V397 HydrophobicContact CD1-CG1 3.7Å; F380-V397 HydrophobicContact CD2-CG1 4.21Å; F380-V397 HydrophobicContact CE1-CG1 3.91Å; F380-V397 HydrophobicContact CE2-CG1 4.41Å; F380-V397 HydrophobicContact CG-CG1 3.86Å; F380-V397 HydrophobicContact CZ-CG1 4.27Å; L393-V397 WeakPolarHBondContact O-CG2 3.28Å; L393-V397 PolarHBondContact O-N 3.17Å; L393-V397 VanDerWaalsContact O-N 3.1Å; K394-V397 PolarHBondContact O-N 3.36Å; V397-T399 PolarHBondContact O-N 3.12Å; V397-N400 PolarHBondContact O-N 3.49Å; V397-L401 HydrophobicContact CG1-CD1 3.71Å; V397-L401 HydrophobicContact CG1-CG 4.25Å; V397-L401 VanDerWaalsContact O-CG 3.27Å; V397-L401 WeakPolarHBondContact O-CG 3.46Å; V397-L401 PolarHBondContact O-N 2.85Å
398	L	93.6	Very high	91.7	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-60.2	-32	175.9	-71.5	173.2	0	0	0	112.6	L377 F380 Y381 K394 L395 A402 F414 Y417	L377-L398 HydrophobicContact CD1-CD2 3.68Å; L377-L398 HydrophobicContact CG-CD2 4.2Å; F380-L398 HydrophobicContact CB-CD2 3.87Å; F380-L398 HydrophobicContact CB-CG 4.1Å; Y381-L398 HydrophobicContact CD1-CD2 4.09Å; Y381-L398 HydrophobicContact CE1-CD2 4.28Å; K394-L398 WeakPolarHBondContact O-CG 3.36Å; K394-L398 PolarHBondContact O-N 3.47Å; L395-L398 PolarHBondContact O-N 3.08Å; L398-A402 PolarHBondContact O-N 3.49Å; L398-F414 HydrophobicContact CB-CE1 4Å; L398-F414 HydrophobicContact CB-CZ 4.14Å; L398-F414 HydrophobicContact CD1-CE1 4.22Å; L398-Y417 HydrophobicContact CD1-CE2 4.16Å
399	T	91.8	Very high	91.8	Very high	4 Å²	4	33.1 Å²	33.1	3%	0.025	18%	0.179	C	C	.	.	H	α-helix	trans	-73.6	-39	176.9	-53.7	0	0	0	0	111.8	L395 E396 V397 A402 A432 R435	L395-T399 WeakPolarHBondContact O-CB 3.45Å; L395-T399 PolarHBondContact O-N 3.11Å; L395-T399 PolarHBondContact O-OG1 3.2Å; E396-T399 WeakPolarHBondContact O-CB 3.41Å; E396-T399 PolarHBondContact O-N 3.14Å; E396-T399 VanDerWaalsContact O-N 3.15Å; V397-T399 PolarHBondContact O-N 3.12Å; T399-A402 WeakPolarHBondContact O-CB 3.24Å; T399-A402 PolarHBondContact O-N 3.08Å; T399-A432 HydrophobicContact CG2-CB 4.38Å; T399-A432 VanDerWaalsContact OG1-CB 3.31Å; T399-A432 WeakPolarHBondContact OG1-CB 3.11Å; T399-R435 HydrophobicContact CG2-CB 3.81Å
400	N	89.9	Confident	91.9	Very high	19 Å²	19	27.7 Å²	27.7	10%	0.102	15%	0.154	C	C	.	.	H	α-helix	trans	-73.1	-28.9	178	-67.9	-24.9	0	0	0	112.9	S366 I367 R370 E396 V397 A402	S366-N400 VanDerWaalsContact OG-CB 3.24Å; S366-N400 WeakPolarHBondContact OG-CB 3.14Å; S366-N400 PolarHBondContact OG-ND2 2.93Å; S366-N400 VanDerWaalsContact OG-ND2 3.14Å; I367-N400 WeakPolarHBondContact CG1-ND2 3.38Å; R370-N400 VanDerWaalsContact CD-O 3.26Å; R370-N400 WeakPolarHBondContact CD-O 3.37Å; R370-N400 WeakPolarHBondContact CG-O 3.46Å; E396-N400 PolarHBondContact O-N 2.83Å; E396-N400 PolarHBondContact O-ND2 3.16Å; V397-N400 PolarHBondContact O-N 3.49Å; N400-A402 VanDerWaalsContact C-N 3.31Å
401	L	90.6	Very high	91.9	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	1.9	175.6	-60.6	177.3	0	0	0	113.7	R370 F373 L377 F380 V397 N403 N406	R370-L401 WeakPolarHBondContact O-CD2 3.39Å; F373-L401 HydrophobicContact CB-CD1 3.73Å; F373-L401 HydrophobicContact CB-CD2 3.97Å; F373-L401 HydrophobicContact CB-CG 4.5Å; L377-L401 HydrophobicContact CD1-CB 4.02Å; L377-L401 HydrophobicContact CD1-CD1 4.18Å; F380-L401 HydrophobicContact CD2-CD1 4.33Å; F380-L401 HydrophobicContact CE2-CD1 4.43Å; V397-L401 HydrophobicContact CG1-CD1 3.71Å; V397-L401 HydrophobicContact CG1-CG 4.25Å; V397-L401 VanDerWaalsContact O-CG 3.27Å; V397-L401 WeakPolarHBondContact O-CG 3.46Å; V397-L401 PolarHBondContact O-N 2.85Å; L401-N403 PolarHBondContact O-N 3.05Å; L401-N406 PolarHBondContact O-ND2 3.44Å; L401-N406 PolarHBondContact O-OD1 2.68Å
402	A	90.7	Very high	91.8	Very high	7 Å²	7	35 Å²	35	6%	0.058	18%	0.182	C	C	.	.			trans	-71.6	112.5	-179.4	0	0	0	0	0	111.8	L398 T399 N400 N406 I407 I440	L398-A402 PolarHBondContact O-N 3.49Å; T399-A402 WeakPolarHBondContact O-CB 3.24Å; T399-A402 PolarHBondContact O-N 3.08Å; N400-A402 VanDerWaalsContact C-N 3.31Å; A402-N406 WeakPolarHBondContact CA-OD1 3.32Å; A402-I407 HydrophobicContact CB-CD1 4.3Å; A402-I440 HydrophobicContact CB-CD1 4.47Å
403	N	89	Confident	91.8	Very high	43 Å²	43	34.9 Å²	34.9	23%	0.23	18%	0.18	C	C	.	.			trans	-117.7	162.7	177.2	-66.8	-29.2	0	0	0	110.2	E374 L401 T405 N406 I407	E374-N403 PolarHBondContact OE1-ND2 3.48Å; E374-N403 PolarHBondContact OE2-ND2 2.81Å; L401-N403 PolarHBondContact O-N 3.05Å; N403-T405 PolarHBondContact O-N 3.45Å; N403-T405 VanDerWaalsContact O-N 3.07Å; N403-N406 PolarHBondContact N-ND2 3.4Å; N403-N406 PolarHBondContact N-OD1 3.44Å; N403-N406 PolarHBondContact O-N 2.84Å; N403-N406 VanDerWaalsContact O-N 3.08Å; N403-N406 PolarHBondContact O-OD1 2.92Å; N403-I407 WeakPolarHBondContact O-CB 3.42Å; N403-I407 WeakPolarHBondContact O-CG2 3.21Å; N403-I407 PolarHBondContact O-N 3.06Å
404	E	86.4	Confident	91.9	Very high	129 Å²	129	34.7 Å²	34.7	60%	0.603	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.5	-177	-56.8	-149.5	136.4	0	0	114.3	I440	E404-I440 HydrophobicContact CG-CG2 4.17Å
405	T	89.3	Confident	91.8	Very high	118 Å²	118	40.1 Å²	40.1	72%	0.724	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-38.8	176.9	50.4	0	0	0	0	113	N403	N403-T405 PolarHBondContact O-N 3.45Å; N403-T405 VanDerWaalsContact O-N 3.07Å
406	N	91.4	Very high	91.7	Very high	16 Å²	16	44 Å²	44	9%	0.086	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-15.6	-169.9	73.7	36.5	0	0	0	113.6	E374 L377 L401 A402 N403 P408 T409 V410	E374-N406 PolarHBondContact OE1-ND2 3.28Å; E374-N406 VanDerWaalsContact OE1-ND2 3.1Å; L377-N406 HydrophobicContact CD2-CB 4.33Å; L401-N406 PolarHBondContact O-ND2 3.44Å; L401-N406 PolarHBondContact O-OD1 2.68Å; A402-N406 WeakPolarHBondContact CA-OD1 3.32Å; N403-N406 PolarHBondContact N-ND2 3.4Å; N403-N406 PolarHBondContact N-OD1 3.44Å; N403-N406 PolarHBondContact O-N 2.84Å; N403-N406 VanDerWaalsContact O-N 3.08Å; N403-N406 PolarHBondContact O-OD1 2.92Å; N406-P408 VanDerWaalsContact C-N 3.32Å; N406-P408 VanDerWaalsContact O-N 3.16Å; N406-T409 PolarHBondContact O-N 2.91Å; N406-T409 PolarHBondContact O-OG1 3.23Å; N406-V410 PolarHBondContact O-N 3.14Å; N406-V410 VanDerWaalsContact O-N 3.15Å
407	I	92.8	Very high	91.8	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.015	23%	0.23	C	C	.	.	H	α-helix	trans	-53.5	-33.3	179.7	-173.4	63.1	0	0	0	115.1	A402 N403 T409 V410 L411 C436 I440 V443	A402-I407 HydrophobicContact CB-CD1 4.3Å; N403-I407 WeakPolarHBondContact O-CB 3.42Å; N403-I407 WeakPolarHBondContact O-CG2 3.21Å; N403-I407 PolarHBondContact O-N 3.06Å; I407-T409 VanDerWaalsContact C-N 3.28Å; I407-T409 PolarHBondContact O-N 2.95Å; I407-V410 PolarHBondContact O-N 2.89Å; I407-L411 HydrophobicContact CD1-CD1 4.2Å; I407-L411 HydrophobicContact CD1-CD2 4.13Å; I407-L411 HydrophobicContact CD1-CG 3.73Å; I407-L411 HydrophobicContact CG1-CD1 4.08Å; I407-L411 HydrophobicContact CG1-CG 4.07Å; I407-L411 WeakPolarHBondContact O-CG 3.18Å; I407-L411 PolarHBondContact O-N 2.96Å; I407-C436 HydrophobicContact CD1-CB 3.77Å; I407-I440 HydrophobicContact CB-CD1 3.81Å; I407-I440 HydrophobicContact CD1-CD1 4.25Å; I407-I440 HydrophobicContact CG1-CD1 3.95Å; I407-I440 HydrophobicContact CG2-CD1 4.07Å; I407-I440 HydrophobicContact CG2-CG2 4.5Å; I407-V443 HydrophobicContact CG1-CG1 4.46Å; I407-V443 HydrophobicContact CG1-CG2 4.22Å; I407-V443 HydrophobicContact CG2-CG2 3.88Å
408	P	92	Very high	91.7	Very high	79 Å²	79	45.8 Å²	45.8	51%	0.513	24%	0.237	S	C	.	.	H	α-helix	trans	-68.6	-23.2	177.3	-18.1	33.8	0	0	0	113.9	N406	N406-P408 VanDerWaalsContact C-N 3.32Å; N406-P408 VanDerWaalsContact O-N 3.16Å
409	T	92.6	Very high	91.5	Very high	59 Å²	59	55.7 Å²	55.7	36%	0.362	27%	0.274	S	S	.	.	H	α-helix	trans	-85.3	-41.1	172.5	55.3	0	0	0	0	111.2	N406 I407 L411 R412 E413	N406-T409 PolarHBondContact O-N 2.91Å; N406-T409 PolarHBondContact O-OG1 3.23Å; I407-T409 VanDerWaalsContact C-N 3.28Å; I407-T409 PolarHBondContact O-N 2.95Å; T409-L411 PolarHBondContact O-N 2.98Å; T409-R412 WeakPolarHBondContact O-CB 3.11Å; T409-R412 PolarHBondContact O-N 3.2Å; T409-R412 VanDerWaalsContact O-N 3.15Å; T409-E413 PolarHBondContact O-N 3.01Å
410	V	93.9	Very high	91.4	Very high	1 Å²	1	57 Å²	57	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-41	178.2	178.7	0	0	0	0	111.6	L377 N406 I407 R412 E413 F414	L377-V410 HydrophobicContact CD2-CG2 4.22Å; N406-V410 PolarHBondContact O-N 3.14Å; N406-V410 VanDerWaalsContact O-N 3.15Å; I407-V410 PolarHBondContact O-N 2.89Å; V410-R412 VanDerWaalsContact C-N 3.33Å; V410-R412 PolarHBondContact O-N 3.24Å; V410-E413 WeakPolarHBondContact O-CB 3.3Å; V410-E413 PolarHBondContact O-N 3.08Å; V410-F414 HydrophobicContact CG1-CD1 4.16Å; V410-F414 HydrophobicContact CG1-CD2 4.26Å; V410-F414 HydrophobicContact CG1-CE1 3.6Å; V410-F414 HydrophobicContact CG1-CE2 3.75Å; V410-F414 HydrophobicContact CG1-CG 4.47Å; V410-F414 HydrophobicContact CG1-CZ 3.39Å; V410-F414 WeakPolarHBondContact O-CD1 3.37Å; V410-F414 WeakPolarHBondContact O-CG 3.43Å; V410-F414 PolarHBondContact O-N 3.35Å
411	L	92.5	Very high	91.3	Very high	19 Å²	19	63.7 Å²	63.7	10%	0.099	32%	0.316	C	S	.	.	H	α-helix	trans	-68.2	-28.3	175.9	-71.8	-177.8	0	0	0	114	I407 T409 F414 Q415 I433 V443	I407-L411 HydrophobicContact CD1-CD1 4.2Å; I407-L411 HydrophobicContact CD1-CD2 4.13Å; I407-L411 HydrophobicContact CD1-CG 3.73Å; I407-L411 HydrophobicContact CG1-CD1 4.08Å; I407-L411 HydrophobicContact CG1-CG 4.07Å; I407-L411 WeakPolarHBondContact O-CG 3.18Å; I407-L411 PolarHBondContact O-N 2.96Å; T409-L411 PolarHBondContact O-N 2.98Å; L411-F414 HydrophobicContact CD2-CD2 4.15Å; L411-F414 PolarHBondContact O-N 2.61Å; L411-Q415 WeakPolarHBondContact O-CB 3.3Å; L411-Q415 VanDerWaalsContact O-CG 3.27Å; L411-Q415 WeakPolarHBondContact O-CG 3.15Å; L411-Q415 PolarHBondContact O-N 3.1Å; L411-I433 HydrophobicContact CD2-CG1 4.18Å; L411-V443 HydrophobicContact CD1-CG1 3.36Å
412	R	92.3	Very high	91.3	Very high	163 Å²	163	65.1 Å²	65.1	62%	0.615	32%	0.324	S	S	*	.	H	α-helix	trans	-70	-37.8	176.3	-166.9	-175.3	-57.4	165.4	3.3	111.4	T409 V410 T416	T409-R412 WeakPolarHBondContact O-CB 3.11Å; T409-R412 PolarHBondContact O-N 3.2Å; T409-R412 VanDerWaalsContact O-N 3.15Å; V410-R412 VanDerWaalsContact C-N 3.33Å; V410-R412 PolarHBondContact O-N 3.24Å; R412-T416 PolarHBondContact O-N 2.66Å; R412-T416 PolarHBondContact O-OG1 3.09Å; R412-T416 VanDerWaalsContact O-OG1 3.13Å
413	E	94.3	Very high	91.2	Very high	51 Å²	51	68 Å²	68	24%	0.238	34%	0.335	C	S	.	.	H	α-helix	trans	-62.3	-51.2	168.2	-71.2	-62.9	127.5	0	0	110.6	Y381 T409 V410 Q415 T416 Y417	Y381-E413 HydrophobicContact CD1-CG 4.48Å; Y381-E413 HydrophobicContact CE1-CG 4.23Å; Y381-E413 HydrophobicContact CE2-CG 4.33Å; T409-E413 PolarHBondContact O-N 3.01Å; V410-E413 WeakPolarHBondContact O-CB 3.3Å; V410-E413 PolarHBondContact O-N 3.08Å; E413-Q415 VanDerWaalsContact C-N 3.31Å; E413-Q415 PolarHBondContact O-N 2.98Å; E413-T416 WeakPolarHBondContact O-CA 3.48Å; E413-T416 VanDerWaalsContact O-CB 3.27Å; E413-T416 WeakPolarHBondContact O-CB 3.39Å; E413-T416 PolarHBondContact O-N 3.38Å; E413-Y417 HydrophobicContact CB-CE1 4.2Å; E413-Y417 HydrophobicContact CB-CE2 4.04Å; E413-Y417 VanDerWaalsContact O-CD1 3.23Å; E413-Y417 WeakPolarHBondContact O-CD1 3.13Å; E413-Y417 VanDerWaalsContact O-CG 3.29Å; E413-Y417 PolarHBondContact O-N 3.44Å; E413-Y417 WeakPolarHBondContact OE2-CE1 3.43Å; E413-Y417 PolarHBondContact OE2-OH 2.84Å
414	F	94.6	Very high	91.3	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-61	-35.8	-179.4	-66.6	0.6	0	0	0	113	L395 L398 V410 L411 T416 Y417 I418 T429 A432 I433	L395-F414 HydrophobicContact CD1-CD1 3.93Å; L395-F414 HydrophobicContact CD1-CE1 3.49Å; L395-F414 VanDerWaalsContact CD1-CE1 3.49Å; L395-F414 HydrophobicContact CD1-CE2 4.37Å; L395-F414 HydrophobicContact CD1-CZ 3.73Å; L398-F414 HydrophobicContact CB-CE1 4Å; L398-F414 HydrophobicContact CB-CZ 4.14Å; L398-F414 HydrophobicContact CD1-CE1 4.22Å; V410-F414 HydrophobicContact CG1-CD1 4.16Å; V410-F414 HydrophobicContact CG1-CD2 4.26Å; V410-F414 HydrophobicContact CG1-CE1 3.6Å; V410-F414 HydrophobicContact CG1-CE2 3.75Å; V410-F414 HydrophobicContact CG1-CG 4.47Å; V410-F414 HydrophobicContact CG1-CZ 3.39Å; V410-F414 WeakPolarHBondContact O-CD1 3.37Å; V410-F414 WeakPolarHBondContact O-CG 3.43Å; V410-F414 PolarHBondContact O-N 3.35Å; L411-F414 HydrophobicContact CD2-CD2 4.15Å; L411-F414 PolarHBondContact O-N 2.61Å; F414-T416 VanDerWaalsContact C-N 3.26Å; F414-T416 PolarHBondContact O-N 3.41Å; F414-Y417 AromaticContact CD1-CD2 3.85Å; F414-Y417 HydrophobicContact CD1-CD2 3.85Å; F414-Y417 AromaticContact CD1-CE2 3.96Å; F414-Y417 HydrophobicContact CD1-CE2 3.96Å; F414-Y417 HydrophobicContact CE1-CE2 4.35Å; F414-Y417 PolarHBondContact O-N 3.11Å; F414-I418 WeakPolarHBondContact O-CG1 3.36Å; F414-I418 PolarHBondContact O-N 3.15Å; F414-T429 HydrophobicContact CB-CG2 3.93Å; F414-T429 HydrophobicContact CG-CG2 4.29Å; F414-A432 HydrophobicContact CE2-CB 3.91Å; F414-A432 HydrophobicContact CZ-CB 4.3Å; F414-I433 HydrophobicContact CB-CD1 4.14Å; F414-I433 HydrophobicContact CB-CG1 4.06Å; F414-I433 HydrophobicContact CD2-CG1 3.73Å; F414-I433 HydrophobicContact CG-CG1 4.38Å
415	Q	91.8	Very high	91.6	Very high	118 Å²	118	65.1 Å²	65.1	55%	0.551	32%	0.324	S	S	*	.	H	α-helix	trans	-62.5	-30.3	171.6	-78.5	174.2	-1.2	0	0	113.3	L411 E413	L411-Q415 WeakPolarHBondContact O-CB 3.3Å; L411-Q415 VanDerWaalsContact O-CG 3.27Å; L411-Q415 WeakPolarHBondContact O-CG 3.15Å; L411-Q415 PolarHBondContact O-N 3.1Å; E413-Q415 VanDerWaalsContact C-N 3.31Å; E413-Q415 PolarHBondContact O-N 2.98Å
416	T	91.4	Very high	91.8	Very high	86 Å²	86	59.6 Å²	59.6	53%	0.528	29%	0.29	S	S	.	.	H	α-helix	trans	-75.7	-41.3	172.5	-55.3	0	0	0	0	110.5	R412 E413 F414 I418 R419	R412-T416 PolarHBondContact O-N 2.66Å; R412-T416 PolarHBondContact O-OG1 3.09Å; R412-T416 VanDerWaalsContact O-OG1 3.13Å; E413-T416 WeakPolarHBondContact O-CA 3.48Å; E413-T416 VanDerWaalsContact O-CB 3.27Å; E413-T416 WeakPolarHBondContact O-CB 3.39Å; E413-T416 PolarHBondContact O-N 3.38Å; F414-T416 VanDerWaalsContact C-N 3.26Å; F414-T416 PolarHBondContact O-N 3.41Å; T416-I418 VanDerWaalsContact C-N 3.33Å; T416-I418 PolarHBondContact O-N 2.93Å; T416-R419 WeakPolarHBondContact O-CB 3.17Å; T416-R419 PolarHBondContact O-N 3.38Å
417	Y	93.9	Very high	91.8	Very high	14 Å²	14	59.7 Å²	59.7	6%	0.055	29%	0.293	C	S	.	.	H	α-helix	trans	-65	-33.6	-177.8	-59.3	-9.7	0	0	0	112.9	I382 L395 L398 E413 F414 R419 S420 F425	I382-Y417 HydrophobicContact CB-CE1 4.14Å; I382-Y417 HydrophobicContact CB-CE2 4.1Å; I382-Y417 HydrophobicContact CD1-CD2 3.95Å; I382-Y417 HydrophobicContact CD1-CE2 3.63Å; I382-Y417 HydrophobicContact CG1-CE2 3.94Å; I382-Y417 PolarHBondContact N-OH 3.38Å; L395-Y417 HydrophobicContact CD1-CD2 4.5Å; L398-Y417 HydrophobicContact CD1-CE2 4.16Å; E413-Y417 HydrophobicContact CB-CE1 4.2Å; E413-Y417 HydrophobicContact CB-CE2 4.04Å; E413-Y417 VanDerWaalsContact O-CD1 3.23Å; E413-Y417 WeakPolarHBondContact O-CD1 3.13Å; E413-Y417 VanDerWaalsContact O-CG 3.29Å; E413-Y417 PolarHBondContact O-N 3.44Å; E413-Y417 WeakPolarHBondContact OE2-CE1 3.43Å; E413-Y417 PolarHBondContact OE2-OH 2.84Å; F414-Y417 AromaticContact CD1-CD2 3.85Å; F414-Y417 HydrophobicContact CD1-CD2 3.85Å; F414-Y417 AromaticContact CD1-CE2 3.96Å; F414-Y417 HydrophobicContact CD1-CE2 3.96Å; F414-Y417 HydrophobicContact CE1-CE2 4.35Å; F414-Y417 PolarHBondContact O-N 3.11Å; Y417-R419 PolarHBondContact O-N 2.87Å; Y417-R419 VanDerWaalsContact O-N 3.17Å; Y417-S420 WeakPolarHBondContact O-CB 3.37Å; Y417-S420 PolarHBondContact O-N 2.94Å; Y417-S420 VanDerWaalsContact O-N 3.12Å; Y417-S420 PolarHBondContact O-OG 3.01Å; Y417-F425 AromaticContact CD2-CZ 3.86Å; Y417-F425 HydrophobicContact CD2-CZ 3.86Å; Y417-F425 HydrophobicContact CG-CE1 4.19Å; Y417-F425 AromaticContact CG-CZ 3.81Å; Y417-F425 HydrophobicContact CG-CZ 3.81Å
418	I	90.9	Very high	91.7	Very high	31 Å²	31	60.8 Å²	60.8	16%	0.159	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.9	171.8	-71.6	159.9	0	0	0	112.9	F414 T416 S420 V426 T429 I430 I433 L454	F414-I418 WeakPolarHBondContact O-CG1 3.36Å; F414-I418 PolarHBondContact O-N 3.15Å; T416-I418 VanDerWaalsContact C-N 3.33Å; T416-I418 PolarHBondContact O-N 2.93Å; I418-S420 VanDerWaalsContact C-N 3.29Å; I418-S420 PolarHBondContact O-N 3.39Å; I418-V426 HydrophobicContact CG2-CG1 4.31Å; I418-V426 WeakPolarHBondContact O-CG2 3.3Å; I418-T429 HydrophobicContact CG1-CG2 3.97Å; I418-I430 HydrophobicContact CG1-CG1 4.5Å; I418-I433 HydrophobicContact CD1-CD1 3.49Å; I418-I433 VanDerWaalsContact CD1-CD1 3.49Å; I418-I433 HydrophobicContact CG1-CD1 4.43Å; I418-L454 HydrophobicContact CD1-CD1 3.99Å; I418-L454 HydrophobicContact CG2-CD1 4.36Å; I418-L454 HydrophobicContact CG2-CD2 3.83Å
419	R	89.5	Confident	91.8	Very high	209 Å²	209	57 Å²	57	79%	0.789	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	5.1	-179.4	-57.6	-179.2	180	-170.2	-1.9	113.8	T416 Y417	T416-R419 WeakPolarHBondContact O-CB 3.17Å; T416-R419 PolarHBondContact O-N 3.38Å; Y417-R419 PolarHBondContact O-N 2.87Å; Y417-R419 VanDerWaalsContact O-N 3.17Å
420	S	88.9	Confident	91.9	Very high	32 Å²	32	54.2 Å²	54.2	22%	0.224	26%	0.261	C	S	.	.	S	Bend	trans	-76.1	162	179.3	66.9	0	0	0	0	112.6	Y417 I418 D422 F425 V426	Y417-S420 WeakPolarHBondContact O-CB 3.37Å; Y417-S420 PolarHBondContact O-N 2.94Å; Y417-S420 VanDerWaalsContact O-N 3.12Å; Y417-S420 PolarHBondContact O-OG 3.01Å; I418-S420 VanDerWaalsContact C-N 3.29Å; I418-S420 PolarHBondContact O-N 3.39Å; S420-D422 VanDerWaalsContact C-N 3.34Å; S420-F425 WeakPolarHBondContact OG-CD1 3.24Å; S420-V426 WeakPolarHBondContact OG-CG2 3.24Å
421	M	88.4	Confident	91.7	Very high	158 Å²	158	55.3 Å²	55.3	78%	0.778	27%	0.266	S	S	*	.	S	Bend	trans	-77.1	-23	-179.5	-58.2	-62.6	95.9	0	0	112.9	K423	M421-K423 PolarHBondContact O-N 3.47Å
422	D	90.5	Very high	91.7	Very high	31 Å²	31	54.4 Å²	54.4	17%	0.166	26%	0.261	C	S	.	.			trans	-78.8	99.2	-175.5	-179	-22	0	0	0	110.3	T388 S420 D424 F425 V426	T388-D422 WeakPolarHBondContact CB-OD2 3.3Å; T388-D422 WeakPolarHBondContact CG2-OD2 3.46Å; T388-D422 PolarHBondContact OG1-OD2 3.35Å; S420-D422 VanDerWaalsContact C-N 3.34Å; D422-D424 PolarHBondContact O-N 3.4Å; D422-D424 PolarHBondContact OD1-N 3.44Å; D422-F425 HydrophobicContact CB-CB 3.96Å; D422-F425 PolarHBondContact O-N 3.34Å; D422-F425 WeakPolarHBondContact OD1-CB 3.32Å; D422-F425 PolarHBondContact OD1-N 3.09Å; D422-V426 WeakPolarHBondContact O-CG2 3.32Å; D422-V426 PolarHBondContact O-N 3.44Å
423	K	89.7	Confident	91.8	Very high	69 Å²	69	47.3 Å²	47.3	30%	0.3	24%	0.235	S	C	.	.	H	α-helix	trans	-69.2	-31.8	-170.7	-54.8	-57.9	178.7	178.2	0	113.1	M421 V426 A427 D459 L461	M421-K423 PolarHBondContact O-N 3.47Å; K423-V426 PolarHBondContact O-N 3.4Å; K423-A427 PolarHBondContact O-N 2.97Å; K423-D459 WeakPolarHBondContact CE-OD1 3.27Å; K423-D459 IonicContact NZ-OD1 3.29Å; K423-D459 PolarHBondContact NZ-OD1 2.93Å; K423-D459 VanDerWaalsContact NZ-OD1 3.09Å; K423-D459 IonicContact NZ-OD2 3.78Å; K423-D459 PolarHBondContact NZ-OD2 2.9Å; K423-L461 HydrophobicContact CB-CD1 4.07Å
424	D	89.9	Confident	91.6	Very high	107 Å²	107	44.9 Å²	44.9	57%	0.572	22%	0.224	S	C	*	.	H	α-helix	trans	-70.6	-40.6	177.4	-62.2	-35.7	0	0	0	110.7	D422 A427 A428	D422-D424 PolarHBondContact O-N 3.4Å; D422-D424 PolarHBondContact OD1-N 3.44Å; D424-A427 PolarHBondContact O-N 2.94Å; D424-A428 WeakPolarHBondContact O-CB 3.47Å; D424-A428 PolarHBondContact O-N 3.04Å
425	F	93.1	Very high	91.3	Very high	3 Å²	3	46.2 Å²	46.2	1%	0.013	23%	0.229	C	C	.	.	H	α-helix	trans	-65.3	-36.5	171.1	173.6	-120.6	0	0	0	112.9	I382 K391 L395 Y417 S420 D422 A428 T429	I382-F425 HydrophobicContact CB-CZ 4.46Å; I382-F425 HydrophobicContact CD1-CE2 3.56Å; I382-F425 HydrophobicContact CD1-CZ 3.53Å; I382-F425 HydrophobicContact CG2-CE1 4.42Å; I382-F425 HydrophobicContact CG2-CZ 3.97Å; K391-F425 HydrophobicContact CB-CD2 3.6Å; K391-F425 HydrophobicContact CB-CE2 3.74Å; K391-F425 HydrophobicContact CB-CG 4.03Å; K391-F425 HydrophobicContact CB-CZ 4.25Å; K391-F425 HydrophobicContact CD-CD1 3.77Å; K391-F425 HydrophobicContact CD-CD2 4.36Å; K391-F425 HydrophobicContact CD-CE1 3.99Å; K391-F425 HydrophobicContact CD-CG 3.97Å; K391-F425 HydrophobicContact CD-CZ 4.4Å; L395-F425 HydrophobicContact CB-CE2 4.24Å; L395-F425 HydrophobicContact CD2-CD2 4.45Å; L395-F425 HydrophobicContact CD2-CE2 4.15Å; Y417-F425 AromaticContact CD2-CZ 3.86Å; Y417-F425 HydrophobicContact CD2-CZ 3.86Å; Y417-F425 HydrophobicContact CG-CE1 4.19Å; Y417-F425 AromaticContact CG-CZ 3.81Å; Y417-F425 HydrophobicContact CG-CZ 3.81Å; S420-F425 WeakPolarHBondContact OG-CD1 3.24Å; D422-F425 HydrophobicContact CB-CB 3.96Å; D422-F425 PolarHBondContact O-N 3.34Å; D422-F425 WeakPolarHBondContact OD1-CB 3.32Å; D422-F425 PolarHBondContact OD1-N 3.09Å; F425-A428 PolarHBondContact O-N 2.66Å; F425-T429 WeakPolarHBondContact O-CB 3.44Å; F425-T429 PolarHBondContact O-N 2.86Å; F425-T429 PolarHBondContact O-OG1 3.12Å
426	V	93.3	Very high	91.3	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-43.3	172.5	173	0	0	0	0	111.4	I418 S420 D422 K423 T429 I430 V462	I418-V426 HydrophobicContact CG2-CG1 4.31Å; I418-V426 WeakPolarHBondContact O-CG2 3.3Å; S420-V426 WeakPolarHBondContact OG-CG2 3.24Å; D422-V426 WeakPolarHBondContact O-CG2 3.32Å; D422-V426 PolarHBondContact O-N 3.44Å; K423-V426 PolarHBondContact O-N 3.4Å; V426-T429 WeakPolarHBondContact O-CB 3.33Å; V426-T429 PolarHBondContact O-N 3.41Å; V426-I430 HydrophobicContact CG1-CD1 3.89Å; V426-I430 WeakPolarHBondContact O-CG1 3.44Å; V426-I430 PolarHBondContact O-N 2.7Å; V426-V462 HydrophobicContact CG1-CG1 4.48Å; V426-V462 HydrophobicContact CG1-CG2 3.81Å
427	A	90.8	Very high	91.2	Very high	17 Å²	17	36.7 Å²	36.7	14%	0.14	18%	0.179	C	C	.	.	H	α-helix	trans	-61.2	-45.4	175.5	0	0	0	0	0	111.7	K423 D424 T429 I430 Q431 E465	K423-A427 PolarHBondContact O-N 2.97Å; D424-A427 PolarHBondContact O-N 2.94Å; A427-T429 VanDerWaalsContact C-N 3.31Å; A427-T429 PolarHBondContact O-N 2.84Å; A427-I430 WeakPolarHBondContact O-CB 3.47Å; A427-I430 PolarHBondContact O-N 3.5Å; A427-I430 VanDerWaalsContact O-N 3.14Å; A427-Q431 PolarHBondContact O-N 3.02Å; A427-Q431 VanDerWaalsContact O-N 3.11Å; A427-E465 HydrophobicContact CB-CB 4.33Å; A427-E465 HydrophobicContact CB-CG 4.2Å
428	A	91.6	Very high	90.9	Very high	27 Å²	27	37.4 Å²	37.4	22%	0.223	19%	0.185	C	C	.	.	H	α-helix	trans	-58.3	-42.3	172.8	0	0	0	0	0	111.9	I392 L395 D424 F425 I430 Q431 A432	I392-A428 HydrophobicContact CG1-CB 4.27Å; L395-A428 VanDerWaalsContact CD2-C 3.43Å; L395-A428 HydrophobicContact CD2-CB 3.74Å; D424-A428 WeakPolarHBondContact O-CB 3.47Å; D424-A428 PolarHBondContact O-N 3.04Å; F425-A428 PolarHBondContact O-N 2.66Å; A428-I430 VanDerWaalsContact C-N 3.28Å; A428-I430 PolarHBondContact O-N 3.37Å; A428-Q431 PolarHBondContact O-N 3.3Å; A428-A432 PolarHBondContact O-N 3.37Å
429	T	94.6	Very high	90.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.6	-36	177.1	-58.4	0	0	0	0	111.8	L395 F414 I418 F425 V426 A427 A432 I433	L395-T429 HydrophobicContact CD1-CG2 4.42Å; F414-T429 HydrophobicContact CB-CG2 3.93Å; F414-T429 HydrophobicContact CG-CG2 4.29Å; I418-T429 HydrophobicContact CG1-CG2 3.97Å; F425-T429 WeakPolarHBondContact O-CB 3.44Å; F425-T429 PolarHBondContact O-N 2.86Å; F425-T429 PolarHBondContact O-OG1 3.12Å; V426-T429 WeakPolarHBondContact O-CB 3.33Å; V426-T429 PolarHBondContact O-N 3.41Å; A427-T429 VanDerWaalsContact C-N 3.31Å; A427-T429 PolarHBondContact O-N 2.84Å; T429-A432 WeakPolarHBondContact O-CB 3.31Å; T429-A432 PolarHBondContact O-N 3.25Å; T429-I433 HydrophobicContact CG2-CD1 4.36Å; T429-I433 WeakPolarHBondContact O-CG1 3.18Å; T429-I433 PolarHBondContact O-N 2.98Å
430	I	93.4	Very high	90.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68.5	-41.2	176.8	-73.3	161	0	0	0	111.4	I418 V426 A427 A428 I433 G434 L451 L454 V462 E465 V469	I418-I430 HydrophobicContact CG1-CG1 4.5Å; V426-I430 HydrophobicContact CG1-CD1 3.89Å; V426-I430 WeakPolarHBondContact O-CG1 3.44Å; V426-I430 PolarHBondContact O-N 2.7Å; A427-I430 WeakPolarHBondContact O-CB 3.47Å; A427-I430 PolarHBondContact O-N 3.5Å; A427-I430 VanDerWaalsContact O-N 3.14Å; A428-I430 VanDerWaalsContact C-N 3.28Å; A428-I430 PolarHBondContact O-N 3.37Å; I430-I433 PolarHBondContact O-N 2.87Å; I430-G434 PolarHBondContact O-N 3.37Å; I430-G434 VanDerWaalsContact O-N 3.08Å; I430-L451 HydrophobicContact CG2-CD2 3.82Å; I430-L454 HydrophobicContact CD1-CD1 3.97Å; I430-L454 HydrophobicContact CG1-CD1 3.91Å; I430-V462 HydrophobicContact CD1-CG1 3.86Å; I430-E465 HydrophobicContact CB-CG 4.43Å; I430-E465 HydrophobicContact CG2-CB 4.28Å; I430-E465 HydrophobicContact CG2-CG 4.06Å; I430-V469 HydrophobicContact CG2-CB 4.45Å; I430-V469 HydrophobicContact CG2-CG2 3.9Å
431	Q	91.2	Very high	90.4	Very high	23 Å²	23	31.3 Å²	31.3	11%	0.107	17%	0.174	C	C	.	.	H	α-helix	trans	-63.8	-40.5	171.1	-68.2	-69	1.3	0	0	112	A427 A428 I433 G434 R435 E465 V469	A427-Q431 PolarHBondContact O-N 3.02Å; A427-Q431 VanDerWaalsContact O-N 3.11Å; A428-Q431 PolarHBondContact O-N 3.3Å; Q431-I433 PolarHBondContact O-N 2.85Å; Q431-G434 CarbonylContact O-C 3.56Å; Q431-G434 WeakPolarHBondContact O-CA 3.32Å; Q431-G434 PolarHBondContact O-N 3.32Å; Q431-R435 PolarHBondContact O-N 2.98Å; Q431-E465 HydrophobicContact CG-CG 4.01Å; Q431-E465 WeakPolarHBondContact CG-OE1 3.15Å; Q431-E465 PolarHBondContact NE2-OE1 3.31Å; Q431-E465 PolarHBondContact NE2-OE2 3.28Å; Q431-V469 HydrophobicContact CG-CG2 4.41Å; Q431-V469 VanDerWaalsContact OE1-CG2 3.27Å
432	A	92	Very high	90.3	Very high	1 Å²	1	34 Å²	34	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-59.4	-45	176.1	0	0	0	0	0	112.6	L395 T399 F414 A428 T429 G434 R435 C436	L395-A432 HydrophobicContact CD1-CB 3.81Å; L395-A432 HydrophobicContact CD2-CB 4.15Å; L395-A432 HydrophobicContact CG-CB 3.93Å; T399-A432 HydrophobicContact CG2-CB 4.38Å; T399-A432 VanDerWaalsContact OG1-CB 3.31Å; T399-A432 WeakPolarHBondContact OG1-CB 3.11Å; F414-A432 HydrophobicContact CE2-CB 3.91Å; F414-A432 HydrophobicContact CZ-CB 4.3Å; A428-A432 PolarHBondContact O-N 3.37Å; T429-A432 WeakPolarHBondContact O-CB 3.31Å; T429-A432 PolarHBondContact O-N 3.25Å; A432-G434 VanDerWaalsContact C-N 3.27Å; A432-G434 PolarHBondContact O-N 3.43Å; A432-R435 PolarHBondContact O-N 2.99Å; A432-R435 VanDerWaalsContact O-N 3.12Å; A432-C436 PolarHBondContact O-N 3.3Å; A432-C436 PolarHBondContact O-SG 2.9Å; A432-C436 VanDerWaalsContact O-SG 3.39Å
433	I	93.2	Very high	90.2	Very high	13 Å²	13	33.7 Å²	33.7	7%	0.067	17%	0.174	C	C	.	.	H	α-helix	trans	-58	-41.5	171.5	-69.5	165.4	0	0	0	110.9	L411 F414 I418 T429 I430 Q431 R435 C436 A437 C447 L451	L411-I433 HydrophobicContact CD2-CG1 4.18Å; F414-I433 HydrophobicContact CB-CD1 4.14Å; F414-I433 HydrophobicContact CB-CG1 4.06Å; F414-I433 HydrophobicContact CD2-CG1 3.73Å; F414-I433 HydrophobicContact CG-CG1 4.38Å; I418-I433 HydrophobicContact CD1-CD1 3.49Å; I418-I433 VanDerWaalsContact CD1-CD1 3.49Å; I418-I433 HydrophobicContact CG1-CD1 4.43Å; T429-I433 HydrophobicContact CG2-CD1 4.36Å; T429-I433 WeakPolarHBondContact O-CG1 3.18Å; T429-I433 PolarHBondContact O-N 2.98Å; I430-I433 PolarHBondContact O-N 2.87Å; Q431-I433 PolarHBondContact O-N 2.85Å; I433-R435 PolarHBondContact O-N 3.36Å; I433-C436 PolarHBondContact O-N 3.41Å; I433-A437 WeakPolarHBondContact O-CB 3.37Å; I433-A437 PolarHBondContact O-N 2.8Å; I433-C447 HydrophobicContact CG2-CB 3.86Å; I433-L451 HydrophobicContact CG2-CD2 4.43Å; I433-L451 HydrophobicContact CG2-CG 4.42Å
434	G	90.6	Very high	90.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58.1	-43.9	173.2	0	0	0	0	0	113.5	I430 Q431 A432 A437 T438 V469 L612	I430-G434 PolarHBondContact O-N 3.37Å; I430-G434 VanDerWaalsContact O-N 3.08Å; Q431-G434 CarbonylContact O-C 3.56Å; Q431-G434 WeakPolarHBondContact O-CA 3.32Å; Q431-G434 PolarHBondContact O-N 3.32Å; A432-G434 VanDerWaalsContact C-N 3.27Å; A432-G434 PolarHBondContact O-N 3.43Å; G434-A437 PolarHBondContact O-N 3.12Å; G434-T438 PolarHBondContact O-N 3.13Å; G434-T438 PolarHBondContact O-OG1 3.27Å; G434-V469 VanDerWaalsContact CA-CG1 3.42Å; G434-L612 WeakPolarHBondContact O-CD2 3.37Å
435	R	89	Confident	89.9	Confident	29 Å²	29	30.9 Å²	30.9	11%	0.109	16%	0.159	C	C	.	.	H	α-helix	trans	-66.3	-44	179.2	-66.3	-169.3	-162	126.3	3.6	110.6	E396 T399 Q431 A432 I433 A437 T438 N439 L612 E613	E396-R435 IonicContact OE1-CZ 2.81Å; E396-R435 IonicContact OE1-NH1 3.49Å; E396-R435 PolarHBondContact OE1-NH1 3.19Å; E396-R435 IonicContact OE2-CZ 2.68Å; E396-R435 IonicContact OE2-NH1 2.65Å; E396-R435 PolarHBondContact OE2-NH1 2.71Å; E396-R435 IonicContact OE2-NH2 3.59Å; T399-R435 HydrophobicContact CG2-CB 3.81Å; Q431-R435 PolarHBondContact O-N 2.98Å; A432-R435 PolarHBondContact O-N 2.99Å; A432-R435 VanDerWaalsContact O-N 3.12Å; I433-R435 PolarHBondContact O-N 3.36Å; R435-A437 PolarHBondContact O-N 3.04Å; R435-T438 WeakPolarHBondContact O-CB 3.43Å; R435-T438 PolarHBondContact O-N 2.89Å; R435-N439 WeakPolarHBondContact O-CB 3.33Å; R435-N439 VanDerWaalsContact O-CG 3.28Å; R435-N439 PolarHBondContact O-N 3.15Å; R435-L612 HydrophobicContact CB-CD2 4.36Å; R435-L612 HydrophobicContact CG-CD2 3.73Å; R435-L612 HydrophobicContact CG-CG 3.82Å; R435-L612 VanDerWaalsContact N-CD2 3.26Å; R435-E613 PolarHBondContact NE-O 3.14Å; R435-E613 PolarHBondContact NH2-O 2.76Å
436	C	90.3	Very high	89.6	Confident	3 Å²	3	35.3 Å²	35.3	2%	0.02	19%	0.186	C	C	.	.	H	α-helix	trans	-57.3	-45.4	173	-66.8	0	0	0	0	112.5	I407 A432 I433 T438 N439 I440	I407-C436 HydrophobicContact CD1-CB 3.77Å; A432-C436 PolarHBondContact O-N 3.3Å; A432-C436 PolarHBondContact O-SG 2.9Å; A432-C436 VanDerWaalsContact O-SG 3.39Å; I433-C436 PolarHBondContact O-N 3.41Å; C436-T438 VanDerWaalsContact C-N 3.29Å; C436-T438 PolarHBondContact O-N 2.95Å; C436-N439 PolarHBondContact O-N 3.41Å; C436-I440 WeakPolarHBondContact O-CB 3.5Å; C436-I440 PolarHBondContact O-N 2.9Å
437	A	89.7	Confident	89.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-70.5	-22.1	178.4	0	0	0	0	0	114.2	I433 G434 R435 R444 C447 L473	I433-A437 WeakPolarHBondContact O-CB 3.37Å; I433-A437 PolarHBondContact O-N 2.8Å; G434-A437 PolarHBondContact O-N 3.12Å; R435-A437 PolarHBondContact O-N 3.04Å; A437-R444 HydrophobicContact CB-CG 4.48Å; A437-R444 PolarHBondContact O-NE 2.67Å; A437-C447 HydrophobicContact CB-CB 3.66Å; A437-L473 HydrophobicContact CB-CD1 3.99Å; A437-L473 HydrophobicContact CB-CD2 3.86Å
438	T	87.4	Confident	89.3	Confident	30 Å²	30	34.8 Å²	34.8	18%	0.184	18%	0.182	C	C	.	.	H	α-helix	trans	-75.8	-53	172	-54.6	0	0	0	0	109.6	G434 R435 C436 R444 L473	G434-T438 PolarHBondContact O-N 3.13Å; G434-T438 PolarHBondContact O-OG1 3.27Å; R435-T438 WeakPolarHBondContact O-CB 3.43Å; R435-T438 PolarHBondContact O-N 2.89Å; C436-T438 VanDerWaalsContact C-N 3.29Å; C436-T438 PolarHBondContact O-N 2.95Å; T438-R444 PolarHBondContact O-NH2 3.36Å; T438-L473 WeakPolarHBondContact OG1-CD2 3.17Å
439	N	85.6	Confident	89.1	Confident	101 Å²	101	37.5 Å²	37.5	54%	0.54	19%	0.193	S	C	.	.	H	α-helix	trans	-70.2	-39.9	-175.2	-66.1	-10.7	0	0	0	113.7	R435 C436	R435-N439 WeakPolarHBondContact O-CB 3.33Å; R435-N439 VanDerWaalsContact O-CG 3.28Å; R435-N439 PolarHBondContact O-N 3.15Å; C436-N439 PolarHBondContact O-N 3.41Å
440	I	88.7	Confident	88.7	Confident	9 Å²	9	38.8 Å²	38.8	5%	0.046	21%	0.206	C	C	.	.			trans	-112.3	98.1	-174	-54.8	174.8	0	0	0	109.5	A402 E404 I407 C436 R442 V443	A402-I440 HydrophobicContact CB-CD1 4.47Å; E404-I440 HydrophobicContact CG-CG2 4.17Å; I407-I440 HydrophobicContact CB-CD1 3.81Å; I407-I440 HydrophobicContact CD1-CD1 4.25Å; I407-I440 HydrophobicContact CG1-CD1 3.95Å; I407-I440 HydrophobicContact CG2-CD1 4.07Å; I407-I440 HydrophobicContact CG2-CG2 4.5Å; C436-I440 WeakPolarHBondContact O-CB 3.5Å; C436-I440 PolarHBondContact O-N 2.9Å; I440-R442 VanDerWaalsContact C-N 3.32Å; I440-R442 PolarHBondContact O-N 2.92Å; I440-V443 HydrophobicContact CG2-CG2 3.92Å; I440-V443 PolarHBondContact O-N 3.17Å
441	G	85.1	Confident	88.6	Confident	34 Å²	34	38.9 Å²	38.9	35%	0.351	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-59.3	-37.7	-174	0	0	0	0	0	114.4	V443 R444	G441-V443 PolarHBondContact O-N 3.5Å; G441-V443 VanDerWaalsContact O-N 3.09Å; G441-R444 WeakPolarHBondContact O-CB 3.39Å; G441-R444 PolarHBondContact O-N 3.13Å
442	R	87.4	Confident	88.3	Confident	215 Å²	215	38.5 Å²	38.5	81%	0.811	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-58.1	-25.2	-176.9	-176.4	175.4	179.8	179.4	1.6	114.6	I440	I440-R442 VanDerWaalsContact C-N 3.32Å; I440-R442 PolarHBondContact O-N 2.92Å
443	V	87.3	Confident	88	Confident	23 Å²	23	45.3 Å²	45.3	14%	0.139	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-107.7	-5.2	-170.8	-164.2	0	0	0	0	112.1	I407 L411 I440 G441 D445 T446 C447	I407-V443 HydrophobicContact CG1-CG1 4.46Å; I407-V443 HydrophobicContact CG1-CG2 4.22Å; I407-V443 HydrophobicContact CG2-CG2 3.88Å; L411-V443 HydrophobicContact CD1-CG1 3.36Å; I440-V443 HydrophobicContact CG2-CG2 3.92Å; I440-V443 PolarHBondContact O-N 3.17Å; G441-V443 PolarHBondContact O-N 3.5Å; G441-V443 VanDerWaalsContact O-N 3.09Å; V443-D445 PolarHBondContact O-N 2.95Å; V443-T446 WeakPolarHBondContact O-CB 3.35Å; V443-T446 PolarHBondContact O-N 3.03Å; V443-T446 VanDerWaalsContact O-N 3.09Å; V443-C447 PolarHBondContact O-N 3.5Å
444	R	87.1	Confident	87.7	Confident	40 Å²	40	45.8 Å²	45.8	15%	0.151	24%	0.24	C	C	.	.	H	α-helix	trans	-54.5	-48.6	-172.6	-173	176.5	-63.4	140.1	2.4	113.4	A437 T438 G441 T446 C447 L448 Q477	A437-R444 HydrophobicContact CB-CG 4.48Å; A437-R444 PolarHBondContact O-NE 2.67Å; T438-R444 PolarHBondContact O-NH2 3.36Å; G441-R444 WeakPolarHBondContact O-CB 3.39Å; G441-R444 PolarHBondContact O-N 3.13Å; R444-T446 VanDerWaalsContact C-N 3.35Å; R444-T446 PolarHBondContact O-N 3.33Å; R444-C447 PolarHBondContact O-N 2.93Å; R444-L448 VanDerWaalsContact O-CB 3.27Å; R444-L448 WeakPolarHBondContact O-CB 3.46Å; R444-L448 PolarHBondContact O-N 3.2Å; R444-Q477 VanDerWaalsContact CD-OE1 3.32Å
445	D	85.9	Confident	87.3	Confident	78 Å²	78	46.2 Å²	46.2	42%	0.417	24%	0.242	S	C	.	.	H	α-helix	trans	-66.9	-34.1	179.8	-66.9	-60.2	0	0	0	112.8	V443 L448 N449 H481	V443-D445 PolarHBondContact O-N 2.95Å; D445-L448 PolarHBondContact O-N 3.13Å; D445-N449 WeakPolarHBondContact O-CB 3.48Å; D445-N449 PolarHBondContact O-N 3.35Å; D445-N449 PolarHBondContact O-ND2 3.39Å; D445-H481 IonicContact OD1-CE1 2.72Å; D445-H481 PolarHBondContact OD1-CE1 3.15Å
446	T	87.9	Confident	87.1	Confident	95 Å²	95	49 Å²	49	58%	0.583	27%	0.266	S	S	*	.	H	α-helix	trans	-66.1	-45.3	175.3	-48	0	0	0	0	110.7	V443 R444 G450	V443-T446 WeakPolarHBondContact O-CB 3.35Å; V443-T446 PolarHBondContact O-N 3.03Å; V443-T446 VanDerWaalsContact O-N 3.09Å; R444-T446 VanDerWaalsContact C-N 3.35Å; R444-T446 PolarHBondContact O-N 3.33Å; T446-G450 PolarHBondContact O-N 3.13Å
447	C	89.8	Confident	86.7	Confident	8 Å²	8	52.2 Å²	52.2	5%	0.054	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-45.1	173.8	-67	0	0	0	0	111.8	I433 A437 V443 R444 G450 L451	I433-C447 HydrophobicContact CG2-CB 3.86Å; A437-C447 HydrophobicContact CB-CB 3.66Å; V443-C447 PolarHBondContact O-N 3.5Å; R444-C447 PolarHBondContact O-N 2.93Å; C447-G450 PolarHBondContact O-N 3.38Å; C447-L451 VanDerWaalsContact O-CG 3.29Å; C447-L451 WeakPolarHBondContact O-CG 3.36Å; C447-L451 PolarHBondContact O-N 2.9Å
448	L	87.4	Confident	86.2	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-63.8	-43.2	-177.6	-169.1	66.9	0	0	0	111.8	R444 D445 L451 V452 I470 L473 L474 I484	R444-L448 VanDerWaalsContact O-CB 3.27Å; R444-L448 WeakPolarHBondContact O-CB 3.46Å; R444-L448 PolarHBondContact O-N 3.2Å; D445-L448 PolarHBondContact O-N 3.13Å; L448-L451 PolarHBondContact O-N 3.32Å; L448-V452 VanDerWaalsContact O-CG2 3.29Å; L448-V452 WeakPolarHBondContact O-CG2 3.26Å; L448-V452 PolarHBondContact O-N 3.33Å; L448-I470 HydrophobicContact CD1-CB 4.47Å; L448-I470 HydrophobicContact CD1-CG1 4.2Å; L448-I470 HydrophobicContact CD1-CG2 4.25Å; L448-L473 HydrophobicContact CD1-CB 4.22Å; L448-L473 HydrophobicContact CD1-CD1 4.12Å; L448-L474 HydrophobicContact CD2-CD2 4.1Å; L448-I484 HydrophobicContact CD2-CD1 3.43Å; L448-I484 VanDerWaalsContact CD2-CD1 3.43Å; L448-I484 HydrophobicContact CG-CD1 3.86Å
449	N	86.4	Confident	86.1	Confident	85 Å²	85	65.9 Å²	65.9	46%	0.455	34%	0.336	S	S	.	.	H	α-helix	trans	-65.1	-38.9	173.5	-76.3	-65.1	0	0	0	112.2	D445 V452 Q453	D445-N449 WeakPolarHBondContact O-CB 3.48Å; D445-N449 PolarHBondContact O-N 3.35Å; D445-N449 PolarHBondContact O-ND2 3.39Å; N449-V452 PolarHBondContact O-N 2.89Å; N449-Q453 WeakPolarHBondContact O-CG 3.39Å; N449-Q453 PolarHBondContact O-N 3.46Å; N449-Q453 VanDerWaalsContact O-N 3.16Å
450	G	88	Confident	86	Confident	27 Å²	27	66.2 Å²	66.2	28%	0.278	33%	0.334	S	S	.	.	H	α-helix	trans	-61.6	-46.8	173.7	0	0	0	0	0	112.6	T446 C447 V452 Q453 L454	T446-G450 PolarHBondContact O-N 3.13Å; C447-G450 PolarHBondContact O-N 3.38Å; G450-V452 VanDerWaalsContact C-N 3.3Å; G450-V452 PolarHBondContact O-N 3.42Å; G450-Q453 WeakPolarHBondContact O-CB 3.42Å; G450-Q453 PolarHBondContact O-N 3.18Å; G450-Q453 VanDerWaalsContact O-N 3.11Å; G450-L454 PolarHBondContact O-N 2.93Å
451	L	89.7	Confident	85.9	Confident	2 Å²	2	70.4 Å²	70.4	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-60.9	-37.5	176	-69.1	168.4	0	0	0	112.2	I430 I433 C447 L448 Q453 L454 V469 I470 L473	I430-L451 HydrophobicContact CG2-CD2 3.82Å; I433-L451 HydrophobicContact CG2-CD2 4.43Å; I433-L451 HydrophobicContact CG2-CG 4.42Å; C447-L451 VanDerWaalsContact O-CG 3.29Å; C447-L451 WeakPolarHBondContact O-CG 3.36Å; C447-L451 PolarHBondContact O-N 2.9Å; L448-L451 PolarHBondContact O-N 3.32Å; L451-Q453 VanDerWaalsContact C-N 3.31Å; L451-Q453 PolarHBondContact O-N 3.24Å; L451-L454 HydrophobicContact CD2-CD1 4.32Å; L451-L454 WeakPolarHBondContact O-CB 3.37Å; L451-L454 PolarHBondContact O-N 3.38Å; L451-V469 HydrophobicContact CD1-CB 4.23Å; L451-V469 HydrophobicContact CD1-CG1 3.52Å; L451-I470 HydrophobicContact CB-CD1 3.9Å; L451-I470 HydrophobicContact CB-CG1 3.72Å; L451-I470 HydrophobicContact CD1-CG1 4.29Å; L451-L473 HydrophobicContact CD1-CD1 3.85Å
452	V	86.4	Confident	86.1	Confident	14 Å²	14	69 Å²	69	9%	0.085	34%	0.341	C	S	.	.	H	α-helix	trans	-64.5	-34.7	175.3	169.7	0	0	0	0	111.7	L448 N449 G450 L455 I470 I484	L448-V452 VanDerWaalsContact O-CG2 3.29Å; L448-V452 WeakPolarHBondContact O-CG2 3.26Å; L448-V452 PolarHBondContact O-N 3.33Å; N449-V452 PolarHBondContact O-N 2.89Å; G450-V452 VanDerWaalsContact C-N 3.3Å; G450-V452 PolarHBondContact O-N 3.42Å; V452-L455 WeakPolarHBondContact O-CB 3.39Å; V452-L455 WeakPolarHBondContact O-CG 3.45Å; V452-L455 PolarHBondContact O-N 2.87Å; V452-I470 HydrophobicContact CG2-CD1 3.94Å; V452-I484 HydrophobicContact CG2-CG2 3.8Å
453	Q	85.3	Confident	86	Confident	144 Å²	144	59.1 Å²	59.1	67%	0.673	30%	0.304	S	S	*	.	H	α-helix	trans	-65.9	-36.6	173.6	-67.6	171.5	-1.1	0	0	112	N449 G450 L451 L455 S456	N449-Q453 WeakPolarHBondContact O-CG 3.39Å; N449-Q453 PolarHBondContact O-N 3.46Å; N449-Q453 VanDerWaalsContact O-N 3.16Å; G450-Q453 WeakPolarHBondContact O-CB 3.42Å; G450-Q453 PolarHBondContact O-N 3.18Å; G450-Q453 VanDerWaalsContact O-N 3.11Å; L451-Q453 VanDerWaalsContact C-N 3.31Å; L451-Q453 PolarHBondContact O-N 3.24Å; Q453-L455 PolarHBondContact O-N 3.38Å; Q453-L455 VanDerWaalsContact O-N 3.14Å; Q453-S456 PolarHBondContact O-N 2.89Å; Q453-S456 VanDerWaalsContact O-N 3.09Å
454	L	86.7	Confident	86	Confident	24 Å²	24	58.7 Å²	58.7	13%	0.126	30%	0.303	C	S	.	.	H	α-helix	trans	-63.6	-17.5	177.4	-58.3	-177.2	0	0	0	113.8	I418 I430 G450 L451 S456 N457 V462	I418-L454 HydrophobicContact CD1-CD1 3.99Å; I418-L454 HydrophobicContact CG2-CD1 4.36Å; I418-L454 HydrophobicContact CG2-CD2 3.83Å; I430-L454 HydrophobicContact CD1-CD1 3.97Å; I430-L454 HydrophobicContact CG1-CD1 3.91Å; G450-L454 PolarHBondContact O-N 2.93Å; L451-L454 HydrophobicContact CD2-CD1 4.32Å; L451-L454 WeakPolarHBondContact O-CB 3.37Å; L451-L454 PolarHBondContact O-N 3.38Å; L454-S456 PolarHBondContact O-N 3.27Å; L454-N457 VanDerWaalsContact O-CB 3.32Å; L454-N457 WeakPolarHBondContact O-CB 3.32Å; L454-N457 PolarHBondContact O-N 3.19Å; L454-N457 VanDerWaalsContact O-N 3.16Å; L454-N457 PolarHBondContact O-ND2 2.94Å; L454-V462 HydrophobicContact CB-CG1 4.47Å
455	L	82.7	Confident	86.1	Confident	8 Å²	8	58.8 Å²	58.8	4%	0.042	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-11.2	174.1	-55.3	-178.5	0	0	0	113.9	V452 Q453 V463 V467 I470 L488 L491	V452-L455 WeakPolarHBondContact O-CB 3.39Å; V452-L455 WeakPolarHBondContact O-CG 3.45Å; V452-L455 PolarHBondContact O-N 2.87Å; Q453-L455 PolarHBondContact O-N 3.38Å; Q453-L455 VanDerWaalsContact O-N 3.14Å; L455-V463 HydrophobicContact CD2-CG1 4.17Å; L455-V467 HydrophobicContact CD1-CG2 4.5Å; L455-V467 HydrophobicContact CD2-CG2 3.43Å; L455-V467 VanDerWaalsContact CD2-CG2 3.43Å; L455-I470 HydrophobicContact CD1-CD1 3.82Å; L455-I470 HydrophobicContact CD2-CD1 4.18Å; L455-I470 HydrophobicContact CG-CD1 4.14Å; L455-L488 HydrophobicContact CD1-CD2 3.26Å; L455-L491 HydrophobicContact CB-CD1 3.86Å; L455-L491 HydrophobicContact CD1-CD1 4.2Å
456	S	83.3	Confident	86.3	Confident	89 Å²	89	55.1 Å²	55.1	62%	0.622	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	1.8	173.9	-56.6	0	0	0	0	113.1	Q453 L454	Q453-S456 PolarHBondContact O-N 2.89Å; Q453-S456 VanDerWaalsContact O-N 3.09Å; L454-S456 PolarHBondContact O-N 3.27Å
457	N	83.1	Confident	86.3	Confident	70 Å²	70	50.6 Å²	50.6	37%	0.374	26%	0.258	S	S	.	.	S	Bend	trans	-71.5	155.1	173	-71.3	-37.3	0	0	0	111.5	L454 V462 V463	L454-N457 VanDerWaalsContact O-CB 3.32Å; L454-N457 WeakPolarHBondContact O-CB 3.32Å; L454-N457 PolarHBondContact O-N 3.19Å; L454-N457 VanDerWaalsContact O-N 3.16Å; L454-N457 PolarHBondContact O-ND2 2.94Å; N457-V462 HydrophobicContact CB-CG1 4.36Å; N457-V463 WeakPolarHBondContact O-CG2 3.18Å
458	R	79.7	Confident	86.1	Confident	251 Å²	251	51 Å²	51	95%	0.947	26%	0.26	S	S	*	.	S	Bend	trans	-81.9	-19.8	176.3	-61.3	-176.6	-177.9	-174.9	0.4	113.6	E460	R458-E460 PolarHBondContact O-N 3.06Å
459	D	84.3	Confident	86.1	Confident	65 Å²	65	50.9 Å²	50.9	35%	0.348	26%	0.26	S	S	.	.			trans	-75.6	114.8	-176.8	-68.5	-53.7	0	0	0	111.8	K423 L461 V462 V463	K423-D459 WeakPolarHBondContact CE-OD1 3.27Å; K423-D459 IonicContact NZ-OD1 3.29Å; K423-D459 PolarHBondContact NZ-OD1 2.93Å; K423-D459 VanDerWaalsContact NZ-OD1 3.09Å; K423-D459 IonicContact NZ-OD2 3.78Å; K423-D459 PolarHBondContact NZ-OD2 2.9Å; D459-L461 PolarHBondContact O-N 3.24Å; D459-V462 HydrophobicContact CB-CB 3.91Å; D459-V462 HydrophobicContact CB-CG2 3.6Å; D459-V462 WeakPolarHBondContact O-CB 3.39Å; D459-V462 PolarHBondContact O-N 3.33Å; D459-V462 VanDerWaalsContact O-N 3.16Å; D459-V463 PolarHBondContact O-N 3.04Å; D459-V463 VanDerWaalsContact O-N 3.14Å
460	E	84	Confident	86.2	Confident	108 Å²	108	46.9 Å²	46.9	51%	0.505	24%	0.238	S	C	.	.	H	α-helix	trans	-57.5	-45.4	-176	-69.9	-162.2	-169.7	0	0	113.9	R458 V462 V463 A464 V497	R458-E460 PolarHBondContact O-N 3.06Å; E460-V462 VanDerWaalsContact C-N 3.29Å; E460-V462 PolarHBondContact O-N 3Å; E460-V463 PolarHBondContact O-N 2.78Å; E460-A464 WeakPolarHBondContact O-CB 3.48Å; E460-A464 PolarHBondContact O-N 3.47Å; E460-V497 HydrophobicContact CB-CG2 3.5Å; E460-V497 VanDerWaalsContact CB-CG2 3.5Å; E460-V497 HydrophobicContact CG-CG2 3.64Å
461	L	85.9	Confident	86.1	Confident	98 Å²	98	48 Å²	48	51%	0.513	24%	0.236	S	C	.	.	H	α-helix	trans	-60.8	-38.5	179.1	-61.9	174.8	0	0	0	112.1	K423 D459 A464 E465	K423-L461 HydrophobicContact CB-CD1 4.07Å; D459-L461 PolarHBondContact O-N 3.24Å; L461-A464 PolarHBondContact O-N 2.94Å; L461-E465 PolarHBondContact O-N 3.39Å
462	V	88.8	Confident	85.9	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.024	25%	0.246	C	C	.	.	H	α-helix	trans	-67.7	-42.7	179.6	177	0	0	0	0	110.6	V426 I430 L454 N457 D459 E460 S466	V426-V462 HydrophobicContact CG1-CG1 4.48Å; V426-V462 HydrophobicContact CG1-CG2 3.81Å; I430-V462 HydrophobicContact CD1-CG1 3.86Å; L454-V462 HydrophobicContact CB-CG1 4.47Å; N457-V462 HydrophobicContact CB-CG1 4.36Å; D459-V462 HydrophobicContact CB-CB 3.91Å; D459-V462 HydrophobicContact CB-CG2 3.6Å; D459-V462 WeakPolarHBondContact O-CB 3.39Å; D459-V462 PolarHBondContact O-N 3.33Å; D459-V462 VanDerWaalsContact O-N 3.16Å; E460-V462 VanDerWaalsContact C-N 3.29Å; E460-V462 PolarHBondContact O-N 3Å; V462-S466 VanDerWaalsContact O-CB 3.24Å; V462-S466 WeakPolarHBondContact O-CB 3.38Å; V462-S466 PolarHBondContact O-N 2.95Å; V462-S466 VanDerWaalsContact O-N 3.08Å; V462-S466 PolarHBondContact O-OG 3.43Å
463	V	87.2	Confident	85.8	Confident	7 Å²	7	50 Å²	50	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-68.6	-42.4	175.8	179	0	0	0	0	111.1	L455 N457 D459 E460 E465 S466 V467 I495	L455-V463 HydrophobicContact CD2-CG1 4.17Å; N457-V463 WeakPolarHBondContact O-CG2 3.18Å; D459-V463 PolarHBondContact O-N 3.04Å; D459-V463 VanDerWaalsContact O-N 3.14Å; E460-V463 PolarHBondContact O-N 2.78Å; V463-E465 PolarHBondContact O-N 3.38Å; V463-S466 PolarHBondContact O-N 3.41Å; V463-V467 WeakPolarHBondContact O-CG2 3.36Å; V463-V467 PolarHBondContact O-N 3.09Å; V463-I495 HydrophobicContact CG1-CD1 4.22Å; V463-I495 HydrophobicContact CG1-CG1 4.07Å; V463-I495 HydrophobicContact CG1-CG2 3.96Å
464	A	85.8	Confident	85.7	Confident	14 Å²	14	43.1 Å²	43.1	12%	0.116	21%	0.211	C	C	.	.	H	α-helix	trans	-54.3	-54.7	176.9	0	0	0	0	0	111.6	E460 L461 V467 V468 V497	E460-A464 WeakPolarHBondContact O-CB 3.48Å; E460-A464 PolarHBondContact O-N 3.47Å; L461-A464 PolarHBondContact O-N 2.94Å; A464-V467 PolarHBondContact O-N 2.81Å; A464-V468 WeakPolarHBondContact O-CG2 3.31Å; A464-V468 PolarHBondContact O-N 3.49Å; A464-V468 VanDerWaalsContact O-N 3.08Å; A464-V497 HydrophobicContact CB-CG1 4.08Å
465	E	89.2	Confident	85.4	Confident	43 Å²	43	43.5 Å²	43.5	20%	0.201	21%	0.212	C	C	.	.	H	α-helix	trans	-73	-34.9	-173.9	-162.9	69.7	141.5	0	0	112.1	A427 I430 Q431 L461 V463 V467 V468 V469	A427-E465 HydrophobicContact CB-CB 4.33Å; A427-E465 HydrophobicContact CB-CG 4.2Å; I430-E465 HydrophobicContact CB-CG 4.43Å; I430-E465 HydrophobicContact CG2-CB 4.28Å; I430-E465 HydrophobicContact CG2-CG 4.06Å; Q431-E465 HydrophobicContact CG-CG 4.01Å; Q431-E465 WeakPolarHBondContact CG-OE1 3.15Å; Q431-E465 PolarHBondContact NE2-OE1 3.31Å; Q431-E465 PolarHBondContact NE2-OE2 3.28Å; L461-E465 PolarHBondContact O-N 3.39Å; V463-E465 PolarHBondContact O-N 3.38Å; E465-V467 PolarHBondContact O-N 2.98Å; E465-V468 PolarHBondContact O-N 3.35Å; E465-V469 WeakPolarHBondContact O-CG2 3.47Å; E465-V469 PolarHBondContact O-N 2.96Å
466	S	90.6	Very high	85	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59.4	-44.3	172.5	-62.3	0	0	0	0	111.7	V462 V463 V469 I470	V462-S466 VanDerWaalsContact O-CB 3.24Å; V462-S466 WeakPolarHBondContact O-CB 3.38Å; V462-S466 PolarHBondContact O-N 2.95Å; V462-S466 VanDerWaalsContact O-N 3.08Å; V462-S466 PolarHBondContact O-OG 3.43Å; V463-S466 PolarHBondContact O-N 3.41Å; S466-V469 PolarHBondContact O-N 3.46Å; S466-I470 WeakPolarHBondContact O-CB 3.33Å; S466-I470 WeakPolarHBondContact O-CD1 3.36Å; S466-I470 WeakPolarHBondContact O-CG1 3.32Å; S466-I470 PolarHBondContact O-N 3.45Å
467	V	87.3	Confident	84.5	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.1	-39.5	175.5	173.6	0	0	0	0	111.8	L455 V463 A464 E465 I470 K471 A500 I504	L455-V467 HydrophobicContact CD1-CG2 4.5Å; L455-V467 HydrophobicContact CD2-CG2 3.43Å; L455-V467 VanDerWaalsContact CD2-CG2 3.43Å; V463-V467 WeakPolarHBondContact O-CG2 3.36Å; V463-V467 PolarHBondContact O-N 3.09Å; A464-V467 PolarHBondContact O-N 2.81Å; E465-V467 PolarHBondContact O-N 2.98Å; V467-I470 PolarHBondContact O-N 2.65Å; V467-K471 VanDerWaalsContact O-CB 3.28Å; V467-K471 WeakPolarHBondContact O-CB 3.5Å; V467-K471 PolarHBondContact O-N 3.42Å; V467-A500 HydrophobicContact CB-CB 4.18Å; V467-A500 HydrophobicContact CG1-CB 4.46Å; V467-A500 HydrophobicContact CG2-CB 3.99Å; V467-I504 HydrophobicContact CG1-CD1 4.36Å; V467-I504 HydrophobicContact CG1-CG1 3.81Å; V467-I504 HydrophobicContact CG2-CD1 3.99Å; V467-I504 HydrophobicContact CG2-CG1 4.29Å
468	V	86	Confident	83.6	Confident	16 Å²	16	45.9 Å²	45.9	10%	0.097	22%	0.218	C	C	.	.	H	α-helix	trans	-61.5	-45.5	177.2	169.7	0	0	0	0	110.8	A464 E465 K471 K472 M499	A464-V468 WeakPolarHBondContact O-CG2 3.31Å; A464-V468 PolarHBondContact O-N 3.49Å; A464-V468 VanDerWaalsContact O-N 3.08Å; E465-V468 PolarHBondContact O-N 3.35Å; V468-K471 PolarHBondContact O-N 3.3Å; V468-K472 HydrophobicContact CG1-CD 4.33Å; V468-K472 VanDerWaalsContact O-CG 3.31Å; V468-K472 WeakPolarHBondContact O-CG 3.39Å; V468-K472 PolarHBondContact O-N 3.23Å; V468-K472 VanDerWaalsContact O-N 3.14Å; V468-M499 HydrophobicContact CG2-CE 3.61Å
469	V	88.2	Confident	82.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.2	-47.3	177.1	177.3	0	0	0	0	111.4	I430 Q431 G434 L451 E465 S466 K471 K472 L473	I430-V469 HydrophobicContact CG2-CB 4.45Å; I430-V469 HydrophobicContact CG2-CG2 3.9Å; Q431-V469 HydrophobicContact CG-CG2 4.41Å; Q431-V469 VanDerWaalsContact OE1-CG2 3.27Å; G434-V469 VanDerWaalsContact CA-CG1 3.42Å; L451-V469 HydrophobicContact CD1-CB 4.23Å; L451-V469 HydrophobicContact CD1-CG1 3.52Å; E465-V469 WeakPolarHBondContact O-CG2 3.47Å; E465-V469 PolarHBondContact O-N 2.96Å; S466-V469 PolarHBondContact O-N 3.46Å; V469-K471 VanDerWaalsContact C-N 3.29Å; V469-K471 PolarHBondContact O-N 2.92Å; V469-K472 PolarHBondContact O-N 2.78Å; V469-K472 VanDerWaalsContact O-N 3.17Å; V469-L473 HydrophobicContact CG1-CD1 3.9Å; V469-L473 HydrophobicContact CG1-CG 4.25Å; V469-L473 WeakPolarHBondContact O-CG 3.46Å; V469-L473 PolarHBondContact O-N 3.19Å
470	I	88.6	Confident	82.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-54.6	-46.8	175.8	-71.6	163.9	0	0	0	110.3	L448 L451 V452 L455 S466 V467 K472 L473 L474 L488	L448-I470 HydrophobicContact CD1-CB 4.47Å; L448-I470 HydrophobicContact CD1-CG1 4.2Å; L448-I470 HydrophobicContact CD1-CG2 4.25Å; L451-I470 HydrophobicContact CB-CD1 3.9Å; L451-I470 HydrophobicContact CB-CG1 3.72Å; L451-I470 HydrophobicContact CD1-CG1 4.29Å; V452-I470 HydrophobicContact CG2-CD1 3.94Å; L455-I470 HydrophobicContact CD1-CD1 3.82Å; L455-I470 HydrophobicContact CD2-CD1 4.18Å; L455-I470 HydrophobicContact CG-CD1 4.14Å; S466-I470 WeakPolarHBondContact O-CB 3.33Å; S466-I470 WeakPolarHBondContact O-CD1 3.36Å; S466-I470 WeakPolarHBondContact O-CG1 3.32Å; S466-I470 PolarHBondContact O-N 3.45Å; V467-I470 PolarHBondContact O-N 2.65Å; I470-K472 PolarHBondContact O-N 3.19Å; I470-L473 PolarHBondContact O-N 2.95Å; I470-L474 HydrophobicContact CG2-CD1 3.62Å; I470-L474 HydrophobicContact CG2-CG 4.06Å; I470-L474 WeakPolarHBondContact O-CB 3.4Å; I470-L474 WeakPolarHBondContact O-CG 3.49Å; I470-L474 PolarHBondContact O-N 2.91Å; I470-L488 HydrophobicContact CG2-CD1 4.12Å
471	K	85.6	Confident	81.5	Confident	52 Å²	52	36.7 Å²	36.7	23%	0.226	20%	0.198	C	C	.	.	H	α-helix	trans	-57.1	-48.8	177.9	172.5	-179.8	164.5	-172.1	0	112	V467 V468 V469 L474 Q475 W506 L507	V467-K471 VanDerWaalsContact O-CB 3.28Å; V467-K471 WeakPolarHBondContact O-CB 3.5Å; V467-K471 PolarHBondContact O-N 3.42Å; V468-K471 PolarHBondContact O-N 3.3Å; V469-K471 VanDerWaalsContact C-N 3.29Å; V469-K471 PolarHBondContact O-N 2.92Å; K471-L474 PolarHBondContact O-N 3.46Å; K471-Q475 WeakPolarHBondContact O-CG 3.38Å; K471-Q475 PolarHBondContact O-N 3.34Å; K471-W506 HydrophobicContact CD-CE3 3.89Å; K471-W506 HydrophobicContact CD-CZ3 4.36Å; K471-W506 VanDerWaalsContact CE-CE3 3.47Å; K471-W506 HydrophobicContact CG-CE3 3.95Å; K471-W506 HydrophobicContact CG-CZ3 3.97Å; K471-L507 HydrophobicContact CB-CD1 4.04Å; K471-L507 HydrophobicContact CB-CD2 4.45Å; K471-L507 HydrophobicContact CB-CG 4.31Å; K471-L507 HydrophobicContact CG-CD2 4.27Å; K471-L507 HydrophobicContact CG-CG 4.24Å
472	K	84.2	Confident	80.9	Confident	53 Å²	53	32.8 Å²	32.8	23%	0.23	18%	0.182	C	C	.	.	H	α-helix	trans	-63.7	-44.7	-180	-63.8	172.7	-174.5	171.3	0	111.3	V468 V469 I470 Q475 P610 L612	V468-K472 HydrophobicContact CG1-CD 4.33Å; V468-K472 VanDerWaalsContact O-CG 3.31Å; V468-K472 WeakPolarHBondContact O-CG 3.39Å; V468-K472 PolarHBondContact O-N 3.23Å; V468-K472 VanDerWaalsContact O-N 3.14Å; V469-K472 PolarHBondContact O-N 2.78Å; V469-K472 VanDerWaalsContact O-N 3.17Å; I470-K472 PolarHBondContact O-N 3.19Å; K472-Q475 PolarHBondContact O-N 3.19Å; K472-P610 HydrophobicContact CB-CG 4.07Å; K472-P610 HydrophobicContact CG-CB 4.49Å; K472-P610 HydrophobicContact CG-CG 3.74Å; K472-L612 HydrophobicContact CD-CD1 3.37Å; K472-L612 VanDerWaalsContact NZ-CD1 3.31Å
473	L	85.3	Confident	80.5	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-61.7	-44.7	176.3	-69.8	175.2	0	0	0	112.4	A437 T438 L448 L451 V469 I470 Q475 M476	A437-L473 HydrophobicContact CB-CD1 3.99Å; A437-L473 HydrophobicContact CB-CD2 3.86Å; T438-L473 WeakPolarHBondContact OG1-CD2 3.17Å; L448-L473 HydrophobicContact CD1-CB 4.22Å; L448-L473 HydrophobicContact CD1-CD1 4.12Å; L451-L473 HydrophobicContact CD1-CD1 3.85Å; V469-L473 HydrophobicContact CG1-CD1 3.9Å; V469-L473 HydrophobicContact CG1-CG 4.25Å; V469-L473 WeakPolarHBondContact O-CG 3.46Å; V469-L473 PolarHBondContact O-N 3.19Å; I470-L473 PolarHBondContact O-N 2.95Å; L473-Q475 PolarHBondContact O-N 3.09Å; L473-M476 WeakPolarHBondContact O-CB 3.37Å; L473-M476 PolarHBondContact O-N 3.21Å
474	L	82.9	Confident	80.3	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-64.6	-21.9	178	-71.3	179.6	0	0	0	113.4	L448 I470 K471 M476 H481 I485 L488 L507 Y511	L448-L474 HydrophobicContact CD2-CD2 4.1Å; I470-L474 HydrophobicContact CG2-CD1 3.62Å; I470-L474 HydrophobicContact CG2-CG 4.06Å; I470-L474 WeakPolarHBondContact O-CB 3.4Å; I470-L474 WeakPolarHBondContact O-CG 3.49Å; I470-L474 PolarHBondContact O-N 2.91Å; K471-L474 PolarHBondContact O-N 3.46Å; L474-M476 VanDerWaalsContact C-N 3.33Å; L474-H481 HydrophobicContact CD2-CB 3.33Å; L474-H481 VanDerWaalsContact CD2-CD2 3.45Å; L474-H481 WeakPolarHBondContact CD2-CD2 3.16Å; L474-I485 HydrophobicContact CD1-CG1 4.43Å; L474-L488 HydrophobicContact CD1-CD1 4.27Å; L474-L507 HydrophobicContact CB-CD2 4.07Å; L474-L507 HydrophobicContact CD1-CD1 3.98Å; L474-L507 HydrophobicContact CD1-CD2 3.93Å; L474-Y511 HydrophobicContact CB-CE2 4.44Å; L474-Y511 PolarHBondContact O-OH 3.4Å
475	Q	79.9	Confident	80.1	Confident	31 Å²	31	39.1 Å²	39.1	15%	0.145	21%	0.209	C	C	.	.	H	α-helix	trans	-75.9	-19.4	173.7	-72.2	179.1	-101.8	0	0	113	K471 K472 L473 W506 A609 P610	K471-Q475 WeakPolarHBondContact O-CG 3.38Å; K471-Q475 PolarHBondContact O-N 3.34Å; K472-Q475 PolarHBondContact O-N 3.19Å; L473-Q475 PolarHBondContact O-N 3.09Å; Q475-W506 VanDerWaalsContact CD-CH2 3.48Å; Q475-W506 HydrophobicContact CG-CH2 3.74Å; Q475-W506 HydrophobicContact CG-CZ3 3.88Å; Q475-A609 HydrophobicContact CB-CB 4.09Å; Q475-P610 VanDerWaalsContact CD-CD 3.5Å
476	M	75.8	Confident	79.9	Confident	91 Å²	91	40.3 Å²	40.3	45%	0.448	21%	0.213	S	C	.	.	H	α-helix	trans	-78.6	-29.1	176.9	-60.7	-64.7	-71.2	0	0	112.8	L473 L474 A609	L473-M476 WeakPolarHBondContact O-CB 3.37Å; L473-M476 PolarHBondContact O-N 3.21Å; L474-M476 VanDerWaalsContact C-N 3.33Å; M476-A609 HydrophobicContact SD-CB 3.55Å; M476-A609 VanDerWaalsContact SD-CB 3.55Å
477	Q	72.2	Confident	79.5	Confident	58 Å²	58	44.1 Å²	44.1	27%	0.271	23%	0.231	S	C	.	.			trans	-137	77.5	-179.8	-70.6	-172.3	-76.9	0	0	111.8	R444 A479 H481	R444-Q477 VanDerWaalsContact CD-OE1 3.32Å; Q477-A479 PolarHBondContact O-N 3.17Å; Q477-A479 VanDerWaalsContact O-N 3.11Å; Q477-H481 PolarHBondContact O-CD2 3.34Å
478	P	65.1	Low	79.3	Confident	69 Å²	69	44.2 Å²	44.2	45%	0.448	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.1	-173.1	25.7	-36.4	0	0	0	115.2	Y511	P478-Y511 HydrophobicContact CB-CE1 3.52Å
479	A	64.4	Low	79.2	Confident	82 Å²	82	43.6 Å²	43.6	68%	0.678	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-15.7	-167.1	0	0	0	0	0	115.9	Q477	Q477-A479 PolarHBondContact O-N 3.17Å; Q477-A479 VanDerWaalsContact O-N 3.11Å
480	Q	67.4	Low	79	Confident	135 Å²	135	50.7 Å²	50.7	63%	0.631	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-18.2	-164.3	-70.7	179.7	-22.5	0	0	115.2
481	H	70.6	Confident	78.6	Confident	13 Å²	13	51.8 Å²	51.8	6%	0.06	27%	0.265	C	S	.	.			trans	-106.7	29.7	-162.8	-56.1	-59.5	0	0	0	115.3	D445 L474 Q477 E483 I484 I485	D445-H481 IonicContact OD1-CE1 2.72Å; D445-H481 PolarHBondContact OD1-CE1 3.15Å; L474-H481 HydrophobicContact CD2-CB 3.33Å; L474-H481 VanDerWaalsContact CD2-CD2 3.45Å; L474-H481 WeakPolarHBondContact CD2-CD2 3.16Å; Q477-H481 PolarHBondContact O-CD2 3.34Å; H481-E483 VanDerWaalsContact C-N 3.31Å; H481-E483 PolarHBondContact O-N 3.22Å; H481-I484 HydrophobicContact CB-CB 4.47Å; H481-I484 HydrophobicContact CB-CD1 4.3Å; H481-I484 PolarHBondContact O-N 3.35Å; H481-I484 VanDerWaalsContact O-N 3.09Å; H481-I485 PolarHBondContact O-N 2.91Å
482	G	74.6	Confident	78.5	Confident	17 Å²	17	49.4 Å²	49.4	18%	0.175	25%	0.254	C	S	.	.	H	α-helix	trans	-55.2	-37.8	-177	0	0	0	0	0	114.9	I485 K486	G482-I485 PolarHBondContact O-N 3.4Å; G482-K486 WeakPolarHBondContact O-CG 3.38Å; G482-K486 PolarHBondContact O-N 2.99Å
483	E	80.2	Confident	78.4	Confident	132 Å²	132	51.1 Å²	51.1	62%	0.617	27%	0.266	S	S	*	.	H	α-helix	trans	-68.5	-34	177.8	-57.8	-46	127.3	0	0	113.1	H481 K486 H487	H481-E483 VanDerWaalsContact C-N 3.31Å; H481-E483 PolarHBondContact O-N 3.22Å; E483-K486 WeakPolarHBondContact O-CB 3.47Å; E483-K486 PolarHBondContact O-N 3.48Å; E483-K486 IonicContact OE1-NZ 2.72Å; E483-K486 PolarHBondContact OE1-NZ 2.98Å; E483-K486 VanDerWaalsContact OE2-CD 3.32Å; E483-K486 WeakPolarHBondContact OE2-CD 3.46Å; E483-K486 IonicContact OE2-NZ 2.6Å; E483-K486 PolarHBondContact OE2-NZ 3.5Å; E483-H487 PolarHBondContact O-N 2.94Å
484	I	82.4	Confident	78.2	Confident	21 Å²	21	56.9 Å²	56.9	11%	0.108	30%	0.297	C	S	.	.	H	α-helix	trans	-67.1	-41.4	178.1	-64.5	174.6	0	0	0	109.6	L448 V452 H481 K486 H487 L488	L448-I484 HydrophobicContact CD2-CD1 3.43Å; L448-I484 VanDerWaalsContact CD2-CD1 3.43Å; L448-I484 HydrophobicContact CG-CD1 3.86Å; V452-I484 HydrophobicContact CG2-CG2 3.8Å; H481-I484 HydrophobicContact CB-CB 4.47Å; H481-I484 HydrophobicContact CB-CD1 4.3Å; H481-I484 PolarHBondContact O-N 3.35Å; H481-I484 VanDerWaalsContact O-N 3.09Å; I484-K486 VanDerWaalsContact C-N 3.32Å; I484-K486 PolarHBondContact O-N 3Å; I484-H487 WeakPolarHBondContact O-CA 3.37Å; I484-H487 WeakPolarHBondContact O-CB 3.34Å; I484-H487 PolarHBondContact O-N 3.38Å; I484-L488 HydrophobicContact CG2-CD1 4.35Å; I484-L488 HydrophobicContact CG2-CG 4.43Å; I484-L488 WeakPolarHBondContact O-CG 3.42Å; I484-L488 PolarHBondContact O-N 3.35Å
485	I	82.9	Confident	78.2	Confident	5 Å²	5	57.3 Å²	57.3	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-64.4	-37.1	176.4	-56.2	158.4	0	0	0	110.8	L474 H481 G482 H487 L488 A489 I508 Y511 V515	L474-I485 HydrophobicContact CD1-CG1 4.43Å; H481-I485 PolarHBondContact O-N 2.91Å; G482-I485 PolarHBondContact O-N 3.4Å; I485-H487 VanDerWaalsContact C-N 3.29Å; I485-H487 PolarHBondContact O-N 2.98Å; I485-L488 PolarHBondContact O-N 3.22Å; I485-A489 WeakPolarHBondContact O-CB 3.4Å; I485-A489 PolarHBondContact O-N 3.04Å; I485-I508 HydrophobicContact CG2-CG1 4.21Å; I485-Y511 HydrophobicContact CD1-CD2 3.46Å; I485-Y511 VanDerWaalsContact CD1-CD2 3.46Å; I485-Y511 HydrophobicContact CD1-CE2 4.31Å; I485-Y511 HydrophobicContact CD1-CG 3.8Å; I485-Y511 HydrophobicContact CG1-CD2 4.32Å; I485-V515 HydrophobicContact CB-CG2 4.27Å; I485-V515 HydrophobicContact CG2-CG2 3.8Å
486	K	83.9	Confident	78.3	Confident	67 Å²	67	62.9 Å²	62.9	29%	0.291	33%	0.325	S	S	.	.	H	α-helix	trans	-64.2	-31.5	171.3	-65.7	172.5	-159.3	168.6	0	112.8	G482 E483 I484 K490 V515 I518	G482-K486 WeakPolarHBondContact O-CG 3.38Å; G482-K486 PolarHBondContact O-N 2.99Å; E483-K486 WeakPolarHBondContact O-CB 3.47Å; E483-K486 PolarHBondContact O-N 3.48Å; E483-K486 IonicContact OE1-NZ 2.72Å; E483-K486 PolarHBondContact OE1-NZ 2.98Å; E483-K486 VanDerWaalsContact OE2-CD 3.32Å; E483-K486 WeakPolarHBondContact OE2-CD 3.46Å; E483-K486 IonicContact OE2-NZ 2.6Å; E483-K486 PolarHBondContact OE2-NZ 3.5Å; I484-K486 VanDerWaalsContact C-N 3.32Å; I484-K486 PolarHBondContact O-N 3Å; K486-K490 WeakPolarHBondContact O-CG 3.26Å; K486-V515 HydrophobicContact CG-CG1 3.9Å; K486-I518 HydrophobicContact CB-CD1 4.29Å; K486-I518 HydrophobicContact CG-CD1 4.1Å
487	H	82.2	Confident	78.8	Confident	81 Å²	81	59.5 Å²	59.5	38%	0.375	31%	0.309	S	S	.	.	H	α-helix	trans	-73.5	-48.1	175.8	-168.2	94.3	0	0	0	111.3	E483 I484 I485 A489 K490 L491	E483-H487 PolarHBondContact O-N 2.94Å; I484-H487 WeakPolarHBondContact O-CA 3.37Å; I484-H487 WeakPolarHBondContact O-CB 3.34Å; I484-H487 PolarHBondContact O-N 3.38Å; I485-H487 VanDerWaalsContact C-N 3.29Å; I485-H487 PolarHBondContact O-N 2.98Å; H487-A489 VanDerWaalsContact C-N 3.27Å; H487-A489 PolarHBondContact O-N 3.36Å; H487-K490 WeakPolarHBondContact O-CB 3.23Å; H487-K490 PolarHBondContact O-N 3.4Å; H487-L491 PolarHBondContact O-N 3.17Å; H487-L491 VanDerWaalsContact O-N 3.12Å
488	L	82.8	Confident	79.5	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-54.8	-42.1	173.8	-65.6	174.6	0	0	0	112.1	L455 I470 L474 I484 I485 K490 L491 T492 I504 L507	L455-L488 HydrophobicContact CD1-CD2 3.26Å; I470-L488 HydrophobicContact CG2-CD1 4.12Å; L474-L488 HydrophobicContact CD1-CD1 4.27Å; I484-L488 HydrophobicContact CG2-CD1 4.35Å; I484-L488 HydrophobicContact CG2-CG 4.43Å; I484-L488 WeakPolarHBondContact O-CG 3.42Å; I484-L488 PolarHBondContact O-N 3.35Å; I485-L488 PolarHBondContact O-N 3.22Å; L488-K490 PolarHBondContact O-N 3.15Å; L488-L491 PolarHBondContact O-N 2.96Å; L488-T492 PolarHBondContact O-N 3.16Å; L488-T492 VanDerWaalsContact O-N 3.07Å; L488-T492 PolarHBondContact O-OG1 3.37Å; L488-I504 HydrophobicContact CB-CG2 4.11Å; L488-L507 HydrophobicContact CD1-CD1 3.9Å
489	A	83.3	Confident	80.5	Confident	4 Å²	4	60.1 Å²	60.1	3%	0.033	31%	0.311	C	S	.	.	H	α-helix	trans	-65.6	-20.4	177.3	0	0	0	0	0	114.3	I485 H487 I508 I518 V522	I485-A489 WeakPolarHBondContact O-CB 3.4Å; I485-A489 PolarHBondContact O-N 3.04Å; H487-A489 VanDerWaalsContact C-N 3.27Å; H487-A489 PolarHBondContact O-N 3.36Å; A489-I508 HydrophobicContact CB-CD1 3.69Å; A489-I508 HydrophobicContact CB-CG1 4.33Å; A489-I518 HydrophobicContact CB-CG2 3.82Å; A489-V522 HydrophobicContact CB-CG2 4.27Å
490	K	84.1	Confident	81.5	Confident	149 Å²	149	56.2 Å²	56.2	65%	0.648	28%	0.279	S	S	*	.	H	α-helix	trans	-83.8	-39.3	171	-68.5	173.1	-177.8	-178.4	0	111.8	K486 H487 L488 T492	K486-K490 WeakPolarHBondContact O-CG 3.26Å; H487-K490 WeakPolarHBondContact O-CB 3.23Å; H487-K490 PolarHBondContact O-N 3.4Å; L488-K490 PolarHBondContact O-N 3.15Å; K490-T492 PolarHBondContact O-N 2.88Å
491	L	81.6	Confident	82.5	Confident	23 Å²	23	51.8 Å²	51.8	12%	0.12	26%	0.257	C	S	.	.	H	α-helix	trans	-72.8	-13.2	178.5	-65.1	-178.9	0	0	0	113.9	L455 H487 L488 D493 N494 I495	L455-L491 HydrophobicContact CB-CD1 3.86Å; L455-L491 HydrophobicContact CD1-CD1 4.2Å; H487-L491 PolarHBondContact O-N 3.17Å; H487-L491 VanDerWaalsContact O-N 3.12Å; L488-L491 PolarHBondContact O-N 2.96Å; L491-D493 PolarHBondContact O-N 3.34Å; L491-D493 VanDerWaalsContact O-N 3.11Å; L491-N494 PolarHBondContact O-N 3.41Å; L491-I495 HydrophobicContact CB-CD1 4.09Å; L491-I495 WeakPolarHBondContact O-CG1 3.27Å; L491-I495 PolarHBondContact O-N 3.08Å
492	T	82.3	Confident	83.4	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-27.9	-178	-55.4	0	0	0	0	113.5	L488 K490 I504 V522	L488-T492 PolarHBondContact O-N 3.16Å; L488-T492 VanDerWaalsContact O-N 3.07Å; L488-T492 PolarHBondContact O-OG1 3.37Å; K490-T492 PolarHBondContact O-N 2.88Å; T492-I504 WeakPolarHBondContact OG1-CG2 3.47Å; T492-V522 HydrophobicContact CG2-CG1 4.36Å
493	D	81.8	Confident	84.1	Confident	90 Å²	90	51 Å²	51	48%	0.481	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-24.8	178.1	-64	5.5	0	0	0	113	L491 K525	L491-D493 PolarHBondContact O-N 3.34Å; L491-D493 VanDerWaalsContact O-N 3.11Å; D493-K525 WeakPolarHBondContact OD1-CD 3.31Å; D493-K525 IonicContact OD1-NZ 3.82Å; D493-K525 PolarHBondContact OD1-NZ 2.88Å; D493-K525 IonicContact OD2-NZ 2.62Å; D493-K525 PolarHBondContact OD2-NZ 2.71Å
494	N	82.3	Confident	84.5	Confident	123 Å²	123	44.7 Å²	44.7	66%	0.658	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-26.3	-174.5	-65.8	-8.6	0	0	0	113	L491 Q496	L491-N494 PolarHBondContact O-N 3.41Å; N494-Q496 PolarHBondContact O-N 3.39Å
495	I	82	Confident	84.8	Confident	11 Å²	11	43.7 Å²	43.7	6%	0.056	22%	0.216	C	C	.	.			trans	-81.6	113.1	-175.6	-64	167.4	0	0	0	108.2	V463 L491 V497 A500 R501 I504	V463-I495 HydrophobicContact CG1-CD1 4.22Å; V463-I495 HydrophobicContact CG1-CG1 4.07Å; V463-I495 HydrophobicContact CG1-CG2 3.96Å; L491-I495 HydrophobicContact CB-CD1 4.09Å; L491-I495 WeakPolarHBondContact O-CG1 3.27Å; L491-I495 PolarHBondContact O-N 3.08Å; I495-V497 HydrophobicContact CG2-CB 4.5Å; I495-A500 HydrophobicContact CG2-CB 3.6Å; I495-R501 HydrophobicContact CB-CG 4.46Å; I495-R501 HydrophobicContact CG2-CG 4.08Å; I495-R501 WeakPolarHBondContact O-CD 3.41Å; I495-R501 WeakPolarHBondContact O-CG 3.5Å; I495-R501 PolarHBondContact O-NE 3.47Å; I495-I504 HydrophobicContact CD1-CD1 3.47Å; I495-I504 VanDerWaalsContact CD1-CD1 3.47Å
496	Q	82.1	Confident	85.2	Confident	148 Å²	148	44.5 Å²	44.5	69%	0.692	22%	0.218	S	C	*	.			trans	-79.9	-32.3	178.6	-57.2	-169.5	25.6	0	0	112.3	N494 P498 R501	N494-Q496 PolarHBondContact O-N 3.39Å; Q496-P498 WeakPolarHBondContact O-CD 3.43Å; Q496-R501 VanDerWaalsContact O-CD 3.29Å; Q496-R501 WeakPolarHBondContact O-CD 3.43Å
497	V	86.5	Confident	85.3	Confident	19 Å²	19	41.4 Å²	41.4	12%	0.115	21%	0.205	C	C	.	.			trans	-60.9	118.4	-168.9	-165.2	0	0	0	0	113.3	E460 A464 I495 M499 A500 R501	E460-V497 HydrophobicContact CB-CG2 3.5Å; E460-V497 VanDerWaalsContact CB-CG2 3.5Å; E460-V497 HydrophobicContact CG-CG2 3.64Å; A464-V497 HydrophobicContact CB-CG1 4.08Å; I495-V497 HydrophobicContact CG2-CB 4.5Å; V497-M499 PolarHBondContact O-N 3.14Å; V497-A500 HydrophobicContact CB-CB 4.07Å; V497-A500 WeakPolarHBondContact O-CB 3.47Å; V497-A500 PolarHBondContact O-N 3.41Å; V497-A500 VanDerWaalsContact O-N 3.15Å; V497-R501 WeakPolarHBondContact O-CG 3.48Å; V497-R501 PolarHBondContact O-N 3.03Å
498	P	87.4	Confident	85.5	Confident	45 Å²	45	37.6 Å²	37.6	29%	0.292	19%	0.187	S	C	.	.	H	α-helix	trans	-52.1	-47.5	-176	-31.9	36.6	0	0	0	115.1	Q496 A500 R501 A502 E534 V537	Q496-P498 WeakPolarHBondContact O-CD 3.43Å; P498-A500 VanDerWaalsContact C-N 3.33Å; P498-A500 PolarHBondContact O-N 2.86Å; P498-R501 PolarHBondContact O-N 3.47Å; P498-A502 VanDerWaalsContact O-CB 3.26Å; P498-A502 WeakPolarHBondContact O-CB 3.27Å; P498-A502 PolarHBondContact O-N 3.28Å; P498-E534 HydrophobicContact CB-CB 3.78Å; P498-E534 HydrophobicContact CB-CG 4.05Å; P498-E534 HydrophobicContact CG-CB 3.84Å; P498-E534 HydrophobicContact CG-CG 3.54Å; P498-V537 HydrophobicContact CB-CG2 3.98Å; P498-V537 VanDerWaalsContact O-CG2 3.32Å; P498-V537 WeakPolarHBondContact O-CG2 3.37Å
499	M	85.4	Confident	85.7	Confident	96 Å²	96	37.7 Å²	37.7	47%	0.473	19%	0.188	S	C	.	.	H	α-helix	trans	-67.6	-32.5	-176.5	-177.6	156.9	135.5	0	0	112.9	V468 V497 S503	V468-M499 HydrophobicContact CG2-CE 3.61Å; V497-M499 PolarHBondContact O-N 3.14Å; M499-S503 VanDerWaalsContact O-CB 3.31Å; M499-S503 WeakPolarHBondContact O-CB 3.4Å; M499-S503 PolarHBondContact O-N 3.17Å; M499-S503 PolarHBondContact O-OG 3.42Å
500	A	86.4	Confident	85.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-69.7	-50.8	172.7	0	0	0	0	0	110.9	V467 I495 V497 P498 A502 S503 I504	V467-A500 HydrophobicContact CB-CB 4.18Å; V467-A500 HydrophobicContact CG1-CB 4.46Å; V467-A500 HydrophobicContact CG2-CB 3.99Å; I495-A500 HydrophobicContact CG2-CB 3.6Å; V497-A500 HydrophobicContact CB-CB 4.07Å; V497-A500 WeakPolarHBondContact O-CB 3.47Å; V497-A500 PolarHBondContact O-N 3.41Å; V497-A500 VanDerWaalsContact O-N 3.15Å; P498-A500 VanDerWaalsContact C-N 3.33Å; P498-A500 PolarHBondContact O-N 2.86Å; A500-A502 PolarHBondContact O-N 2.91Å; A500-S503 PolarHBondContact O-N 3.09Å; A500-S503 VanDerWaalsContact O-N 3.1Å; A500-I504 PolarHBondContact O-N 2.8Å
501	R	88.2	Confident	85.7	Confident	41 Å²	41	33.4 Å²	33.4	16%	0.155	17%	0.169	C	C	.	.	H	α-helix	trans	-57.7	-49.1	178.7	-63.5	175.1	89.2	-165.9	-14.5	111.4	I495 Q496 V497 P498 S503 I504 L505 E533 V537	I495-R501 HydrophobicContact CB-CG 4.46Å; I495-R501 HydrophobicContact CG2-CG 4.08Å; I495-R501 WeakPolarHBondContact O-CD 3.41Å; I495-R501 WeakPolarHBondContact O-CG 3.5Å; I495-R501 PolarHBondContact O-NE 3.47Å; Q496-R501 VanDerWaalsContact O-CD 3.29Å; Q496-R501 WeakPolarHBondContact O-CD 3.43Å; V497-R501 WeakPolarHBondContact O-CG 3.48Å; V497-R501 PolarHBondContact O-N 3.03Å; P498-R501 PolarHBondContact O-N 3.47Å; R501-S503 VanDerWaalsContact C-N 3.27Å; R501-S503 PolarHBondContact O-N 3.03Å; R501-I504 PolarHBondContact O-N 3.24Å; R501-L505 WeakPolarHBondContact O-CB 3.34Å; R501-L505 VanDerWaalsContact O-CG 3.26Å; R501-L505 WeakPolarHBondContact O-CG 3.48Å; R501-L505 PolarHBondContact O-N 3.41Å; R501-E533 IonicContact CZ-OE1 3.99Å; R501-E533 IonicContact CZ-OE2 2.81Å; R501-E533 IonicContact NE-OE2 2.86Å; R501-E533 IonicContact NH1-OE1 2.74Å; R501-E533 IonicContact NH1-OE2 3.11Å; R501-E533 PolarHBondContact NH1-OE2 3.16Å; R501-E533 VanDerWaalsContact NH2-CD 3.3Å; R501-E533 IonicContact NH2-OE1 2.63Å; R501-E533 PolarHBondContact NH2-OE1 3.37Å; R501-E533 IonicContact NH2-OE2 2.74Å; R501-E533 PolarHBondContact NH2-OE2 3.41Å; R501-E533 VanDerWaalsContact NH2-OE2 3.15Å; R501-V537 HydrophobicContact CB-CG2 4.15Å
502	A	89.4	Confident	85.7	Confident	4 Å²	4	32.5 Å²	32.5	3%	0.033	16%	0.164	C	C	.	.	H	α-helix	trans	-57.4	-39.1	175.9	0	0	0	0	0	112.5	P498 A500 W506 I536 V537 Q540	P498-A502 VanDerWaalsContact O-CB 3.26Å; P498-A502 WeakPolarHBondContact O-CB 3.27Å; P498-A502 PolarHBondContact O-N 3.28Å; A500-A502 PolarHBondContact O-N 2.91Å; A502-W506 WeakPolarHBondContact O-CB 3.45Å; A502-W506 PolarHBondContact O-N 2.9Å; A502-I536 HydrophobicContact CB-CG2 3.83Å; A502-V537 HydrophobicContact CB-CG2 4.3Å; A502-Q540 HydrophobicContact CB-CB 4.49Å; A502-Q540 HydrophobicContact CB-CG 3.89Å
503	S	88.3	Confident	85.6	Confident	10 Å²	10	39.6 Å²	39.6	7%	0.07	20%	0.198	C	C	.	.	H	α-helix	trans	-72.1	-36.2	178.2	-67.8	0	0	0	0	113.3	M499 A500 R501 W506 L507	M499-S503 VanDerWaalsContact O-CB 3.31Å; M499-S503 WeakPolarHBondContact O-CB 3.4Å; M499-S503 PolarHBondContact O-N 3.17Å; M499-S503 PolarHBondContact O-OG 3.42Å; A500-S503 PolarHBondContact O-N 3.09Å; A500-S503 VanDerWaalsContact O-N 3.1Å; R501-S503 VanDerWaalsContact C-N 3.27Å; R501-S503 PolarHBondContact O-N 3.03Å; S503-W506 PolarHBondContact O-N 3.37Å; S503-L507 WeakPolarHBondContact O-CG 3.43Å; S503-L507 PolarHBondContact O-N 2.91Å
504	I	88.6	Confident	85.4	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-69.3	-44.4	173.4	-67.7	165.4	0	0	0	110.9	V467 L488 T492 I495 A500 R501 W506 L507 I508	V467-I504 HydrophobicContact CG1-CD1 4.36Å; V467-I504 HydrophobicContact CG1-CG1 3.81Å; V467-I504 HydrophobicContact CG2-CD1 3.99Å; V467-I504 HydrophobicContact CG2-CG1 4.29Å; L488-I504 HydrophobicContact CB-CG2 4.11Å; T492-I504 WeakPolarHBondContact OG1-CG2 3.47Å; I495-I504 HydrophobicContact CD1-CD1 3.47Å; I495-I504 VanDerWaalsContact CD1-CD1 3.47Å; A500-I504 PolarHBondContact O-N 2.8Å; R501-I504 PolarHBondContact O-N 3.24Å; I504-W506 VanDerWaalsContact C-N 3.26Å; I504-W506 PolarHBondContact O-N 3.18Å; I504-L507 WeakPolarHBondContact O-CB 3.31Å; I504-L507 PolarHBondContact O-N 3.44Å; I504-L507 VanDerWaalsContact O-N 3.16Å; I504-I508 HydrophobicContact CG2-CD1 3.64Å; I504-I508 HydrophobicContact CG2-CG1 4.31Å; I504-I508 VanDerWaalsContact O-CG1 3.31Å; I504-I508 WeakPolarHBondContact O-CG1 3.41Å; I504-I508 PolarHBondContact O-N 2.93Å
505	L	90.1	Very high	85.4	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.7	-37.7	174.8	-67.8	171	0	0	0	111.8	R501 G509 V522 M526 V537 Q540 V541 L544	R501-L505 WeakPolarHBondContact O-CB 3.34Å; R501-L505 VanDerWaalsContact O-CG 3.26Å; R501-L505 WeakPolarHBondContact O-CG 3.48Å; R501-L505 PolarHBondContact O-N 3.41Å; L505-G509 PolarHBondContact O-N 3.37Å; L505-V522 HydrophobicContact CD2-CG1 3.52Å; L505-M526 HydrophobicContact CD1-CG 4.21Å; L505-M526 HydrophobicContact CD1-SD 4.09Å; L505-M526 HydrophobicContact CD2-CG 3.7Å; L505-M526 HydrophobicContact CD2-SD 4.19Å; L505-V537 HydrophobicContact CD1-CG1 3.76Å; L505-Q540 HydrophobicContact CB-CB 4.25Å; L505-V541 HydrophobicContact CD1-CG2 3.75Å; L505-L544 HydrophobicContact CD2-CD2 3.78Å
506	W	89.6	Confident	85.2	Confident	22 Å²	22	36.9 Å²	36.9	8%	0.083	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-47	172.9	-178.8	84.3	0	0	0	112.1	K471 Q475 A502 S503 I504 G509 E510 K607	K471-W506 HydrophobicContact CD-CE3 3.89Å; K471-W506 HydrophobicContact CD-CZ3 4.36Å; K471-W506 VanDerWaalsContact CE-CE3 3.47Å; K471-W506 HydrophobicContact CG-CE3 3.95Å; K471-W506 HydrophobicContact CG-CZ3 3.97Å; Q475-W506 VanDerWaalsContact CD-CH2 3.48Å; Q475-W506 HydrophobicContact CG-CH2 3.74Å; Q475-W506 HydrophobicContact CG-CZ3 3.88Å; A502-W506 WeakPolarHBondContact O-CB 3.45Å; A502-W506 PolarHBondContact O-N 2.9Å; S503-W506 PolarHBondContact O-N 3.37Å; I504-W506 VanDerWaalsContact C-N 3.26Å; I504-W506 PolarHBondContact O-N 3.18Å; W506-G509 PolarHBondContact O-N 2.97Å; W506-G509 VanDerWaalsContact O-N 3.15Å; W506-E510 HydrophobicContact CH2-CB 4.07Å; W506-E510 HydrophobicContact CH2-CG 3.85Å; W506-E510 HydrophobicContact CZ2-CB 4.13Å; W506-E510 VanDerWaalsContact CZ2-CD 3.46Å; W506-E510 HydrophobicContact CZ2-CG 3.89Å; W506-E510 VanDerWaalsContact CZ2-OE2 3.23Å; W506-E510 WeakPolarHBondContact CZ2-OE2 3.43Å; W506-E510 HydrophobicContact CZ3-CB 4.41Å; W506-E510 PolarHBondContact O-N 2.9Å; W506-K607 HydrophobicContact CZ2-CD 4.41Å
507	L	86.1	Confident	85.3	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-46.2	176.7	-79.3	167.4	0	0	0	112.3	K471 L474 L488 S503 I504 G509 E510 Y511	K471-L507 HydrophobicContact CB-CD1 4.04Å; K471-L507 HydrophobicContact CB-CD2 4.45Å; K471-L507 HydrophobicContact CB-CG 4.31Å; K471-L507 HydrophobicContact CG-CD2 4.27Å; K471-L507 HydrophobicContact CG-CG 4.24Å; L474-L507 HydrophobicContact CB-CD2 4.07Å; L474-L507 HydrophobicContact CD1-CD1 3.98Å; L474-L507 HydrophobicContact CD1-CD2 3.93Å; L488-L507 HydrophobicContact CD1-CD1 3.9Å; S503-L507 WeakPolarHBondContact O-CG 3.43Å; S503-L507 PolarHBondContact O-N 2.91Å; I504-L507 WeakPolarHBondContact O-CB 3.31Å; I504-L507 PolarHBondContact O-N 3.44Å; I504-L507 VanDerWaalsContact O-N 3.16Å; L507-G509 PolarHBondContact O-N 3.33Å; L507-E510 PolarHBondContact O-N 2.82Å; L507-Y511 HydrophobicContact CD2-CD2 4.2Å; L507-Y511 HydrophobicContact CD2-CE2 3.83Å; L507-Y511 WeakPolarHBondContact O-CD2 3.44Å; L507-Y511 PolarHBondContact O-N 3.31Å
508	I	87.9	Confident	85.2	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-63.7	-32.6	177	-66.3	167.5	0	0	0	110.9	I485 A489 I504 C512 A519 V522 L544	I485-I508 HydrophobicContact CG2-CG1 4.21Å; A489-I508 HydrophobicContact CB-CD1 3.69Å; A489-I508 HydrophobicContact CB-CG1 4.33Å; I504-I508 HydrophobicContact CG2-CD1 3.64Å; I504-I508 HydrophobicContact CG2-CG1 4.31Å; I504-I508 VanDerWaalsContact O-CG1 3.31Å; I504-I508 WeakPolarHBondContact O-CG1 3.41Å; I504-I508 PolarHBondContact O-N 2.93Å; I508-C512 VanDerWaalsContact O-CA 3.28Å; I508-C512 WeakPolarHBondContact O-CA 3.35Å; I508-C512 WeakPolarHBondContact O-CB 3.36Å; I508-C512 PolarHBondContact O-N 2.98Å; I508-C512 VanDerWaalsContact O-N 3.15Å; I508-A519 HydrophobicContact CG2-CB 3.52Å; I508-V522 HydrophobicContact CD1-CG1 4.28Å; I508-V522 HydrophobicContact CD1-CG2 4.33Å; I508-L544 HydrophobicContact CG2-CD1 4.18Å
509	G	86.9	Confident	85.2	Confident	2 Å²	2	38.2 Å²	38.2	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-73	-44.3	175.1	0	0	0	0	0	113.6	L505 W506 L507 C512 K547	L505-G509 PolarHBondContact O-N 3.37Å; W506-G509 PolarHBondContact O-N 2.97Å; W506-G509 VanDerWaalsContact O-N 3.15Å; L507-G509 PolarHBondContact O-N 3.33Å; G509-C512 PolarHBondContact O-SG 3.44Å; G509-C512 VanDerWaalsContact O-SG 3.37Å; G509-K547 WeakPolarHBondContact O-CD 3.41Å
510	E	84.4	Confident	85.3	Confident	43 Å²	43	34.3 Å²	34.3	20%	0.201	17%	0.165	C	C	.	.	H	α-helix	trans	-61.9	-49.3	174.6	-153.8	78.9	-174.7	0	0	110.6	W506 L507 C512 K547	W506-E510 HydrophobicContact CH2-CB 4.07Å; W506-E510 HydrophobicContact CH2-CG 3.85Å; W506-E510 HydrophobicContact CZ2-CB 4.13Å; W506-E510 VanDerWaalsContact CZ2-CD 3.46Å; W506-E510 HydrophobicContact CZ2-CG 3.89Å; W506-E510 VanDerWaalsContact CZ2-OE2 3.23Å; W506-E510 WeakPolarHBondContact CZ2-OE2 3.43Å; W506-E510 HydrophobicContact CZ3-CB 4.41Å; W506-E510 PolarHBondContact O-N 2.9Å; L507-E510 PolarHBondContact O-N 2.82Å; E510-C512 PolarHBondContact O-N 3.4Å; E510-K547 VanDerWaalsContact CA-NZ 3.34Å; E510-K547 IonicContact OE2-NZ 2.63Å; E510-K547 PolarHBondContact OE2-NZ 3.26Å
511	Y	83.1	Confident	85.5	Confident	21 Å²	21	36.9 Å²	36.9	8%	0.082	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	28.8	-175.8	-56.5	-50.4	0	0	0	114.2	L474 P478 I485 L507 E513 H514	L474-Y511 HydrophobicContact CB-CE2 4.44Å; L474-Y511 PolarHBondContact O-OH 3.4Å; P478-Y511 HydrophobicContact CB-CE1 3.52Å; I485-Y511 HydrophobicContact CD1-CD2 3.46Å; I485-Y511 VanDerWaalsContact CD1-CD2 3.46Å; I485-Y511 HydrophobicContact CD1-CE2 4.31Å; I485-Y511 HydrophobicContact CD1-CG 3.8Å; I485-Y511 HydrophobicContact CG1-CD2 4.32Å; L507-Y511 HydrophobicContact CD2-CD2 4.2Å; L507-Y511 HydrophobicContact CD2-CE2 3.83Å; L507-Y511 WeakPolarHBondContact O-CD2 3.44Å; L507-Y511 PolarHBondContact O-N 3.31Å; Y511-E513 PolarHBondContact O-N 3.39Å; Y511-E513 VanDerWaalsContact O-N 3.12Å; Y511-H514 PolarHBondContact O-N 2.94Å
512	C	80.9	Confident	85.6	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.02	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.2	-175.9	61.7	0	0	0	0	114	I508 G509 E510 V515 A519 L548	I508-C512 VanDerWaalsContact O-CA 3.28Å; I508-C512 WeakPolarHBondContact O-CA 3.35Å; I508-C512 WeakPolarHBondContact O-CB 3.36Å; I508-C512 PolarHBondContact O-N 2.98Å; I508-C512 VanDerWaalsContact O-N 3.15Å; G509-C512 PolarHBondContact O-SG 3.44Å; G509-C512 VanDerWaalsContact O-SG 3.37Å; E510-C512 PolarHBondContact O-N 3.4Å; C512-V515 CarbonylContact O-C 3.56Å; C512-V515 PolarHBondContact O-N 3Å; C512-A519 HydrophobicContact CB-CB 4.49Å; C512-L548 HydrophobicContact CB-CD2 3.79Å
513	E	80	Confident	85.7	Confident	150 Å²	150	34.9 Å²	34.9	70%	0.701	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-32.7	174	-58	-169	152.4	0	0	113	Y511 P516	Y511-E513 PolarHBondContact O-N 3.39Å; Y511-E513 VanDerWaalsContact O-N 3.12Å; E513-P516 WeakPolarHBondContact O-CD 3.34Å
514	H	78.5	Confident	85.8	Confident	90 Å²	90	39.7 Å²	39.7	42%	0.417	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-18.7	178.3	-66.9	91.8	0	0	0	112.8	Y511 P516	Y511-H514 PolarHBondContact O-N 2.94Å; H514-P516 VanDerWaalsContact C-CD 3.44Å
515	V	80.8	Confident	85.9	Confident	7 Å²	7	42.3 Å²	42.3	4%	0.042	20%	0.199	C	C	.	.			trans	-132.1	48.7	-174.9	-149.3	0	0	0	0	113.5	I485 K486 C512 K517 I518 A519	I485-V515 HydrophobicContact CB-CG2 4.27Å; I485-V515 HydrophobicContact CG2-CG2 3.8Å; K486-V515 HydrophobicContact CG-CG1 3.9Å; C512-V515 CarbonylContact O-C 3.56Å; C512-V515 PolarHBondContact O-N 3Å; V515-K517 PolarHBondContact O-N 3.29Å; V515-I518 HydrophobicContact CG1-CB 3.68Å; V515-I518 HydrophobicContact CG1-CD1 3.75Å; V515-I518 HydrophobicContact CG1-CG1 3.77Å; V515-I518 PolarHBondContact O-N 2.58Å; V515-I518 VanDerWaalsContact O-N 3.12Å; V515-A519 PolarHBondContact O-N 2.81Å; V515-A519 VanDerWaalsContact O-N 3.14Å
516	P	79.3	Confident	85.9	Confident	70 Å²	70	42.7 Å²	42.7	46%	0.455	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-16.8	-165	28.5	-37.3	0	0	0	114.6	E513 H514 P520	E513-P516 WeakPolarHBondContact O-CD 3.34Å; H514-P516 VanDerWaalsContact C-CD 3.44Å; P516-P520 VanDerWaalsContact O-CD 3.26Å; P516-P520 WeakPolarHBondContact O-CD 3.34Å; P516-P520 WeakPolarHBondContact O-CG 3.43Å
517	K	82.5	Confident	86	Confident	190 Å²	190	41.8 Å²	41.8	83%	0.826	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-30	176.7	-66.6	-175.7	179.8	179.4	0	114	V515	V515-K517 PolarHBondContact O-N 3.29Å
518	I	85.5	Confident	86.3	Confident	51 Å²	51	49.5 Å²	49.5	26%	0.262	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-36.4	-173.7	-49.1	-179.8	0	0	0	110.9	K486 A489 V515 D521 V522	K486-I518 HydrophobicContact CB-CD1 4.29Å; K486-I518 HydrophobicContact CG-CD1 4.1Å; A489-I518 HydrophobicContact CB-CG2 3.82Å; V515-I518 HydrophobicContact CG1-CB 3.68Å; V515-I518 HydrophobicContact CG1-CD1 3.75Å; V515-I518 HydrophobicContact CG1-CG1 3.77Å; V515-I518 PolarHBondContact O-N 2.58Å; V515-I518 VanDerWaalsContact O-N 3.12Å; I518-D521 WeakPolarHBondContact O-CA 3.5Å; I518-D521 WeakPolarHBondContact O-CB 3.35Å; I518-D521 PolarHBondContact O-N 3.03Å; I518-V522 HydrophobicContact CG2-CG2 4.12Å; I518-V522 PolarHBondContact O-N 3.26Å
519	A	86.3	Confident	86.3	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.2	-39.8	-179.9	0	0	0	0	0	114	I508 C512 V515 D521 L523 L548	I508-A519 HydrophobicContact CG2-CB 3.52Å; C512-A519 HydrophobicContact CB-CB 4.49Å; V515-A519 PolarHBondContact O-N 2.81Å; V515-A519 VanDerWaalsContact O-N 3.14Å; A519-D521 VanDerWaalsContact C-N 3.3Å; A519-D521 PolarHBondContact O-N 3.37Å; A519-L523 PolarHBondContact O-N 2.78Å; A519-L548 HydrophobicContact CB-CD1 4.14Å; A519-L548 HydrophobicContact CB-CD2 3.78Å; A519-L548 WeakPolarHBondContact O-CD1 3.21Å
520	P	89.3	Confident	86.6	Confident	13 Å²	13	51.1 Å²	51.1	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-64.2	-30.6	170.7	-23.3	35.6	0	0	0	114	P516 R524 T556	P516-P520 VanDerWaalsContact O-CD 3.26Å; P516-P520 WeakPolarHBondContact O-CD 3.34Å; P516-P520 WeakPolarHBondContact O-CG 3.43Å; P520-R524 WeakPolarHBondContact O-CB 3.46Å; P520-R524 PolarHBondContact O-N 3.31Å; P520-T556 HydrophobicContact CB-CG2 4.07Å; P520-T556 HydrophobicContact CG-CG2 4.14Å
521	D	89.4	Confident	86.8	Confident	55 Å²	55	54.2 Å²	54.2	29%	0.294	27%	0.265	S	S	.	.	H	α-helix	trans	-75.6	-40.6	179	-163.4	61.4	0	0	0	112	I518 A519 L523 R524 K525	I518-D521 WeakPolarHBondContact O-CA 3.5Å; I518-D521 WeakPolarHBondContact O-CB 3.35Å; I518-D521 PolarHBondContact O-N 3.03Å; A519-D521 VanDerWaalsContact C-N 3.3Å; A519-D521 PolarHBondContact O-N 3.37Å; D521-L523 VanDerWaalsContact C-N 3.33Å; D521-L523 PolarHBondContact O-N 2.81Å; D521-R524 WeakPolarHBondContact O-CB 3.48Å; D521-R524 PolarHBondContact O-N 2.87Å; D521-R524 VanDerWaalsContact O-N 3.13Å; D521-R524 IonicContact OD1-CZ 3.55Å; D521-R524 IonicContact OD1-NE 2.68Å; D521-R524 PolarHBondContact OD1-NE 3.07Å; D521-R524 IonicContact OD1-NH2 2.66Å; D521-R524 PolarHBondContact OD1-NH2 3.48Å; D521-R524 IonicContact OD2-NH2 2.73Å; D521-R524 PolarHBondContact OD2-NH2 2.91Å; D521-K525 WeakPolarHBondContact O-CG 3.47Å; D521-K525 PolarHBondContact O-N 2.81Å; D521-K525 WeakPolarHBondContact OD2-CE 3.36Å
522	V	90	Very high	87.2	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.018	30%	0.296	C	S	.	.	H	α-helix	trans	-60.6	-44.1	171.3	174.4	0	0	0	0	110.2	A489 T492 L505 I508 I518 R524 K525 M526	A489-V522 HydrophobicContact CB-CG2 4.27Å; T492-V522 HydrophobicContact CG2-CG1 4.36Å; L505-V522 HydrophobicContact CD2-CG1 3.52Å; I508-V522 HydrophobicContact CD1-CG1 4.28Å; I508-V522 HydrophobicContact CD1-CG2 4.33Å; I518-V522 HydrophobicContact CG2-CG2 4.12Å; I518-V522 PolarHBondContact O-N 3.26Å; V522-R524 VanDerWaalsContact C-N 3.33Å; V522-R524 PolarHBondContact O-N 3.41Å; V522-K525 PolarHBondContact O-N 3.16Å; V522-M526 HydrophobicContact CG1-CG 4.31Å; V522-M526 WeakPolarHBondContact O-CG 3.42Å; V522-M526 PolarHBondContact O-N 2.91Å
523	L	91.4	Very high	87.7	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.1	-42	172.5	178.7	63.2	0	0	0	112	A519 D521 K525 M526 A527 V541 L544 A545 L548 L559 V563	A519-L523 PolarHBondContact O-N 2.78Å; D521-L523 VanDerWaalsContact C-N 3.33Å; D521-L523 PolarHBondContact O-N 2.81Å; L523-K525 VanDerWaalsContact C-N 3.31Å; L523-K525 PolarHBondContact O-N 3.17Å; L523-M526 PolarHBondContact O-N 2.67Å; L523-A527 WeakPolarHBondContact O-CB 3.38Å; L523-A527 PolarHBondContact O-N 3.25Å; L523-V541 HydrophobicContact CD1-CG1 4.05Å; L523-L544 HydrophobicContact CB-CD2 4.42Å; L523-A545 HydrophobicContact CD1-CB 3.83Å; L523-A545 HydrophobicContact CD2-CB 4.15Å; L523-L548 HydrophobicContact CB-CD1 4.03Å; L523-L548 HydrophobicContact CD2-CD1 3.96Å; L523-L559 HydrophobicContact CD2-CB 4.09Å; L523-L559 HydrophobicContact CG-CB 4.4Å; L523-V563 HydrophobicContact CD1-CG2 4.36Å
524	R	92	Very high	88.3	Confident	110 Å²	110	56.4 Å²	56.4	42%	0.415	29%	0.291	S	S	.	.	H	α-helix	trans	-61.5	-35.6	175.9	-179.4	-170.5	67.1	94	4.8	112.6	P520 D521 V522 L559	P520-R524 WeakPolarHBondContact O-CB 3.46Å; P520-R524 PolarHBondContact O-N 3.31Å; D521-R524 WeakPolarHBondContact O-CB 3.48Å; D521-R524 PolarHBondContact O-N 2.87Å; D521-R524 VanDerWaalsContact O-N 3.13Å; D521-R524 IonicContact OD1-CZ 3.55Å; D521-R524 IonicContact OD1-NE 2.68Å; D521-R524 PolarHBondContact OD1-NE 3.07Å; D521-R524 IonicContact OD1-NH2 2.66Å; D521-R524 PolarHBondContact OD1-NH2 3.48Å; D521-R524 IonicContact OD2-NH2 2.73Å; D521-R524 PolarHBondContact OD2-NH2 2.91Å; V522-R524 VanDerWaalsContact C-N 3.33Å; V522-R524 PolarHBondContact O-N 3.41Å; R524-L559 HydrophobicContact CB-CD1 4.14Å; R524-L559 HydrophobicContact CB-CD2 4.46Å
525	K	90.1	Very high	89	Confident	56 Å²	56	54.3 Å²	54.3	24%	0.243	28%	0.283	C	S	.	.	H	α-helix	trans	-70.9	-55.2	174.5	-65.5	-177.6	-164.2	179.3	0	111.2	D493 D521 V522 L523 A527 K528 S529	D493-K525 WeakPolarHBondContact OD1-CD 3.31Å; D493-K525 IonicContact OD1-NZ 3.82Å; D493-K525 PolarHBondContact OD1-NZ 2.88Å; D493-K525 IonicContact OD2-NZ 2.62Å; D493-K525 PolarHBondContact OD2-NZ 2.71Å; D521-K525 WeakPolarHBondContact O-CG 3.47Å; D521-K525 PolarHBondContact O-N 2.81Å; D521-K525 WeakPolarHBondContact OD2-CE 3.36Å; V522-K525 PolarHBondContact O-N 3.16Å; L523-K525 VanDerWaalsContact C-N 3.31Å; L523-K525 PolarHBondContact O-N 3.17Å; K525-A527 PolarHBondContact O-N 2.72Å; K525-K528 WeakPolarHBondContact O-CB 3.43Å; K525-K528 PolarHBondContact O-N 3.18Å; K525-S529 PolarHBondContact O-N 3.49Å
526	M	90.9	Very high	89.5	Confident	7 Å²	7	58.8 Å²	58.8	3%	0.034	31%	0.305	C	S	.	.	H	α-helix	trans	-60.7	-31.4	-178.8	-60.8	-62.8	91.9	0	0	112.6	L505 V522 L523 K528 S529 F530 V541	L505-M526 HydrophobicContact CD1-CG 4.21Å; L505-M526 HydrophobicContact CD1-SD 4.09Å; L505-M526 HydrophobicContact CD2-CG 3.7Å; L505-M526 HydrophobicContact CD2-SD 4.19Å; V522-M526 HydrophobicContact CG1-CG 4.31Å; V522-M526 WeakPolarHBondContact O-CG 3.42Å; V522-M526 PolarHBondContact O-N 2.91Å; L523-M526 PolarHBondContact O-N 2.67Å; M526-K528 PolarHBondContact O-N 3.38Å; M526-S529 PolarHBondContact O-N 3.38Å; M526-S529 PolarHBondContact O-OG 3Å; M526-F530 WeakPolarHBondContact O-CA 3.42Å; M526-F530 WeakPolarHBondContact O-CB 3.44Å; M526-F530 PolarHBondContact O-N 3.34Å; M526-V541 HydrophobicContact CB-CG1 4.1Å; M526-V541 HydrophobicContact CB-CG2 3.79Å; M526-V541 HydrophobicContact CG-CG2 4.2Å
527	A	91	Very high	90.2	Very high	4 Å²	4	55.5 Å²	55.5	3%	0.033	28%	0.284	C	S	.	.	H	α-helix	trans	-63.6	-22.2	174.2	0	0	0	0	0	113.8	L523 K525 Y562 V563	L523-A527 WeakPolarHBondContact O-CB 3.38Å; L523-A527 PolarHBondContact O-N 3.25Å; K525-A527 PolarHBondContact O-N 2.72Å; A527-Y562 HydrophobicContact CB-CD1 4.29Å; A527-Y562 WeakPolarHBondContact O-CE1 3.19Å; A527-V563 HydrophobicContact CB-CG2 3.64Å
528	K	91.4	Very high	90.7	Very high	162 Å²	162	47.3 Å²	47.3	70%	0.704	25%	0.249	S	C	*	.	H	α-helix	trans	-82.3	-39.2	174.1	-66.6	-175.7	172.8	-165.8	0	112.7	K525 M526	K525-K528 WeakPolarHBondContact O-CB 3.43Å; K525-K528 PolarHBondContact O-N 3.18Å; M526-K528 PolarHBondContact O-N 3.38Å
529	S	89.5	Confident	91.1	Very high	37 Å²	37	46 Å²	46	26%	0.259	24%	0.242	S	C	.	.	H	α-helix	trans	-88	-11.9	-177.5	54.1	0	0	0	0	113.6	K525 M526 T531 A532 E533	K525-S529 PolarHBondContact O-N 3.49Å; M526-S529 PolarHBondContact O-N 3.38Å; M526-S529 PolarHBondContact O-OG 3Å; S529-T531 PolarHBondContact O-N 3.48Å; S529-A532 CarbonylContact O-C 3.55Å; S529-A532 WeakPolarHBondContact O-CA 3.28Å; S529-A532 PolarHBondContact O-N 3.28Å; S529-E533 WeakPolarHBondContact CB-OE1 3.38Å; S529-E533 PolarHBondContact O-N 3.26Å; S529-E533 PolarHBondContact OG-OE1 3.21Å
530	F	91.6	Very high	91.4	Very high	1 Å²	1	48 Å²	48	0%	0.004	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-39.1	-41.1	-171.3	-174.2	-90.6	0	0	0	116.4	M526 A532 E533 K538 V541 I542 V563 L566 A567	M526-F530 WeakPolarHBondContact O-CA 3.42Å; M526-F530 WeakPolarHBondContact O-CB 3.44Å; M526-F530 PolarHBondContact O-N 3.34Å; F530-A532 VanDerWaalsContact C-N 3.29Å; F530-A532 PolarHBondContact O-N 3.43Å; F530-E533 PolarHBondContact O-N 3.05Å; F530-K538 HydrophobicContact CD2-CG 4.38Å; F530-K538 HydrophobicContact CE1-CD 4.34Å; F530-K538 HydrophobicContact CE1-CG 4.33Å; F530-K538 HydrophobicContact CE2-CB 3.75Å; F530-K538 HydrophobicContact CE2-CG 4Å; F530-K538 HydrophobicContact CZ-CB 3.8Å; F530-K538 HydrophobicContact CZ-CD 4.25Å; F530-K538 HydrophobicContact CZ-CG 3.96Å; F530-V541 HydrophobicContact CD2-CB 4.19Å; F530-V541 HydrophobicContact CD2-CG1 4Å; F530-V541 HydrophobicContact CE2-CB 4.23Å; F530-V541 HydrophobicContact CE2-CG1 4.35Å; F530-I542 HydrophobicContact CE2-CG1 4.35Å; F530-I542 HydrophobicContact CZ-CD1 4.4Å; F530-V563 HydrophobicContact CD2-CG1 4.27Å; F530-V563 HydrophobicContact CE2-CG1 4.09Å; F530-L566 HydrophobicContact CB-CD1 4.14Å; F530-L566 HydrophobicContact CD1-CB 3.92Å; F530-L566 HydrophobicContact CD1-CD1 4.16Å; F530-L566 HydrophobicContact CE1-CB 4.18Å; F530-L566 HydrophobicContact CG-CD1 4.37Å; F530-A567 HydrophobicContact CE1-CB 4.01Å; F530-A567 HydrophobicContact CZ-CB 3.72Å
531	T	90.2	Very high	91.6	Very high	108 Å²	108	47.4 Å²	47.4	66%	0.663	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-75.7	-14	-178.9	51.9	0	0	0	0	114.6	S529	S529-T531 PolarHBondContact O-N 3.48Å
532	A	90.7	Very high	91.8	Very high	90 Å²	90	44.9 Å²	44.9	74%	0.744	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-113.7	7.6	176.8	0	0	0	0	0	112.4	S529 F530	S529-A532 CarbonylContact O-C 3.55Å; S529-A532 WeakPolarHBondContact O-CA 3.28Å; S529-A532 PolarHBondContact O-N 3.28Å; F530-A532 VanDerWaalsContact C-N 3.29Å; F530-A532 PolarHBondContact O-N 3.43Å
533	E	90.6	Very high	91.9	Very high	13 Å²	13	47 Å²	47	6%	0.061	25%	0.245	C	C	.	.	S	Bend	trans	-84.4	155.7	170.3	-61.3	-60.8	166.7	0	0	110.9	R501 S529 F530 V537 K538	R501-E533 IonicContact CZ-OE1 3.99Å; R501-E533 IonicContact CZ-OE2 2.81Å; R501-E533 IonicContact NE-OE2 2.86Å; R501-E533 IonicContact NH1-OE1 2.74Å; R501-E533 IonicContact NH1-OE2 3.11Å; R501-E533 PolarHBondContact NH1-OE2 3.16Å; R501-E533 VanDerWaalsContact NH2-CD 3.3Å; R501-E533 IonicContact NH2-OE1 2.63Å; R501-E533 PolarHBondContact NH2-OE1 3.37Å; R501-E533 IonicContact NH2-OE2 2.74Å; R501-E533 PolarHBondContact NH2-OE2 3.41Å; R501-E533 VanDerWaalsContact NH2-OE2 3.15Å; S529-E533 WeakPolarHBondContact CB-OE1 3.38Å; S529-E533 PolarHBondContact O-N 3.26Å; S529-E533 PolarHBondContact OG-OE1 3.21Å; F530-E533 PolarHBondContact O-N 3.05Å; E533-V537 HydrophobicContact CB-CB 4.13Å; E533-V537 HydrophobicContact CB-CG1 4.07Å; E533-V537 HydrophobicContact CG-CG1 4.13Å; E533-K538 HydrophobicContact CB-CG 4.14Å; E533-K538 WeakPolarHBondContact O-CE 3.49Å
534	E	92.4	Very high	91.8	Very high	118 Å²	118	47 Å²	47	55%	0.551	25%	0.245	S	C	*	.			trans	-71.1	154.4	170.1	-83.5	-58.5	151.6	0	0	113.2	P498 I536 V537 K538	P498-E534 HydrophobicContact CB-CB 3.78Å; P498-E534 HydrophobicContact CB-CG 4.05Å; P498-E534 HydrophobicContact CG-CB 3.84Å; P498-E534 HydrophobicContact CG-CG 3.54Å; E534-I536 VanDerWaalsContact C-N 3.3Å; E534-I536 PolarHBondContact O-N 3.37Å; E534-V537 HydrophobicContact CB-CG2 4.44Å; E534-V537 WeakPolarHBondContact O-CA 3.06Å; E534-V537 VanDerWaalsContact O-CB 3.3Å; E534-V537 WeakPolarHBondContact O-CB 3.08Å; E534-V537 PolarHBondContact O-N 3.31Å; E534-K538 PolarHBondContact O-N 3.3Å
535	D	93.7	Very high	91.8	Very high	46 Å²	46	41.8 Å²	41.8	25%	0.246	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-36.1	-171.2	-79.1	-11.5	0	0	0	113.6	V537 K538 L539 N572 I575	D535-V537 VanDerWaalsContact C-N 3.26Å; D535-V537 PolarHBondContact O-N 3.42Å; D535-K538 PolarHBondContact O-N 2.85Å; D535-K538 WeakPolarHBondContact OD1-CD 3.07Å; D535-K538 WeakPolarHBondContact OD1-CE 3.48Å; D535-K538 IonicContact OD1-NZ 3.37Å; D535-K538 PolarHBondContact OD1-NZ 3.45Å; D535-L539 WeakPolarHBondContact O-CB 3.34Å; D535-L539 VanDerWaalsContact O-CG 3.29Å; D535-L539 WeakPolarHBondContact O-CG 3.4Å; D535-L539 PolarHBondContact O-N 2.78Å; D535-N572 WeakPolarHBondContact OD2-CB 3.23Å; D535-N572 PolarHBondContact OD2-ND2 3.41Å; D535-I575 HydrophobicContact CB-CD1 3.76Å; D535-I575 VanDerWaalsContact OD1-CD1 3.24Å; D535-I575 WeakPolarHBondContact OD1-CD1 3.32Å
536	I	92	Very high	91.8	Very high	101 Å²	101	39.2 Å²	39.2	52%	0.518	21%	0.214	S	C	.	.	H	α-helix	trans	-62.1	-35.6	174.5	-55.7	177.2	0	0	0	111	A502 E534	A502-I536 HydrophobicContact CB-CG2 3.83Å; E534-I536 VanDerWaalsContact C-N 3.3Å; E534-I536 PolarHBondContact O-N 3.37Å
537	V	93.6	Very high	91.7	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-73.5	-50.2	177.1	-178.8	0	0	0	0	109.9	P498 R501 A502 L505 E533 E534 D535 L539 Q540 V541	P498-V537 HydrophobicContact CB-CG2 3.98Å; P498-V537 VanDerWaalsContact O-CG2 3.32Å; P498-V537 WeakPolarHBondContact O-CG2 3.37Å; R501-V537 HydrophobicContact CB-CG2 4.15Å; A502-V537 HydrophobicContact CB-CG2 4.3Å; L505-V537 HydrophobicContact CD1-CG1 3.76Å; E533-V537 HydrophobicContact CB-CB 4.13Å; E533-V537 HydrophobicContact CB-CG1 4.07Å; E533-V537 HydrophobicContact CG-CG1 4.13Å; E534-V537 HydrophobicContact CB-CG2 4.44Å; E534-V537 WeakPolarHBondContact O-CA 3.06Å; E534-V537 VanDerWaalsContact O-CB 3.3Å; E534-V537 WeakPolarHBondContact O-CB 3.08Å; E534-V537 PolarHBondContact O-N 3.31Å; D535-V537 VanDerWaalsContact C-N 3.26Å; D535-V537 PolarHBondContact O-N 3.42Å; V537-L539 VanDerWaalsContact C-N 3.27Å; V537-L539 PolarHBondContact O-N 3.02Å; V537-Q540 CarbonylContact O-C 3.36Å; V537-Q540 WeakPolarHBondContact O-CA 3.41Å; V537-Q540 PolarHBondContact O-N 3.29Å; V537-V541 HydrophobicContact CG1-CG2 4.28Å; V537-V541 WeakPolarHBondContact O-CG2 3.34Å; V537-V541 PolarHBondContact O-N 3.42Å
538	K	94.2	Very high	91.6	Very high	18 Å²	18	39.4 Å²	39.4	8%	0.078	21%	0.214	C	C	.	.	H	α-helix	trans	-50.7	-45.8	177	-66.7	177.1	-170.4	166	0	112.1	F530 E533 E534 D535 Q540 V541 I542 D570 I575	F530-K538 HydrophobicContact CD2-CG 4.38Å; F530-K538 HydrophobicContact CE1-CD 4.34Å; F530-K538 HydrophobicContact CE1-CG 4.33Å; F530-K538 HydrophobicContact CE2-CB 3.75Å; F530-K538 HydrophobicContact CE2-CG 4Å; F530-K538 HydrophobicContact CZ-CB 3.8Å; F530-K538 HydrophobicContact CZ-CD 4.25Å; F530-K538 HydrophobicContact CZ-CG 3.96Å; E533-K538 HydrophobicContact CB-CG 4.14Å; E533-K538 WeakPolarHBondContact O-CE 3.49Å; E534-K538 PolarHBondContact O-N 3.3Å; D535-K538 PolarHBondContact O-N 2.85Å; D535-K538 WeakPolarHBondContact OD1-CD 3.07Å; D535-K538 WeakPolarHBondContact OD1-CE 3.48Å; D535-K538 IonicContact OD1-NZ 3.37Å; D535-K538 PolarHBondContact OD1-NZ 3.45Å; K538-Q540 VanDerWaalsContact C-N 3.32Å; K538-Q540 PolarHBondContact O-N 3.48Å; K538-V541 PolarHBondContact O-N 2.93Å; K538-I542 WeakPolarHBondContact O-CG1 3.3Å; K538-I542 PolarHBondContact O-N 3.5Å; K538-D570 VanDerWaalsContact CD-OD2 3.29Å; K538-D570 WeakPolarHBondContact CD-OD2 3.19Å; K538-D570 VanDerWaalsContact CE-OD2 3.25Å; K538-D570 WeakPolarHBondContact CE-OD2 3.29Å; K538-D570 VanDerWaalsContact NZ-CG 3.31Å; K538-D570 IonicContact NZ-OD1 2.64Å; K538-D570 PolarHBondContact NZ-OD1 3.11Å; K538-D570 IonicContact NZ-OD2 2.66Å; K538-D570 PolarHBondContact NZ-OD2 3.34Å; K538-I575 HydrophobicContact CB-CD1 3.75Å; K538-I575 HydrophobicContact CD-CD1 3.5Å; K538-I575 HydrophobicContact CG-CD1 4.31Å
539	L	93.1	Very high	91.4	Very high	24 Å²	24	32.6 Å²	32.6	13%	0.126	18%	0.184	C	C	.	.	H	α-helix	trans	-58.3	-39.7	176.5	-74.8	171.3	0	0	0	112.7	D535 V537 N543 I575	D535-L539 WeakPolarHBondContact O-CB 3.34Å; D535-L539 VanDerWaalsContact O-CG 3.29Å; D535-L539 WeakPolarHBondContact O-CG 3.4Å; D535-L539 PolarHBondContact O-N 2.78Å; V537-L539 VanDerWaalsContact C-N 3.27Å; V537-L539 PolarHBondContact O-N 3.02Å; L539-N543 PolarHBondContact O-N 3.49Å; L539-N543 PolarHBondContact O-ND2 3.44Å; L539-I575 HydrophobicContact CD2-CG1 3.86Å; L539-I575 HydrophobicContact CG-CD1 4.43Å; L539-I575 HydrophobicContact CG-CG1 3.99Å
540	Q	92.8	Very high	91.2	Very high	42 Å²	42	32 Å²	32	20%	0.196	18%	0.178	C	C	.	.	H	α-helix	trans	-78.1	-28.4	176.1	-57.6	-56.2	-16.5	0	0	113.2	A502 L505 V537 K538 I542 N543 L544	A502-Q540 HydrophobicContact CB-CB 4.49Å; A502-Q540 HydrophobicContact CB-CG 3.89Å; L505-Q540 HydrophobicContact CB-CB 4.25Å; V537-Q540 CarbonylContact O-C 3.36Å; V537-Q540 WeakPolarHBondContact O-CA 3.41Å; V537-Q540 PolarHBondContact O-N 3.29Å; K538-Q540 VanDerWaalsContact C-N 3.32Å; K538-Q540 PolarHBondContact O-N 3.48Å; Q540-I542 VanDerWaalsContact C-N 3.32Å; Q540-N543 PolarHBondContact O-N 3.49Å; Q540-N543 PolarHBondContact OE1-ND2 3.28Å; Q540-L544 VanDerWaalsContact O-CB 3.3Å; Q540-L544 WeakPolarHBondContact O-CB 3.17Å; Q540-L544 PolarHBondContact O-N 3.36Å
541	V	93.8	Very high	90.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.3	-39.5	170.4	-179.9	0	0	0	0	110.6	L505 L523 M526 F530 V537 K538 L544 A545 V563	L505-V541 HydrophobicContact CD1-CG2 3.75Å; L523-V541 HydrophobicContact CD1-CG1 4.05Å; M526-V541 HydrophobicContact CB-CG1 4.1Å; M526-V541 HydrophobicContact CB-CG2 3.79Å; M526-V541 HydrophobicContact CG-CG2 4.2Å; F530-V541 HydrophobicContact CD2-CB 4.19Å; F530-V541 HydrophobicContact CD2-CG1 4Å; F530-V541 HydrophobicContact CE2-CB 4.23Å; F530-V541 HydrophobicContact CE2-CG1 4.35Å; V537-V541 HydrophobicContact CG1-CG2 4.28Å; V537-V541 WeakPolarHBondContact O-CG2 3.34Å; V537-V541 PolarHBondContact O-N 3.42Å; K538-V541 PolarHBondContact O-N 2.93Å; V541-L544 PolarHBondContact O-N 2.93Å; V541-A545 VanDerWaalsContact O-CB 3.31Å; V541-A545 WeakPolarHBondContact O-CB 3.38Å; V541-A545 PolarHBondContact O-N 2.89Å; V541-V563 HydrophobicContact CG1-CG1 4.08Å; V541-V563 HydrophobicContact CG1-CG2 4.42Å
542	I	92.9	Very high	90.6	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-63.4	-45.9	173.6	-65.4	165.6	0	0	0	110.8	F530 K538 Q540 L544 A545 A546 V563 L564 A567 I575 A579 T582	F530-I542 HydrophobicContact CE2-CG1 4.35Å; F530-I542 HydrophobicContact CZ-CD1 4.4Å; K538-I542 WeakPolarHBondContact O-CG1 3.3Å; K538-I542 PolarHBondContact O-N 3.5Å; Q540-I542 VanDerWaalsContact C-N 3.32Å; I542-L544 PolarHBondContact O-N 2.71Å; I542-A545 PolarHBondContact O-N 3.21Å; I542-A546 WeakPolarHBondContact O-CB 3.48Å; I542-A546 PolarHBondContact O-N 3.04Å; I542-V563 HydrophobicContact CG1-CG1 4.3Å; I542-L564 HydrophobicContact CG2-CD2 4.11Å; I542-A567 HydrophobicContact CD1-CB 3.79Å; I542-A567 HydrophobicContact CG1-CB 4.35Å; I542-I575 HydrophobicContact CD1-CG2 4Å; I542-A579 HydrophobicContact CD1-CB 4.45Å; I542-T582 HydrophobicContact CG2-CG2 4.12Å
543	N	91.3	Very high	90	Very high	46 Å²	46	29 Å²	29	25%	0.246	15%	0.151	C	C	.	.	H	α-helix	trans	-61.5	-41.3	175.7	-72	-30.4	0	0	0	112.7	L539 Q540 A546 K547	L539-N543 PolarHBondContact O-N 3.49Å; L539-N543 PolarHBondContact O-ND2 3.44Å; Q540-N543 PolarHBondContact O-N 3.49Å; Q540-N543 PolarHBondContact OE1-ND2 3.28Å; N543-A546 WeakPolarHBondContact O-CB 3.38Å; N543-A546 PolarHBondContact O-N 3.29Å; N543-K547 WeakPolarHBondContact O-CG 3.37Å; N543-K547 PolarHBondContact O-N 2.91Å; N543-K547 VanDerWaalsContact O-N 3.07Å
544	L	90.9	Very high	89.6	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-63.7	-46.5	176.7	176.6	61.6	0	0	0	110.8	L505 I508 L523 Q540 V541 I542 A546 K547 L548	L505-L544 HydrophobicContact CD2-CD2 3.78Å; I508-L544 HydrophobicContact CG2-CD1 4.18Å; L523-L544 HydrophobicContact CB-CD2 4.42Å; Q540-L544 VanDerWaalsContact O-CB 3.3Å; Q540-L544 WeakPolarHBondContact O-CB 3.17Å; Q540-L544 PolarHBondContact O-N 3.36Å; V541-L544 PolarHBondContact O-N 2.93Å; I542-L544 PolarHBondContact O-N 2.71Å; L544-A546 VanDerWaalsContact C-N 3.33Å; L544-A546 PolarHBondContact O-N 2.94Å; L544-K547 PolarHBondContact O-N 3.22Å; L544-L548 HydrophobicContact CD1-CD1 3.66Å; L544-L548 HydrophobicContact CD1-CG 4.02Å; L544-L548 HydrophobicContact CG-CD1 3.85Å; L544-L548 VanDerWaalsContact O-CB 3.3Å; L544-L548 WeakPolarHBondContact O-CB 3.38Å; L544-L548 WeakPolarHBondContact O-CG 3.35Å; L544-L548 PolarHBondContact O-N 3.42Å
545	A	91.2	Very high	89.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.9	-38.4	177.2	0	0	0	0	0	112.5	L523 V541 I542 Y549 T560	L523-A545 HydrophobicContact CD1-CB 3.83Å; L523-A545 HydrophobicContact CD2-CB 4.15Å; V541-A545 VanDerWaalsContact O-CB 3.31Å; V541-A545 WeakPolarHBondContact O-CB 3.38Å; V541-A545 PolarHBondContact O-N 2.89Å; I542-A545 PolarHBondContact O-N 3.21Å; A545-Y549 WeakPolarHBondContact O-CB 3.41Å; A545-Y549 PolarHBondContact O-N 2.86Å; A545-T560 HydrophobicContact CB-CG2 3.97Å; A545-T560 WeakPolarHBondContact O-CG2 3.44Å; A545-T560 PolarHBondContact O-OG1 3.39Å
546	A	89.8	Confident	88.8	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-61	-53.3	175.1	0	0	0	0	0	112.1	I542 N543 L544 Y549 L550 T582 I586 F603	I542-A546 WeakPolarHBondContact O-CB 3.48Å; I542-A546 PolarHBondContact O-N 3.04Å; N543-A546 WeakPolarHBondContact O-CB 3.38Å; N543-A546 PolarHBondContact O-N 3.29Å; L544-A546 VanDerWaalsContact C-N 3.33Å; L544-A546 PolarHBondContact O-N 2.94Å; A546-Y549 PolarHBondContact O-N 3.49Å; A546-L550 WeakPolarHBondContact O-CG 3.46Å; A546-L550 PolarHBondContact O-N 3.14Å; A546-T582 HydrophobicContact CB-CG2 3.76Å; A546-I586 HydrophobicContact CB-CD1 3.38Å; A546-F603 HydrophobicContact CB-CD1 4.12Å; A546-F603 HydrophobicContact CB-CE1 4.03Å; A546-F603 HydrophobicContact CB-CZ 4.43Å
547	K	89.3	Confident	88.5	Confident	12 Å²	12	36.3 Å²	36.3	5%	0.052	18%	0.177	C	C	.	.	H	α-helix	trans	-63.4	-45.7	178.6	-69.1	-177.6	-179.3	-176.9	0	112.2	G509 E510 N543 L544 Y549 L550 T551 F603 L604	G509-K547 WeakPolarHBondContact O-CD 3.41Å; E510-K547 VanDerWaalsContact CA-NZ 3.34Å; E510-K547 IonicContact OE2-NZ 2.63Å; E510-K547 PolarHBondContact OE2-NZ 3.26Å; N543-K547 WeakPolarHBondContact O-CG 3.37Å; N543-K547 PolarHBondContact O-N 2.91Å; N543-K547 VanDerWaalsContact O-N 3.07Å; L544-K547 PolarHBondContact O-N 3.22Å; K547-Y549 VanDerWaalsContact C-N 3.26Å; K547-Y549 PolarHBondContact O-N 3.43Å; K547-L550 PolarHBondContact O-N 3.45Å; K547-T551 PolarHBondContact O-N 3.08Å; K547-T551 PolarHBondContact O-OG1 3.35Å; K547-F603 VanDerWaalsContact CE-O 3.24Å; K547-F603 WeakPolarHBondContact CE-O 3.42Å; K547-F603 HydrophobicContact CG-CB 4.37Å; K547-L604 HydrophobicContact CB-CD2 4.26Å; K547-L604 HydrophobicContact CD-CD2 4.39Å; K547-L604 HydrophobicContact CG-CD2 4.1Å
548	L	88.2	Confident	88.3	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-65.7	-25.2	179.9	-75.3	176	0	0	0	113.8	C512 A519 L523 L544 N552 T556	C512-L548 HydrophobicContact CB-CD2 3.79Å; A519-L548 HydrophobicContact CB-CD1 4.14Å; A519-L548 HydrophobicContact CB-CD2 3.78Å; A519-L548 WeakPolarHBondContact O-CD1 3.21Å; L523-L548 HydrophobicContact CB-CD1 4.03Å; L523-L548 HydrophobicContact CD2-CD1 3.96Å; L544-L548 HydrophobicContact CD1-CD1 3.66Å; L544-L548 HydrophobicContact CD1-CG 4.02Å; L544-L548 HydrophobicContact CG-CD1 3.85Å; L544-L548 VanDerWaalsContact O-CB 3.3Å; L544-L548 WeakPolarHBondContact O-CB 3.38Å; L544-L548 WeakPolarHBondContact O-CG 3.35Å; L544-L548 PolarHBondContact O-N 3.42Å; L548-N552 CarbonylContact O-C 3.57Å; L548-N552 VanDerWaalsContact O-C 3.28Å; L548-N552 WeakPolarHBondContact O-CA 3.33Å; L548-N552 PolarHBondContact O-N 2.92Å; L548-T556 VanDerWaalsContact C-OG1 3.29Å; L548-T556 HydrophobicContact CB-CG2 3.87Å; L548-T556 PolarHBondContact O-OG1 3.2Å
549	Y	87.8	Confident	88.1	Confident	20 Å²	20	44 Å²	44	8%	0.078	22%	0.218	C	C	.	.	H	α-helix	trans	-68.7	-39.9	169.8	-170.9	-75.3	0	0	0	111.4	A545 A546 K547 S553 T556 K557 T560 I586	A545-Y549 WeakPolarHBondContact O-CB 3.41Å; A545-Y549 PolarHBondContact O-N 2.86Å; A546-Y549 PolarHBondContact O-N 3.49Å; K547-Y549 VanDerWaalsContact C-N 3.26Å; K547-Y549 PolarHBondContact O-N 3.43Å; Y549-S553 VanDerWaalsContact O-CA 3.31Å; Y549-S553 WeakPolarHBondContact O-CA 3.43Å; Y549-S553 WeakPolarHBondContact O-CB 3.26Å; Y549-S553 PolarHBondContact O-N 3.42Å; Y549-T556 WeakPolarHBondContact CA-OG1 3.48Å; Y549-K557 HydrophobicContact CD2-CB 4.44Å; Y549-K557 HydrophobicContact CE2-CB 4.1Å; Y549-K557 HydrophobicContact CE2-CG 3.9Å; Y549-T560 HydrophobicContact CD2-CG2 3.93Å; Y549-T560 HydrophobicContact CG-CG2 4.48Å; Y549-I586 HydrophobicContact CD1-CG2 3.25Å; Y549-I586 HydrophobicContact CD2-CG2 4.12Å; Y549-I586 HydrophobicContact CE1-CG2 3.65Å; Y549-I586 WeakPolarHBondContact CE1-O 3.46Å; Y549-I586 HydrophobicContact CE2-CG2 4.41Å; Y549-I586 HydrophobicContact CG-CG2 3.52Å
550	L	85.9	Confident	87.9	Confident	25 Å²	25	42.8 Å²	42.8	13%	0.131	21%	0.212	C	C	.	.	H	α-helix	trans	-76.2	-27.1	-176.7	-66.4	168.7	0	0	0	113.1	A546 K547 I586 A599 K600 F603	A546-L550 WeakPolarHBondContact O-CG 3.46Å; A546-L550 PolarHBondContact O-N 3.14Å; K547-L550 PolarHBondContact O-N 3.45Å; L550-I586 HydrophobicContact CD1-CD1 4.41Å; L550-A599 HydrophobicContact CD2-CB 4.26Å; L550-K600 HydrophobicContact CB-CG 4.37Å; L550-K600 HydrophobicContact CD2-CG 4.08Å; L550-K600 WeakPolarHBondContact O-CE 3.25Å; L550-K600 PolarHBondContact O-NZ 2.67Å; L550-K600 VanDerWaalsContact O-NZ 3.13Å; L550-F603 HydrophobicContact CD1-CB 3.73Å; L550-F603 HydrophobicContact CD1-CD2 3.82Å; L550-F603 HydrophobicContact CD1-CG 4.09Å
551	T	83.4	Confident	87.7	Confident	54 Å²	54	44.3 Å²	44.3	33%	0.331	22%	0.219	S	C	.	.	H	α-helix	trans	-95	-50.2	176	56.9	0	0	0	0	113.2	K547 L604	K547-T551 PolarHBondContact O-N 3.08Å; K547-T551 PolarHBondContact O-OG1 3.35Å; T551-L604 HydrophobicContact CG2-CD1 4.15Å; T551-L604 HydrophobicContact CG2-CD2 4.31Å
552	N	84.2	Confident	87.6	Confident	36 Å²	36	50.4 Å²	50.4	19%	0.193	24%	0.243	C	C	.	.	H	α-helix	trans	-125.1	52.2	-175	-171.9	6.3	0	0	0	113.1	L548 K554 Q555 T556	L548-N552 CarbonylContact O-C 3.57Å; L548-N552 VanDerWaalsContact O-C 3.28Å; L548-N552 WeakPolarHBondContact O-CA 3.33Å; L548-N552 PolarHBondContact O-N 2.92Å; N552-K554 PolarHBondContact O-N 3.44Å; N552-Q555 PolarHBondContact ND2-OE1 3.49Å; N552-Q555 PolarHBondContact O-N 3.49Å; N552-T556 PolarHBondContact O-N 3.4Å; N552-T556 PolarHBondContact O-OG1 3.37Å
553	S	79.8	Confident	87.6	Confident	46 Å²	46	50.3 Å²	50.3	32%	0.322	24%	0.242	S	C	.	.	H	α-helix	trans	-49.9	-33.7	-178.7	-157.4	0	0	0	0	114.3	Y549 Q555 K557	Y549-S553 VanDerWaalsContact O-CA 3.31Å; Y549-S553 WeakPolarHBondContact O-CA 3.43Å; Y549-S553 WeakPolarHBondContact O-CB 3.26Å; Y549-S553 PolarHBondContact O-N 3.42Å; S553-Q555 VanDerWaalsContact C-N 3.28Å; S553-Q555 PolarHBondContact O-N 3.16Å; S553-K557 WeakPolarHBondContact O-CB 3.49Å; S553-K557 PolarHBondContact O-N 2.86Å; S553-K557 VanDerWaalsContact O-N 3.16Å
554	K	82	Confident	87.6	Confident	209 Å²	209	48.3 Å²	48.3	91%	0.909	23%	0.231	S	C	*	.	H	α-helix	trans	-58.3	-35.4	-177.4	-70.7	-173.9	178.7	-179.1	0	113.5	N552	N552-K554 PolarHBondContact O-N 3.44Å
555	Q	83	Confident	87.6	Confident	127 Å²	127	50.4 Å²	50.4	59%	0.593	25%	0.246	S	C	*	.	H	α-helix	trans	-103.1	-30.7	-178	-69.1	177.8	-28.8	0	0	112.5	N552 S553	N552-Q555 PolarHBondContact ND2-OE1 3.49Å; N552-Q555 PolarHBondContact O-N 3.49Å; S553-Q555 VanDerWaalsContact C-N 3.28Å; S553-Q555 PolarHBondContact O-N 3.16Å
556	T	85	Confident	87.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-98.1	-14.4	-168.1	62.2	0	0	0	0	114.2	P520 L548 Y549 N552 L558 L559 T560	P520-T556 HydrophobicContact CB-CG2 4.07Å; P520-T556 HydrophobicContact CG-CG2 4.14Å; L548-T556 VanDerWaalsContact C-OG1 3.29Å; L548-T556 HydrophobicContact CB-CG2 3.87Å; L548-T556 PolarHBondContact O-OG1 3.2Å; Y549-T556 WeakPolarHBondContact CA-OG1 3.48Å; N552-T556 PolarHBondContact O-N 3.4Å; N552-T556 PolarHBondContact O-OG1 3.37Å; T556-L558 PolarHBondContact O-N 3.4Å; T556-L559 PolarHBondContact O-N 2.91Å; T556-L559 VanDerWaalsContact O-N 3.08Å; T556-T560 PolarHBondContact O-N 3.15Å; T556-T560 PolarHBondContact O-OG1 3.17Å; T556-T560 VanDerWaalsContact O-OG1 3.13Å
557	K	86.4	Confident	87.8	Confident	94 Å²	94	52.6 Å²	52.6	41%	0.409	26%	0.258	S	S	.	.	H	α-helix	trans	-48.9	-49.2	-176.2	174.2	169	-179	178.9	0	114.1	Y549 S553 Q561	Y549-K557 HydrophobicContact CD2-CB 4.44Å; Y549-K557 HydrophobicContact CE2-CB 4.1Å; Y549-K557 HydrophobicContact CE2-CG 3.9Å; S553-K557 WeakPolarHBondContact O-CB 3.49Å; S553-K557 PolarHBondContact O-N 2.86Å; S553-K557 VanDerWaalsContact O-N 3.16Å; K557-Q561 WeakPolarHBondContact O-CB 3.48Å; K557-Q561 VanDerWaalsContact O-CG 3.32Å; K557-Q561 WeakPolarHBondContact O-CG 3.49Å; K557-Q561 PolarHBondContact O-N 3.04Å
558	L	89.1	Confident	87.8	Confident	135 Å²	135	56.2 Å²	56.2	71%	0.707	27%	0.273	S	S	*	.	H	α-helix	trans	-71	-40.2	-179.8	-73.9	88.5	0	0	0	112.2	T556 Q561 Y562	T556-L558 PolarHBondContact O-N 3.4Å; L558-Q561 PolarHBondContact O-N 2.88Å; L558-Y562 WeakPolarHBondContact O-CB 3.2Å; L558-Y562 PolarHBondContact O-N 2.86Å
559	L	89.4	Confident	87.8	Confident	45 Å²	45	64.3 Å²	64.3	24%	0.236	31%	0.305	C	S	.	.	H	α-helix	trans	-61.5	-45.4	176.9	-65.8	173.7	0	0	0	111.2	L523 R524 T556 Y562 V563	L523-L559 HydrophobicContact CD2-CB 4.09Å; L523-L559 HydrophobicContact CG-CB 4.4Å; R524-L559 HydrophobicContact CB-CD1 4.14Å; R524-L559 HydrophobicContact CB-CD2 4.46Å; T556-L559 PolarHBondContact O-N 2.91Å; T556-L559 VanDerWaalsContact O-N 3.08Å; L559-Y562 PolarHBondContact O-N 3.2Å; L559-V563 WeakPolarHBondContact O-CG2 3.33Å; L559-V563 PolarHBondContact O-N 2.64Å
560	T	89.3	Confident	88	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.9	-42.2	175.8	-56.2	0	0	0	0	111.5	A545 Y549 T556 Y562 L564	A545-T560 HydrophobicContact CB-CG2 3.97Å; A545-T560 WeakPolarHBondContact O-CG2 3.44Å; A545-T560 PolarHBondContact O-OG1 3.39Å; Y549-T560 HydrophobicContact CD2-CG2 3.93Å; Y549-T560 HydrophobicContact CG-CG2 4.48Å; T556-T560 PolarHBondContact O-N 3.15Å; T556-T560 PolarHBondContact O-OG1 3.17Å; T556-T560 VanDerWaalsContact O-OG1 3.13Å; T560-Y562 VanDerWaalsContact C-N 3.33Å; T560-Y562 PolarHBondContact O-N 2.77Å; T560-L564 HydrophobicContact CG2-CD1 3.83Å; T560-L564 HydrophobicContact CG2-CG 4.35Å; T560-L564 WeakPolarHBondContact O-CB 3.46Å; T560-L564 VanDerWaalsContact O-CG 3.26Å; T560-L564 WeakPolarHBondContact O-CG 3.41Å; T560-L564 PolarHBondContact O-N 3.12Å
561	Q	89.4	Confident	88.3	Confident	74 Å²	74	71.3 Å²	71.3	35%	0.346	34%	0.338	S	S	.	.	H	α-helix	trans	-65.2	-34.8	176.2	-76.8	178.8	-33.2	0	0	112.9	K557 L558 S565	K557-Q561 WeakPolarHBondContact O-CB 3.48Å; K557-Q561 VanDerWaalsContact O-CG 3.32Å; K557-Q561 WeakPolarHBondContact O-CG 3.49Å; K557-Q561 PolarHBondContact O-N 3.04Å; L558-Q561 PolarHBondContact O-N 2.88Å; Q561-S565 VanDerWaalsContact O-CB 3.31Å; Q561-S565 WeakPolarHBondContact O-CB 3.34Å; Q561-S565 PolarHBondContact O-N 3.45Å; Q561-S565 VanDerWaalsContact O-N 3.16Å; Q561-S565 PolarHBondContact O-OG 3.36Å
562	Y	91.4	Very high	88.8	Confident	128 Å²	128	71 Å²	71	50%	0.502	33%	0.334	S	S	.	.	H	α-helix	trans	-67.7	-52.6	174.5	179.4	-113	0	0	0	111.5	A527 L558 L559 T560 L564 S565 L566	A527-Y562 HydrophobicContact CB-CD1 4.29Å; A527-Y562 WeakPolarHBondContact O-CE1 3.19Å; L558-Y562 WeakPolarHBondContact O-CB 3.2Å; L558-Y562 PolarHBondContact O-N 2.86Å; L559-Y562 PolarHBondContact O-N 3.2Å; T560-Y562 VanDerWaalsContact C-N 3.33Å; T560-Y562 PolarHBondContact O-N 2.77Å; Y562-L564 PolarHBondContact O-N 3.28Å; Y562-S565 CarbonylContact O-C 3.5Å; Y562-S565 WeakPolarHBondContact O-CA 3.14Å; Y562-S565 WeakPolarHBondContact O-CB 3.21Å; Y562-S565 PolarHBondContact O-N 2.73Å; Y562-L566 HydrophobicContact CD1-CD1 4.24Å; Y562-L566 HydrophobicContact CE1-CD1 3.73Å; Y562-L566 HydrophobicContact CE1-CG 4.37Å; Y562-L566 HydrophobicContact CE2-CD2 4.3Å; Y562-L566 HydrophobicContact CE2-CG 4.39Å; Y562-L566 PolarHBondContact O-N 3.01Å
563	V	93.3	Very high	89.2	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-56.9	-47.1	176.9	169.8	0	0	0	0	111.8	L523 A527 F530 V541 I542 L559 S565 L566 A567	L523-V563 HydrophobicContact CD1-CG2 4.36Å; A527-V563 HydrophobicContact CB-CG2 3.64Å; F530-V563 HydrophobicContact CD2-CG1 4.27Å; F530-V563 HydrophobicContact CE2-CG1 4.09Å; V541-V563 HydrophobicContact CG1-CG1 4.08Å; V541-V563 HydrophobicContact CG1-CG2 4.42Å; I542-V563 HydrophobicContact CG1-CG1 4.3Å; L559-V563 WeakPolarHBondContact O-CG2 3.33Å; L559-V563 PolarHBondContact O-N 2.64Å; V563-S565 PolarHBondContact O-N 3.09Å; V563-L566 PolarHBondContact O-N 2.77Å; V563-A567 WeakPolarHBondContact O-CB 3.47Å; V563-A567 PolarHBondContact O-N 3.47Å
564	L	91.4	Very high	89.9	Confident	3 Å²	3	78.5 Å²	78.5	2%	0.016	36%	0.359	C	S	.	.	H	α-helix	trans	-67.1	-15.7	176.4	-69.3	173.5	0	0	0	113.6	I542 T560 Y562 A579 T582 R583	I542-L564 HydrophobicContact CG2-CD2 4.11Å; T560-L564 HydrophobicContact CG2-CD1 3.83Å; T560-L564 HydrophobicContact CG2-CG 4.35Å; T560-L564 WeakPolarHBondContact O-CB 3.46Å; T560-L564 VanDerWaalsContact O-CG 3.26Å; T560-L564 WeakPolarHBondContact O-CG 3.41Å; T560-L564 PolarHBondContact O-N 3.12Å; Y562-L564 PolarHBondContact O-N 3.28Å; L564-A579 HydrophobicContact CD2-CB 4.34Å; L564-T582 HydrophobicContact CD2-CG2 4.09Å; L564-R583 HydrophobicContact CD1-CB 4.14Å
565	S	91.4	Very high	90.4	Very high	47 Å²	47	68.5 Å²	68.5	33%	0.329	32%	0.316	S	S	.	.	H	α-helix	trans	-91	-33.5	174.5	-60.3	0	0	0	0	112	Q561 Y562 V563 Y569 R583	Q561-S565 VanDerWaalsContact O-CB 3.31Å; Q561-S565 WeakPolarHBondContact O-CB 3.34Å; Q561-S565 PolarHBondContact O-N 3.45Å; Q561-S565 VanDerWaalsContact O-N 3.16Å; Q561-S565 PolarHBondContact O-OG 3.36Å; Y562-S565 CarbonylContact O-C 3.5Å; Y562-S565 WeakPolarHBondContact O-CA 3.14Å; Y562-S565 WeakPolarHBondContact O-CB 3.21Å; Y562-S565 PolarHBondContact O-N 2.73Å; V563-S565 PolarHBondContact O-N 3.09Å; S565-Y569 VanDerWaalsContact O-CD2 3.31Å; S565-Y569 WeakPolarHBondContact O-CD2 3.43Å; S565-R583 PolarHBondContact OG-NH1 3.2Å
566	L	90.9	Very high	90.9	Very high	46 Å²	46	65.2 Å²	65.2	24%	0.241	30%	0.298	C	S	.	.	H	α-helix	trans	-62.5	-54.5	167	-65	179	0	0	0	110.4	F530 Y562 V563 K568 Y569	F530-L566 HydrophobicContact CB-CD1 4.14Å; F530-L566 HydrophobicContact CD1-CB 3.92Å; F530-L566 HydrophobicContact CD1-CD1 4.16Å; F530-L566 HydrophobicContact CE1-CB 4.18Å; F530-L566 HydrophobicContact CG-CD1 4.37Å; Y562-L566 HydrophobicContact CD1-CD1 4.24Å; Y562-L566 HydrophobicContact CE1-CD1 3.73Å; Y562-L566 HydrophobicContact CE1-CG 4.37Å; Y562-L566 HydrophobicContact CE2-CD2 4.3Å; Y562-L566 HydrophobicContact CE2-CG 4.39Å; Y562-L566 PolarHBondContact O-N 3.01Å; V563-L566 PolarHBondContact O-N 2.77Å; L566-K568 PolarHBondContact O-N 3Å; L566-Y569 PolarHBondContact O-N 3.39Å
567	A	92.4	Very high	91.3	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-60.6	-21.9	-177.1	0	0	0	0	0	114.3	F530 I542 V563 Y569 D570 I575 R576 A579	F530-A567 HydrophobicContact CE1-CB 4.01Å; F530-A567 HydrophobicContact CZ-CB 3.72Å; I542-A567 HydrophobicContact CD1-CB 3.79Å; I542-A567 HydrophobicContact CG1-CB 4.35Å; V563-A567 WeakPolarHBondContact O-CB 3.47Å; V563-A567 PolarHBondContact O-N 3.47Å; A567-Y569 PolarHBondContact O-N 2.88Å; A567-D570 PolarHBondContact O-N 3.37Å; A567-I575 HydrophobicContact CB-CG2 4.11Å; A567-R576 WeakPolarHBondContact O-CA 3.39Å; A567-R576 WeakPolarHBondContact O-CG 3.47Å; A567-A579 HydrophobicContact CB-CB 3.56Å
568	K	90.1	Very high	91.4	Very high	88 Å²	88	69.8 Å²	69.8	38%	0.383	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-62.3	-27.8	173.1	-177.3	-169.8	167.9	-158.6	0	112.7	L566 R576	L566-K568 PolarHBondContact O-N 3Å; K568-R576 WeakPolarHBondContact O-CG 3.38Å
569	Y	89.1	Confident	91.6	Very high	173 Å²	173	63.4 Å²	63.4	68%	0.678	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-114.5	15.9	-175.9	-61.2	-80.6	0	0	0	112.9	S565 L566 A567	S565-Y569 VanDerWaalsContact O-CD2 3.31Å; S565-Y569 WeakPolarHBondContact O-CD2 3.43Å; L566-Y569 PolarHBondContact O-N 3.39Å; A567-Y569 PolarHBondContact O-N 2.88Å
570	D	92.1	Very high	91.5	Very high	18 Å²	18	66.8 Å²	66.8	10%	0.096	30%	0.295	C	S	.	.			trans	-63.3	162.1	173.8	-153.5	-73.7	0	0	0	111.7	K538 A567 N572 I575 R576	K538-D570 VanDerWaalsContact CD-OD2 3.29Å; K538-D570 WeakPolarHBondContact CD-OD2 3.19Å; K538-D570 VanDerWaalsContact CE-OD2 3.25Å; K538-D570 WeakPolarHBondContact CE-OD2 3.29Å; K538-D570 VanDerWaalsContact NZ-CG 3.31Å; K538-D570 IonicContact NZ-OD1 2.64Å; K538-D570 PolarHBondContact NZ-OD1 3.11Å; K538-D570 IonicContact NZ-OD2 2.66Å; K538-D570 PolarHBondContact NZ-OD2 3.34Å; A567-D570 PolarHBondContact O-N 3.37Å; D570-N572 PolarHBondContact OD1-N 3.34Å; D570-N572 VanDerWaalsContact OD1-N 3.16Å; D570-I575 HydrophobicContact CB-CB 4.4Å; D570-I575 HydrophobicContact CB-CG2 3.85Å; D570-R576 HydrophobicContact CB-CG 4.27Å; D570-R576 WeakPolarHBondContact O-CD 3.41Å; D570-R576 PolarHBondContact O-NE 3.49Å
571	Q	91.1	Very high	91.5	Very high	175 Å²	175	72.6 Å²	72.6	82%	0.818	32%	0.32	S	S	*	.	S	Bend	trans	-74.7	-38.7	175.8	-58.5	-173.4	23.9	0	0	110.8	R576	Q571-R576 PolarHBondContact O-NH2 2.91Å
572	N	93.5	Very high	91.4	Very high	46 Å²	46	69.3 Å²	69.3	25%	0.246	31%	0.306	C	S	.	.			trans	-69	138.5	-179.5	-169.8	-44	0	0	0	111.5	D535 D570 D574 I575 R576	D535-N572 WeakPolarHBondContact OD2-CB 3.23Å; D535-N572 PolarHBondContact OD2-ND2 3.41Å; D570-N572 PolarHBondContact OD1-N 3.34Å; D570-N572 VanDerWaalsContact OD1-N 3.16Å; N572-D574 PolarHBondContact OD1-N 2.88Å; N572-I575 HydrophobicContact CB-CB 4.16Å; N572-I575 HydrophobicContact CB-CD1 3.97Å; N572-I575 HydrophobicContact CB-CG1 3.99Å; N572-R576 WeakPolarHBondContact O-CG 3.43Å; N572-R576 PolarHBondContact O-N 3.11Å; N572-R576 PolarHBondContact O-NE 2.74Å
573	Y	92.8	Very high	91.2	Very high	176 Å²	176	68.4 Å²	68.4	69%	0.69	30%	0.301	S	S	*	.	H	α-helix	trans	-71.7	-47.4	-179.8	-46.9	-89.9	0	0	0	112	I575 R576 D577	Y573-I575 VanDerWaalsContact C-N 3.33Å; Y573-I575 PolarHBondContact O-N 3.05Å; Y573-R576 WeakPolarHBondContact O-CB 3.49Å; Y573-R576 PolarHBondContact O-N 2.95Å; Y573-R576 VanDerWaalsContact O-N 3.14Å; Y573-D577 PolarHBondContact O-N 2.88Å
574	D	93.9	Very high	90.7	Very high	64 Å²	64	74.7 Å²	74.7	34%	0.342	33%	0.331	S	S	.	.	H	α-helix	trans	-61.3	-40.6	179.7	176.5	42.2	0	0	0	111.5	N572 R576 D577 R578	N572-D574 PolarHBondContact OD1-N 2.88Å; D574-R576 PolarHBondContact O-N 2.76Å; D574-D577 PolarHBondContact O-N 3.08Å; D574-R578 VanDerWaalsContact CG-NE 3.31Å; D574-R578 WeakPolarHBondContact O-CB 3.44Å; D574-R578 WeakPolarHBondContact O-CG 3.42Å; D574-R578 PolarHBondContact O-N 3.49Å; D574-R578 WeakPolarHBondContact OD1-CG 3.32Å; D574-R578 IonicContact OD1-CZ 3.36Å; D574-R578 IonicContact OD1-NE 2.68Å; D574-R578 PolarHBondContact OD1-NE 3.09Å; D574-R578 IonicContact OD1-NH2 3.64Å; D574-R578 PolarHBondContact OD1-NH2 3.06Å; D574-R578 IonicContact OD2-CZ 2.57Å; D574-R578 VanDerWaalsContact OD2-CZ 3.24Å; D574-R578 IonicContact OD2-NE 2.69Å; D574-R578 PolarHBondContact OD2-NE 2.94Å; D574-R578 VanDerWaalsContact OD2-NE 3.1Å; D574-R578 IonicContact OD2-NH2 3.73Å; D574-R578 PolarHBondContact OD2-NH2 3.11Å
575	I	93.7	Very high	90.3	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-62.2	-44	175.9	-64.8	-174.1	0	0	0	111.2	D535 K538 L539 I542 A567 D570 N572 Y573 A579	D535-I575 HydrophobicContact CB-CD1 3.76Å; D535-I575 VanDerWaalsContact OD1-CD1 3.24Å; D535-I575 WeakPolarHBondContact OD1-CD1 3.32Å; K538-I575 HydrophobicContact CB-CD1 3.75Å; K538-I575 HydrophobicContact CD-CD1 3.5Å; K538-I575 HydrophobicContact CG-CD1 4.31Å; L539-I575 HydrophobicContact CD2-CG1 3.86Å; L539-I575 HydrophobicContact CG-CD1 4.43Å; L539-I575 HydrophobicContact CG-CG1 3.99Å; I542-I575 HydrophobicContact CD1-CG2 4Å; A567-I575 HydrophobicContact CB-CG2 4.11Å; D570-I575 HydrophobicContact CB-CB 4.4Å; D570-I575 HydrophobicContact CB-CG2 3.85Å; N572-I575 HydrophobicContact CB-CB 4.16Å; N572-I575 HydrophobicContact CB-CD1 3.97Å; N572-I575 HydrophobicContact CB-CG1 3.99Å; Y573-I575 VanDerWaalsContact C-N 3.33Å; Y573-I575 PolarHBondContact O-N 3.05Å; I575-A579 WeakPolarHBondContact O-CB 3.49Å; I575-A579 PolarHBondContact O-N 2.73Å
576	R	93.6	Very high	89.7	Confident	57 Å²	57	73.5 Å²	73.5	22%	0.215	32%	0.32	C	S	.	.	H	α-helix	trans	-63.6	-42.9	176.8	-76.1	-177.8	-79.4	175.1	-4	111.9	A567 K568 D570 Q571 N572 Y573 D574 A579 R580	A567-R576 WeakPolarHBondContact O-CA 3.39Å; A567-R576 WeakPolarHBondContact O-CG 3.47Å; K568-R576 WeakPolarHBondContact O-CG 3.38Å; D570-R576 HydrophobicContact CB-CG 4.27Å; D570-R576 WeakPolarHBondContact O-CD 3.41Å; D570-R576 PolarHBondContact O-NE 3.49Å; Q571-R576 PolarHBondContact O-NH2 2.91Å; N572-R576 WeakPolarHBondContact O-CG 3.43Å; N572-R576 PolarHBondContact O-N 3.11Å; N572-R576 PolarHBondContact O-NE 2.74Å; Y573-R576 WeakPolarHBondContact O-CB 3.49Å; Y573-R576 PolarHBondContact O-N 2.95Å; Y573-R576 VanDerWaalsContact O-N 3.14Å; D574-R576 PolarHBondContact O-N 2.76Å; R576-A579 PolarHBondContact O-N 3.25Å; R576-R580 WeakPolarHBondContact O-CD 3.37Å; R576-R580 WeakPolarHBondContact O-CG 3.35Å; R576-R580 PolarHBondContact O-N 3.19Å
577	D	92.4	Very high	88.9	Confident	83 Å²	83	72.9 Å²	72.9	44%	0.444	32%	0.319	S	S	.	.	H	α-helix	trans	-75.4	-39.4	-178.6	-74.4	-42.6	0	0	0	113.2	Y573 D574 A579 R580 F581	Y573-D577 PolarHBondContact O-N 2.88Å; D574-D577 PolarHBondContact O-N 3.08Å; D577-A579 VanDerWaalsContact C-N 3.3Å; D577-A579 PolarHBondContact O-N 2.96Å; D577-R580 PolarHBondContact O-N 2.84Å; D577-R580 WeakPolarHBondContact OD1-CD 3.37Å; D577-R580 IonicContact OD1-CZ 2.71Å; D577-R580 IonicContact OD1-NE 3.1Å; D577-R580 IonicContact OD1-NH1 2.72Å; D577-R580 PolarHBondContact OD1-NH1 2.69Å; D577-R580 IonicContact OD2-NH1 2.71Å; D577-F581 VanDerWaalsContact O-CB 3.31Å; D577-F581 WeakPolarHBondContact O-CB 3.22Å; D577-F581 PolarHBondContact O-N 3.06Å
578	R	90	Very high	87.5	Confident	108 Å²	108	78 Å²	78	41%	0.408	35%	0.352	S	S	.	.	H	α-helix	trans	-63.1	-35.8	168.5	-68	-163.6	-145.1	-168.5	9.8	112.2	D574 T582	D574-R578 VanDerWaalsContact CG-NE 3.31Å; D574-R578 WeakPolarHBondContact O-CB 3.44Å; D574-R578 WeakPolarHBondContact O-CG 3.42Å; D574-R578 PolarHBondContact O-N 3.49Å; D574-R578 WeakPolarHBondContact OD1-CG 3.32Å; D574-R578 IonicContact OD1-CZ 3.36Å; D574-R578 IonicContact OD1-NE 2.68Å; D574-R578 PolarHBondContact OD1-NE 3.09Å; D574-R578 IonicContact OD1-NH2 3.64Å; D574-R578 PolarHBondContact OD1-NH2 3.06Å; D574-R578 IonicContact OD2-CZ 2.57Å; D574-R578 VanDerWaalsContact OD2-CZ 3.24Å; D574-R578 IonicContact OD2-NE 2.69Å; D574-R578 PolarHBondContact OD2-NE 2.94Å; D574-R578 VanDerWaalsContact OD2-NE 3.1Å; D574-R578 IonicContact OD2-NH2 3.73Å; D574-R578 PolarHBondContact OD2-NH2 3.11Å; R578-T582 WeakPolarHBondContact O-CB 3.42Å; R578-T582 PolarHBondContact O-N 2.91Å; R578-T582 PolarHBondContact O-OG1 3.15Å
579	A	91.6	Very high	86	Confident	1 Å²	1	77 Å²	77	1%	0.008	36%	0.356	C	S	.	.	H	α-helix	trans	-65	-42.7	173.9	0	0	0	0	0	111.9	I542 L564 A567 I575 R576 D577 R583	I542-A579 HydrophobicContact CD1-CB 4.45Å; L564-A579 HydrophobicContact CD2-CB 4.34Å; A567-A579 HydrophobicContact CB-CB 3.56Å; I575-A579 WeakPolarHBondContact O-CB 3.49Å; I575-A579 PolarHBondContact O-N 2.73Å; R576-A579 PolarHBondContact O-N 3.25Å; D577-A579 VanDerWaalsContact C-N 3.3Å; D577-A579 PolarHBondContact O-N 2.96Å; A579-R583 WeakPolarHBondContact O-CB 3.37Å; A579-R583 PolarHBondContact O-N 2.92Å
580	R	88.9	Confident	84.3	Confident	115 Å²	115	78.5 Å²	78.5	43%	0.434	37%	0.369	S	S	.	.	H	α-helix	trans	-61.5	-50.4	174.4	-69.2	158.4	-168.5	159.2	1.1	111.4	R576 D577 R583 Q584	R576-R580 WeakPolarHBondContact O-CD 3.37Å; R576-R580 WeakPolarHBondContact O-CG 3.35Å; R576-R580 PolarHBondContact O-N 3.19Å; D577-R580 PolarHBondContact O-N 2.84Å; D577-R580 WeakPolarHBondContact OD1-CD 3.37Å; D577-R580 IonicContact OD1-CZ 2.71Å; D577-R580 IonicContact OD1-NE 3.1Å; D577-R580 IonicContact OD1-NH1 2.72Å; D577-R580 PolarHBondContact OD1-NH1 2.69Å; D577-R580 IonicContact OD2-NH1 2.71Å; R580-R583 PolarHBondContact O-N 3.5Å; R580-Q584 PolarHBondContact O-N 2.94Å
581	F	88.3	Confident	82.5	Confident	122 Å²	122	85.9 Å²	85.9	54%	0.535	40%	0.403	S	S	.	.	H	α-helix	trans	-61.4	-49.6	179.4	-178.1	-108.8	0	0	0	112.3	D577 R583 Q584 L585	D577-F581 VanDerWaalsContact O-CB 3.31Å; D577-F581 WeakPolarHBondContact O-CB 3.22Å; D577-F581 PolarHBondContact O-N 3.06Å; F581-R583 VanDerWaalsContact C-N 3.34Å; F581-R583 PolarHBondContact O-N 3.38Å; F581-Q584 PolarHBondContact O-N 2.82Å; F581-L585 HydrophobicContact CD1-CD1 3.78Å; F581-L585 HydrophobicContact CE1-CD1 3.43Å; F581-L585 VanDerWaalsContact CE1-CD1 3.43Å; F581-L585 HydrophobicContact CE2-CD1 4.26Å; F581-L585 HydrophobicContact CG-CD1 4.34Å; F581-L585 HydrophobicContact CZ-CD1 3.7Å; F581-L585 PolarHBondContact O-N 3.36Å
582	T	88.1	Confident	80.9	Confident	6 Å²	6	79.9 Å²	79.9	4%	0.037	39%	0.388	C	S	.	.	H	α-helix	trans	-62.1	-40.8	177.7	-58	0	0	0	0	111.4	I542 A546 L564 R578 L585 I586 F603	I542-T582 HydrophobicContact CG2-CG2 4.12Å; A546-T582 HydrophobicContact CB-CG2 3.76Å; L564-T582 HydrophobicContact CD2-CG2 4.09Å; R578-T582 WeakPolarHBondContact O-CB 3.42Å; R578-T582 PolarHBondContact O-N 2.91Å; R578-T582 PolarHBondContact O-OG1 3.15Å; T582-L585 PolarHBondContact O-N 3.2Å; T582-I586 HydrophobicContact CG2-CD1 3.73Å; T582-I586 WeakPolarHBondContact O-CB 3.41Å; T582-I586 WeakPolarHBondContact O-CG1 3.4Å; T582-I586 PolarHBondContact O-N 3.46Å; T582-I586 VanDerWaalsContact O-N 3.15Å; T582-F603 HydrophobicContact CG2-CZ 4.29Å
583	R	86.9	Confident	79.4	Confident	108 Å²	108	79.8 Å²	79.8	41%	0.408	40%	0.398	S	S	.	.	H	α-helix	trans	-61.1	-45.2	174.9	-177.6	176.3	178.7	137.9	0.2	111.7	L564 S565 A579 R580 F581 L585 I586 V587	L564-R583 HydrophobicContact CD1-CB 4.14Å; S565-R583 PolarHBondContact OG-NH1 3.2Å; A579-R583 WeakPolarHBondContact O-CB 3.37Å; A579-R583 PolarHBondContact O-N 2.92Å; R580-R583 PolarHBondContact O-N 3.5Å; F581-R583 VanDerWaalsContact C-N 3.34Å; F581-R583 PolarHBondContact O-N 3.38Å; R583-L585 VanDerWaalsContact C-N 3.33Å; R583-L585 PolarHBondContact O-N 3.27Å; R583-I586 PolarHBondContact O-N 3.18Å; R583-V587 HydrophobicContact CG-CB 4.39Å; R583-V587 HydrophobicContact CG-CG2 3.99Å; R583-V587 WeakPolarHBondContact O-CB 3.34Å; R583-V587 PolarHBondContact O-N 3.04Å
584	Q	83.4	Confident	78.1	Confident	133 Å²	133	74.9 Å²	74.9	62%	0.621	39%	0.394	S	S	*	.	H	α-helix	trans	-69.1	-28	-179.5	-170.3	63.9	10	0	0	113.3	R580 F581	R580-Q584 PolarHBondContact O-N 2.94Å; F581-Q584 PolarHBondContact O-N 2.82Å
585	L	82.1	Confident	76.8	Confident	12 Å²	12	77.6 Å²	77.6	6%	0.063	41%	0.408	C	S	.	.	H	α-helix	trans	-76.5	-32.4	175.1	-78.7	167.7	0	0	0	113.8	F581 T582 R583 L595 L602 F603	F581-L585 HydrophobicContact CD1-CD1 3.78Å; F581-L585 HydrophobicContact CE1-CD1 3.43Å; F581-L585 VanDerWaalsContact CE1-CD1 3.43Å; F581-L585 HydrophobicContact CE2-CD1 4.26Å; F581-L585 HydrophobicContact CG-CD1 4.34Å; F581-L585 HydrophobicContact CZ-CD1 3.7Å; F581-L585 PolarHBondContact O-N 3.36Å; T582-L585 PolarHBondContact O-N 3.2Å; R583-L585 VanDerWaalsContact C-N 3.33Å; R583-L585 PolarHBondContact O-N 3.27Å; L585-L595 HydrophobicContact CD2-CB 3.72Å; L585-L602 HydrophobicContact CD1-CD2 3.94Å; L585-F603 HydrophobicContact CB-CE2 4.25Å; L585-F603 HydrophobicContact CD1-CE2 3.92Å; L585-F603 HydrophobicContact CD1-CZ 4.02Å
586	I	79.3	Confident	75.6	Confident	12 Å²	12	80 Å²	80	6%	0.062	43%	0.425	C	S	.	.	H	α-helix	trans	-114.4	-33.8	-163	-61.1	-178.1	0	0	0	113.1	A546 Y549 L550 T582 R583 P588 F603	A546-I586 HydrophobicContact CB-CD1 3.38Å; Y549-I586 HydrophobicContact CD1-CG2 3.25Å; Y549-I586 HydrophobicContact CD2-CG2 4.12Å; Y549-I586 HydrophobicContact CE1-CG2 3.65Å; Y549-I586 WeakPolarHBondContact CE1-O 3.46Å; Y549-I586 HydrophobicContact CE2-CG2 4.41Å; Y549-I586 HydrophobicContact CG-CG2 3.52Å; L550-I586 HydrophobicContact CD1-CD1 4.41Å; T582-I586 HydrophobicContact CG2-CD1 3.73Å; T582-I586 WeakPolarHBondContact O-CB 3.41Å; T582-I586 WeakPolarHBondContact O-CG1 3.4Å; T582-I586 PolarHBondContact O-N 3.46Å; T582-I586 VanDerWaalsContact O-N 3.15Å; R583-I586 PolarHBondContact O-N 3.18Å; I586-P588 WeakPolarHBondContact O-CD 3.13Å; I586-F603 HydrophobicContact CD1-CD2 4.08Å; I586-F603 HydrophobicContact CD1-CE2 3.7Å; I586-F603 HydrophobicContact CD1-CZ 4.04Å; I586-F603 HydrophobicContact CG1-CD2 4.48Å; I586-F603 HydrophobicContact CG1-CE2 3.98Å
587	V	73.5	Confident	74.6	Confident	34 Å²	34	87.2 Å²	87.2	21%	0.206	45%	0.452	C	S	.	.	S	Bend	trans	-85.9	120.8	176.5	-176.7	0	0	0	0	108.6	R583 S589	R583-V587 HydrophobicContact CG-CB 4.39Å; R583-V587 HydrophobicContact CG-CG2 3.99Å; R583-V587 WeakPolarHBondContact O-CB 3.34Å; R583-V587 PolarHBondContact O-N 3.04Å; V587-S589 PolarHBondContact O-N 2.8Å; V587-S589 VanDerWaalsContact O-N 3.15Å
588	P	63.8	Low	73.9	Confident	108 Å²	108	88.4 Å²	88.4	70%	0.701	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-62.1	119.4	177.3	-22.8	34.2	0	0	0	111.2	I586	I586-P588 WeakPolarHBondContact O-CD 3.13Å
589	S	57.5	Low	73.4	Confident	66 Å²	66	83.4 Å²	83.4	46%	0.462	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-87.6	152.4	156.1	-174.8	0	0	0	0	108.7	V587 Q591 G592	V587-S589 PolarHBondContact O-N 2.8Å; V587-S589 VanDerWaalsContact O-N 3.15Å; S589-Q591 CarbonylContact O-C 3.57Å; S589-Q591 PolarHBondContact O-N 3.33Å; S589-G592 PolarHBondContact O-N 3.37Å
590	E	54.4	Low	72.8	Confident	204 Å²	204	89.2 Å²	89.2	95%	0.953	46%	0.461	S	S	*	.	S	Bend	trans	-62.4	-25.6	-179.8	-60	-169.9	152.9	0	0	112.1	G592	E590-G592 PolarHBondContact O-N 3.38Å
591	Q	54.8	Low	72.5	Confident	174 Å²	174	91.7 Å²	91.7	81%	0.813	48%	0.475	S	S	*	.	S	Bend	trans	-91.7	84.1	161.6	-64.7	-177.3	3.2	0	0	109.6	S589 G593	S589-Q591 CarbonylContact O-C 3.57Å; S589-Q591 PolarHBondContact O-N 3.33Å; Q591-G593 PolarHBondContact O-N 3Å
592	G	55.7	Low	72.1	Confident	49 Å²	49	90.9 Å²	90.9	51%	0.505	48%	0.476	S	S	.	.			trans	-68.2	92.1	-177.7	0	0	0	0	0	113.4	S589 E590	S589-G592 PolarHBondContact O-N 3.37Å; E590-G592 PolarHBondContact O-N 3.38Å
593	G	61.9	Low	71.9	Confident	44 Å²	44	92 Å²	92	45%	0.454	48%	0.48	S	S	.	.			trans	-58	142.8	-179.4	0	0	0	0	0	113.4	Q591 L595 S596	Q591-G593 PolarHBondContact O-N 3Å; G593-L595 PolarHBondContact O-N 2.71Å; G593-L595 VanDerWaalsContact O-N 3.08Å; G593-S596 WeakPolarHBondContact O-CB 3.32Å; G593-S596 PolarHBondContact O-N 3.16Å; G593-S596 PolarHBondContact O-OG 2.73Å
594	A	65.6	Low	71.6	Confident	73 Å²	73	90 Å²	90	60%	0.603	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-52.6	-38	-169.6	0	0	0	0	0	114.2	S596 R597	A594-S596 PolarHBondContact O-N 3.28Å; A594-R597 WeakPolarHBondContact O-CB 3.46Å; A594-R597 PolarHBondContact O-N 2.98Å; A594-R597 VanDerWaalsContact O-N 3.15Å
595	L	66.6	Low	71.4	Confident	121 Å²	121	85.8 Å²	85.8	63%	0.634	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-57.9	-29.8	178.4	-69.1	164.3	0	0	0	113.8	L585 G593 R597 H598 A599	L585-L595 HydrophobicContact CD2-CB 3.72Å; G593-L595 PolarHBondContact O-N 2.71Å; G593-L595 VanDerWaalsContact O-N 3.08Å; L595-R597 PolarHBondContact O-N 3.28Å; L595-H598 CarbonylContact O-C 3.56Å; L595-H598 WeakPolarHBondContact O-CA 3.43Å; L595-H598 PolarHBondContact O-N 2.76Å; L595-A599 PolarHBondContact O-N 3.13Å; L595-A599 VanDerWaalsContact O-N 3.14Å
596	S	70.1	Confident	71	Confident	50 Å²	50	91 Å²	91	35%	0.35	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-60.7	-33.2	178	64.9	0	0	0	0	112.6	G593 A594 H598 A599	G593-S596 WeakPolarHBondContact O-CB 3.32Å; G593-S596 PolarHBondContact O-N 3.16Å; G593-S596 PolarHBondContact O-OG 2.73Å; A594-S596 PolarHBondContact O-N 3.28Å; S596-H598 PolarHBondContact O-N 3.42Å; S596-A599 WeakPolarHBondContact O-CB 3.42Å; S596-A599 PolarHBondContact O-N 3.22Å
597	R	71.7	Confident	70.8	Confident	209 Å²	209	96.4 Å²	96.4	79%	0.789	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-64.7	-25.1	174.6	-58.7	-179.6	179.6	177.6	-0.5	112.3	A594 L595	A594-R597 WeakPolarHBondContact O-CB 3.46Å; A594-R597 PolarHBondContact O-N 2.98Å; A594-R597 VanDerWaalsContact O-N 3.15Å; L595-R597 PolarHBondContact O-N 3.28Å
598	H	78.5	Confident	70.8	Confident	107 Å²	107	100.4 Å²	100.4	50%	0.495	55%	0.55	S	S	.	.	G	3₁₀ helix	trans	-99.1	-3.7	179.6	-63.6	-95.8	0	0	0	113.2	L595 S596 K600 K601 L602	L595-H598 CarbonylContact O-C 3.56Å; L595-H598 WeakPolarHBondContact O-CA 3.43Å; L595-H598 PolarHBondContact O-N 2.76Å; S596-H598 PolarHBondContact O-N 3.42Å; H598-K600 VanDerWaalsContact C-N 3.27Å; H598-K600 PolarHBondContact O-N 3.31Å; H598-K601 WeakPolarHBondContact O-CA 3.21Å; H598-K601 WeakPolarHBondContact O-CB 3.48Å; H598-K601 PolarHBondContact O-N 2.86Å; H598-L602 PolarHBondContact O-N 2.95Å
599	A	78.6	Confident	70.9	Confident	3 Å²	3	97 Å²	97	3%	0.025	53%	0.531	C	S	.	.	H	α-helix	trans	-54.7	-38.9	-177	0	0	0	0	0	113.1	L550 L595 S596 K601 L602 F603	L550-A599 HydrophobicContact CD2-CB 4.26Å; L595-A599 PolarHBondContact O-N 3.13Å; L595-A599 VanDerWaalsContact O-N 3.14Å; S596-A599 WeakPolarHBondContact O-CB 3.42Å; S596-A599 PolarHBondContact O-N 3.22Å; A599-K601 PolarHBondContact O-N 3.13Å; A599-L602 PolarHBondContact O-N 3.35Å; A599-F603 HydrophobicContact CB-CD2 4.44Å; A599-F603 WeakPolarHBondContact O-CD2 3.42Å; A599-F603 PolarHBondContact O-N 3.17Å
600	K	79.8	Confident	71.6	Confident	124 Å²	124	96.2 Å²	96.2	54%	0.539	52%	0.524	S	S	.	.	H	α-helix	trans	-60.3	-43.6	173	-73.3	-162.4	171.7	-158.9	0	112.7	L550 H598 L602 L604	L550-K600 HydrophobicContact CB-CG 4.37Å; L550-K600 HydrophobicContact CD2-CG 4.08Å; L550-K600 WeakPolarHBondContact O-CE 3.25Å; L550-K600 PolarHBondContact O-NZ 2.67Å; L550-K600 VanDerWaalsContact O-NZ 3.13Å; H598-K600 VanDerWaalsContact C-N 3.27Å; H598-K600 PolarHBondContact O-N 3.31Å; K600-L602 VanDerWaalsContact C-N 3.34Å; K600-L604 VanDerWaalsContact O-CB 3.24Å; K600-L604 WeakPolarHBondContact O-CB 3.44Å; K600-L604 PolarHBondContact O-N 3.14Å
601	K	81.1	Confident	72.3	Confident	167 Å²	167	92.9 Å²	92.9	73%	0.726	51%	0.511	S	S	*	.	H	α-helix	trans	-68.3	-32.9	176.6	-64.5	-167.1	177.3	-169.3	0	112	H598 A599 A605	H598-K601 WeakPolarHBondContact O-CA 3.21Å; H598-K601 WeakPolarHBondContact O-CB 3.48Å; H598-K601 PolarHBondContact O-N 2.86Å; A599-K601 PolarHBondContact O-N 3.13Å; K601-A605 VanDerWaalsContact O-CB 3.31Å; K601-A605 WeakPolarHBondContact O-CB 3.11Å; K601-A605 PolarHBondContact O-N 3.42Å
602	L	81.8	Confident	73	Confident	104 Å²	104	85.4 Å²	85.4	55%	0.545	48%	0.477	S	S	.	.	H	α-helix	trans	-74	-44.6	-179.7	-173.4	66.7	0	0	0	112.9	L585 H598 A599 K600	L585-L602 HydrophobicContact CD1-CD2 3.94Å; H598-L602 PolarHBondContact O-N 2.95Å; A599-L602 PolarHBondContact O-N 3.35Å; K600-L602 VanDerWaalsContact C-N 3.34Å
603	F	82.1	Confident	73.6	Confident	30 Å²	30	87.3 Å²	87.3	13%	0.132	47%	0.473	C	S	.	.	H	α-helix	trans	-91	-16.8	-175	-73	-75.3	0	0	0	114.5	A546 K547 L550 T582 L585 I586 A599	A546-F603 HydrophobicContact CB-CD1 4.12Å; A546-F603 HydrophobicContact CB-CE1 4.03Å; A546-F603 HydrophobicContact CB-CZ 4.43Å; K547-F603 VanDerWaalsContact CE-O 3.24Å; K547-F603 WeakPolarHBondContact CE-O 3.42Å; K547-F603 HydrophobicContact CG-CB 4.37Å; L550-F603 HydrophobicContact CD1-CB 3.73Å; L550-F603 HydrophobicContact CD1-CD2 3.82Å; L550-F603 HydrophobicContact CD1-CG 4.09Å; T582-F603 HydrophobicContact CG2-CZ 4.29Å; L585-F603 HydrophobicContact CB-CE2 4.25Å; L585-F603 HydrophobicContact CD1-CE2 3.92Å; L585-F603 HydrophobicContact CD1-CZ 4.02Å; I586-F603 HydrophobicContact CD1-CD2 4.08Å; I586-F603 HydrophobicContact CD1-CE2 3.7Å; I586-F603 HydrophobicContact CD1-CZ 4.04Å; I586-F603 HydrophobicContact CG1-CD2 4.48Å; I586-F603 HydrophobicContact CG1-CE2 3.98Å; A599-F603 HydrophobicContact CB-CD2 4.44Å; A599-F603 WeakPolarHBondContact O-CD2 3.42Å; A599-F603 PolarHBondContact O-N 3.17Å
604	L	80.9	Confident	74.1	Confident	65 Å²	65	86.6 Å²	86.6	34%	0.34	46%	0.46	S	S	.	.	S	Bend	trans	-118.1	17.8	179.9	-50.3	170.9	0	0	0	112.9	K547 T551 K600	K547-L604 HydrophobicContact CB-CD2 4.26Å; K547-L604 HydrophobicContact CD-CD2 4.39Å; K547-L604 HydrophobicContact CG-CD2 4.1Å; T551-L604 HydrophobicContact CG2-CD1 4.15Å; T551-L604 HydrophobicContact CG2-CD2 4.31Å; K600-L604 VanDerWaalsContact O-CB 3.24Å; K600-L604 WeakPolarHBondContact O-CB 3.44Å; K600-L604 PolarHBondContact O-N 3.14Å
605	A	80.2	Confident	74.1	Confident	46 Å²	46	86.8 Å²	86.8	38%	0.38	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-65.6	131.9	169.2	0	0	0	0	0	110.2	K601 K607	K601-A605 VanDerWaalsContact O-CB 3.31Å; K601-A605 WeakPolarHBondContact O-CB 3.11Å; K601-A605 PolarHBondContact O-N 3.42Å; A605-K607 PolarHBondContact O-N 3.16Å
606	P	72.3	Confident	74.2	Confident	122 Å²	122	81.7 Å²	81.7	79%	0.792	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-63.4	129.1	174.6	27.7	-34.1	0	0	0	109.4
607	K	76.4	Confident	74	Confident	125 Å²	125	83 Å²	83	54%	0.543	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-89.1	142.3	178.7	-55.4	-163.4	-178.2	-154.9	0	110.2	W506 A605 A609	W506-K607 HydrophobicContact CZ2-CD 4.41Å; A605-K607 PolarHBondContact O-N 3.16Å; K607-A609 PolarHBondContact O-N 2.8Å
608	P	72.3	Confident	73.9	Confident	118 Å²	118	77.1 Å²	77.1	77%	0.766	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-58.1	140.5	173.2	25.8	-34.1	0	0	0	110
609	A	67.3	Low	74	Confident	37 Å²	37	73.5 Å²	73.5	31%	0.306	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-69.9	134.8	177.4	0	0	0	0	0	110	Q475 M476 K607 I611	Q475-A609 HydrophobicContact CB-CB 4.09Å; M476-A609 HydrophobicContact SD-CB 3.55Å; M476-A609 VanDerWaalsContact SD-CB 3.55Å; K607-A609 PolarHBondContact O-N 2.8Å; A609-I611 PolarHBondContact O-N 2.71Å
610	P	70.7	Confident	73.6	Confident	49 Å²	49	75.2 Å²	75.2	32%	0.318	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-71.8	120.7	177.8	29	-34.6	0	0	0	110.2	K472 Q475 L612	K472-P610 HydrophobicContact CB-CG 4.07Å; K472-P610 HydrophobicContact CG-CB 4.49Å; K472-P610 HydrophobicContact CG-CG 3.74Å; Q475-P610 VanDerWaalsContact CD-CD 3.5Å; P610-L612 PolarHBondContact O-N 2.81Å
611	I	70.2	Confident	73.5	Confident	133 Å²	133	76.2 Å²	76.2	68%	0.682	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-65.1	134.4	174.2	-51	178.9	0	0	0	108.7	A609 E613	A609-I611 PolarHBondContact O-N 2.71Å; I611-E613 HydrophobicContact CB-CG 3.98Å; I611-E613 HydrophobicContact CG2-CG 3.61Å; I611-E613 PolarHBondContact O-N 3.25Å
612	L	68.8	Low	73.7	Confident	17 Å²	17	69.3 Å²	69.3	9%	0.089	38%	0.381	C	S	.	.			trans	-92.4	73.9	-178.1	-167.1	70.1	0	0	0	111.4	G434 R435 K472 P610	G434-L612 WeakPolarHBondContact O-CD2 3.37Å; R435-L612 HydrophobicContact CB-CD2 4.36Å; R435-L612 HydrophobicContact CG-CD2 3.73Å; R435-L612 HydrophobicContact CG-CG 3.82Å; R435-L612 VanDerWaalsContact N-CD2 3.26Å; K472-L612 HydrophobicContact CD-CD1 3.37Å; K472-L612 VanDerWaalsContact NZ-CD1 3.31Å; P610-L612 PolarHBondContact O-N 2.81Å
613	E	69.1	Low	73.8	Confident	90 Å²	90	65.2 Å²	65.2	42%	0.421	36%	0.359	S	S	.	.			trans	-75.6	164.6	-172.7	-54.6	-165.8	137.4	0	0	113.2	R435 I611 K617	R435-E613 PolarHBondContact NE-O 3.14Å; R435-E613 PolarHBondContact NH2-O 2.76Å; I611-E613 HydrophobicContact CB-CG 3.98Å; I611-E613 HydrophobicContact CG2-CG 3.61Å; I611-E613 PolarHBondContact O-N 3.25Å; E613-K617 HydrophobicContact CB-CD 4.17Å; E613-K617 HydrophobicContact CG-CD 4.33Å; E613-K617 IonicContact OE1-NZ 2.71Å; E613-K617 PolarHBondContact OE1-NZ 3.48Å; E613-K617 VanDerWaalsContact OE2-CD 3.24Å; E613-K617 WeakPolarHBondContact OE2-CD 3.3Å; E613-K617 IonicContact OE2-NZ 2.78Å; E613-K617 PolarHBondContact OE2-NZ 3.2Å
614	S	72.1	Confident	73.9	Confident	28 Å²	28	63.9 Å²	63.9	20%	0.196	35%	0.353	C	S	.	.			trans	-79.3	146.2	173.2	54.1	0	0	0	0	111.2	E396 F616 K617	E396-S614 WeakPolarHBondContact OE1-CB 3.43Å; S614-F616 PolarHBondContact O-N 3.11Å; S614-F616 VanDerWaalsContact O-N 3.09Å; S614-K617 WeakPolarHBondContact O-CB 3.28Å; S614-K617 PolarHBondContact O-N 3.18Å; S614-K617 PolarHBondContact OG-N 2.92Å
615	S	66.6	Low	73.9	Confident	78 Å²	78	62.4 Å²	62.4	55%	0.545	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	4.8	166	42.8	0	0	0	0	112.9	R619	S615-R619 PolarHBondContact O-NH1 3.23Å
616	F	66.8	Low	74.2	Confident	14 Å²	14	61.2 Å²	61.2	6%	0.061	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	3.8	178.9	-71.5	-99.5	0	0	0	112.7	A363 I367 L393 E396 S614	A363-F616 HydrophobicContact CB-CD1 4.17Å; A363-F616 HydrophobicContact CB-CE1 4.45Å; I367-F616 HydrophobicContact CD1-CB 4.29Å; L393-F616 HydrophobicContact CD2-CE1 3.45Å; L393-F616 VanDerWaalsContact CD2-CE1 3.45Å; L393-F616 HydrophobicContact CD2-CZ 3.48Å; L393-F616 VanDerWaalsContact CD2-CZ 3.48Å; L393-F616 HydrophobicContact CG-CZ 4.38Å; E396-F616 HydrophobicContact CB-CD2 4.29Å; E396-F616 HydrophobicContact CB-CE2 4.18Å; E396-F616 HydrophobicContact CG-CB 4.48Å; E396-F616 HydrophobicContact CG-CD2 3.5Å; E396-F616 HydrophobicContact CG-CE2 3.89Å; E396-F616 HydrophobicContact CG-CG 4.02Å; S614-F616 PolarHBondContact O-N 3.11Å; S614-F616 VanDerWaalsContact O-N 3.09Å
617	K	66.6	Low	75	Confident	77 Å²	77	60.5 Å²	60.5	34%	0.335	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	158	172	-160.3	-172.7	150.6	-175.9	0	110.6	E613 S614 R619	E613-K617 HydrophobicContact CB-CD 4.17Å; E613-K617 HydrophobicContact CG-CD 4.33Å; E613-K617 IonicContact OE1-NZ 2.71Å; E613-K617 PolarHBondContact OE1-NZ 3.48Å; E613-K617 VanDerWaalsContact OE2-CD 3.24Å; E613-K617 WeakPolarHBondContact OE2-CD 3.3Å; E613-K617 IonicContact OE2-NZ 2.78Å; E613-K617 PolarHBondContact OE2-NZ 3.2Å; S614-K617 WeakPolarHBondContact O-CB 3.28Å; S614-K617 PolarHBondContact O-N 3.18Å; S614-K617 PolarHBondContact OG-N 2.92Å; K617-R619 PolarHBondContact O-N 3.01Å
618	D	70.5	Confident	75.6	Confident	86 Å²	86	54.6 Å²	54.6	46%	0.46	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	-13	177.3	-45.1	-41.7	0	0	0	115.5	D620 H621	D618-D620 PolarHBondContact O-N 3.36Å; D618-H621 PolarHBondContact O-CD2 3.46Å; D618-H621 PolarHBondContact O-N 3.43Å
619	R	79.1	Confident	76.4	Confident	30 Å²	30	49 Å²	49	11%	0.113	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-56.3	-20.6	166.3	-78.3	-174.3	159.1	116.7	-0.8	113.6	Q360 S615 K617 H621 F622 H629 L630 N632	Q360-R619 VanDerWaalsContact NE2-NH2 3.14Å; S615-R619 PolarHBondContact O-NH1 3.23Å; K617-R619 PolarHBondContact O-N 3.01Å; R619-H621 PolarHBondContact O-N 2.67Å; R619-F622 PolarHBondContact O-N 3Å; R619-F622 VanDerWaalsContact O-N 3.08Å; R619-H629 PolarHBondContact NE-O 3.44Å; R619-H629 VanDerWaalsContact NE-O 3.12Å; R619-L630 PolarHBondContact NH2-O 3.15Å; R619-N632 WeakPolarHBondContact CA-OD1 3.42Å; R619-N632 HydrophobicContact CG-CB 3.9Å; R619-N632 VanDerWaalsContact CG-CG 3.43Å; R619-N632 WeakPolarHBondContact CG-OD1 3.41Å; R619-N632 PolarHBondContact N-OD1 3.42Å
620	D	70.9	Confident	77.3	Confident	40 Å²	40	49.3 Å²	49.3	21%	0.214	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-64.8	-13	-179.5	-90.7	-43	0	0	0	115.3	T364 K368 D618	T364-D620 WeakPolarHBondContact CG2-OD1 3.37Å; K368-D620 WeakPolarHBondContact CD-OD1 3.44Å; K368-D620 WeakPolarHBondContact CE-OD1 3.27Å; K368-D620 VanDerWaalsContact NZ-CB 3.32Å; K368-D620 VanDerWaalsContact NZ-CG 3.29Å; K368-D620 PolarHBondContact NZ-O 2.77Å; K368-D620 IonicContact NZ-OD1 2.71Å; K368-D620 PolarHBondContact NZ-OD1 3.44Å; D618-D620 PolarHBondContact O-N 3.36Å
621	H	77.8	Confident	78.1	Confident	144 Å²	144	52.1 Å²	52.1	67%	0.667	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-82.5	-16.1	172.6	-60.9	-64.9	0	0	0	113.4	D618 R619	D618-H621 PolarHBondContact O-CD2 3.46Å; D618-H621 PolarHBondContact O-N 3.43Å; R619-H621 PolarHBondContact O-N 2.67Å
622	F	84.6	Confident	78.9	Confident	22 Å²	22	48.7 Å²	48.7	10%	0.096	26%	0.261	C	S	.	.	S	Bend	trans	-92.9	145.3	179.7	-60.5	-67.4	0	0	0	112.1	R619 L624 S628 H629 N632 K634 Y638	R619-F622 PolarHBondContact O-N 3Å; R619-F622 VanDerWaalsContact O-N 3.08Å; F622-L624 PolarHBondContact O-N 2.86Å; F622-S628 VanDerWaalsContact CD1-CB 3.5Å; F622-H629 HydrophobicContact CB-CB 3.71Å; F622-N632 WeakPolarHBondContact CE2-OD1 3.42Å; F622-K634 HydrophobicContact CE1-CG 3.81Å; F622-K634 HydrophobicContact CZ-CG 4.45Å; F622-Y638 WeakPolarHBondContact CA-OH 3.26Å; F622-Y638 HydrophobicContact CD1-CD1 4.48Å; F622-Y638 AromaticContact CD1-CE1 3.77Å; F622-Y638 HydrophobicContact CD1-CE1 3.77Å; F622-Y638 AromaticContact CD1-CZ 3.92Å; F622-Y638 HydrophobicContact CE1-CE1 4.24Å
623	Q	83.8	Confident	79.7	Confident	19 Å²	19	50.3 Å²	50.3	9%	0.089	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-60.3	127.3	170.2	-174.1	-178.1	32.7	0	0	109.5	Q326 S626 H629 Y638 L641	Q326-Q623 HydrophobicContact CG-CG 4.47Å; Q326-Q623 VanDerWaalsContact NE2-CD 3.26Å; Q623-S626 VanDerWaalsContact O-CB 3.28Å; Q623-S626 WeakPolarHBondContact O-CB 3.35Å; Q623-S626 PolarHBondContact O-N 2.88Å; Q623-S626 PolarHBondContact O-OG 2.99Å; Q623-H629 WeakPolarHBondContact O-CB 3.35Å; Q623-Y638 HydrophobicContact CB-CE2 4.27Å; Q623-Y638 PolarHBondContact N-OH 3.05Å; Q623-L641 HydrophobicContact CB-CD1 4.43Å; Q623-L641 HydrophobicContact CB-CG 4.45Å; Q623-L641 HydrophobicContact CG-CD1 3.8Å; Q623-L641 HydrophobicContact CG-CG 4.01Å
624	L	85.1	Confident	80.5	Confident	1 Å²	1	53 Å²	53	1%	0.005	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	144.5	179.9	-79.7	74.5	0	0	0	109.9	Q326 F329 H330 N361 T364 M365 F622 S626	Q326-L624 WeakPolarHBondContact CG-O 3.25Å; Q326-L624 PolarHBondContact NE2-O 2.95Å; Q326-L624 PolarHBondContact OE1-O 3.35Å; F329-L624 HydrophobicContact CD1-CD1 3.88Å; F329-L624 HydrophobicContact CD1-CD2 3.76Å; F329-L624 HydrophobicContact CD1-CG 4.4Å; F329-L624 HydrophobicContact CE1-CD1 3.6Å; F329-L624 HydrophobicContact CE1-CD2 3.79Å; F329-L624 HydrophobicContact CE1-CG 4.37Å; F329-L624 HydrophobicContact CG-CD2 4.16Å; F329-L624 HydrophobicContact CZ-CD2 4.21Å; H330-L624 PolarHBondContact NE2-N 3.29Å; N361-L624 WeakPolarHBondContact OD1-CB 3.21Å; T364-L624 HydrophobicContact CG2-CD1 4.34Å; T364-L624 HydrophobicContact CG2-CG 4.49Å; M365-L624 HydrophobicContact CE-CD2 3.58Å; M365-L624 HydrophobicContact CG-CD2 3.46Å; M365-L624 VanDerWaalsContact CG-CD2 3.46Å; M365-L624 HydrophobicContact SD-CD2 4.38Å; F622-L624 PolarHBondContact O-N 2.86Å; L624-S626 PolarHBondContact O-N 2.93Å
625	G	80.7	Confident	81.2	Confident	35 Å²	35	52.9 Å²	52.9	36%	0.361	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	-14.4	-175	0	0	0	0	0	115.2	N361	N361-G625 PolarHBondContact OD1-N 3.3Å
626	S	87.1	Confident	82	Confident	21 Å²	21	56.4 Å²	56.4	15%	0.147	31%	0.307	C	S	.	.	S	Bend	trans	-73.3	155.8	179.5	71	0	0	0	0	113.4	Q623 L624 S628 H629 L630	Q623-S626 VanDerWaalsContact O-CB 3.28Å; Q623-S626 WeakPolarHBondContact O-CB 3.35Å; Q623-S626 PolarHBondContact O-N 2.88Å; Q623-S626 PolarHBondContact O-OG 2.99Å; L624-S626 PolarHBondContact O-N 2.93Å; S626-S628 PolarHBondContact O-N 3.32Å; S626-H629 WeakPolarHBondContact O-CB 3.36Å; S626-H629 PolarHBondContact O-N 3.21Å; S626-H629 WeakPolarHBondContact OG-CB 3.46Å; S626-H629 PolarHBondContact OG-N 3.16Å; S626-H629 VanDerWaalsContact OG-N 3.15Å; S626-L630 PolarHBondContact O-N 3.26Å; S626-L630 VanDerWaalsContact O-N 3.17Å
627	L	88.9	Confident	82.3	Confident	106 Å²	106	59.5 Å²	59.5	56%	0.555	34%	0.342	S	S	*	.	H	α-helix	trans	-59.1	-36.2	171.6	-179.1	60.7	0	0	0	111.6	H629 L630 L631 A635	L627-H629 VanDerWaalsContact C-N 3.34Å; L627-H629 PolarHBondContact O-N 3.37Å; L627-L630 WeakPolarHBondContact O-CB 3.32Å; L627-L630 PolarHBondContact O-N 3.19Å; L627-L631 HydrophobicContact CD1-CD1 3.95Å; L627-L631 HydrophobicContact CD1-CG 4.04Å; L627-L631 HydrophobicContact CD2-CD1 4.46Å; L627-L631 HydrophobicContact CG-CD1 3.9Å; L627-L631 HydrophobicContact CG-CG 4.35Å; L627-L631 WeakPolarHBondContact O-CG 3.36Å; L627-L631 PolarHBondContact O-N 3.44Å; L627-A635 HydrophobicContact CD2-CB 4.19Å; L627-A635 HydrophobicContact CG-CB 4.34Å
628	S	88.4	Confident	83.2	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.007	33%	0.334	C	S	.	.	H	α-helix	trans	-62.6	-39.7	177.3	-54.3	0	0	0	0	112.7	F622 S626 N632 A633 A635 Y638	F622-S628 VanDerWaalsContact CD1-CB 3.5Å; S626-S628 PolarHBondContact O-N 3.32Å; S628-N632 VanDerWaalsContact O-CA 3.3Å; S628-N632 WeakPolarHBondContact O-CA 3.23Å; S628-N632 PolarHBondContact O-N 3.3Å; S628-A633 WeakPolarHBondContact CA-O 3.28Å; S628-A633 WeakPolarHBondContact CB-O 3.45Å; S628-A633 PolarHBondContact O-N 3.11Å; S628-A633 PolarHBondContact OG-O 2.89Å; S628-A635 PolarHBondContact OG-N 3.42Å; S628-A635 VanDerWaalsContact OG-N 3.11Å; S628-Y638 VanDerWaalsContact OG-CB 3.3Å; S628-Y638 WeakPolarHBondContact OG-CB 3Å; S628-Y638 WeakPolarHBondContact OG-CD2 3.39Å
629	H	88.6	Confident	83.5	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-65.4	-38.8	174.3	174.8	-95.5	0	0	0	112.5	Q360 N361 T364 R619 F622 Q623 S626 L627	Q360-H629 PolarHBondContact NE2-O 3.28Å; N361-H629 PolarHBondContact OD1-CE1 3.25Å; N361-H629 PolarHBondContact OD1-ND1 2.87Å; T364-H629 WeakPolarHBondContact CB-NE2 3.32Å; T364-H629 PolarHBondContact OG1-CE1 2.91Å; T364-H629 PolarHBondContact OG1-NE2 3.49Å; R619-H629 PolarHBondContact NE-O 3.44Å; R619-H629 VanDerWaalsContact NE-O 3.12Å; F622-H629 HydrophobicContact CB-CB 3.71Å; Q623-H629 WeakPolarHBondContact O-CB 3.35Å; S626-H629 WeakPolarHBondContact O-CB 3.36Å; S626-H629 PolarHBondContact O-N 3.21Å; S626-H629 WeakPolarHBondContact OG-CB 3.46Å; S626-H629 PolarHBondContact OG-N 3.16Å; S626-H629 VanDerWaalsContact OG-N 3.15Å; L627-H629 VanDerWaalsContact C-N 3.34Å; L627-H629 PolarHBondContact O-N 3.37Å
630	L	87.4	Confident	83.7	Confident	43 Å²	43	61.7 Å²	61.7	23%	0.225	35%	0.35	C	S	.	.	H	α-helix	trans	-62.7	-52.3	174.7	-166.2	62.9	0	0	0	110.9	Y356 Q360 R619 S626 L627 N632	Y356-L630 HydrophobicContact CD1-CD1 4.38Å; Y356-L630 HydrophobicContact CE1-CD1 3.75Å; Y356-L630 HydrophobicContact CE1-CG 4.48Å; Q360-L630 HydrophobicContact CB-CD1 4.16Å; Q360-L630 HydrophobicContact CG-CD1 3.71Å; Q360-L630 PolarHBondContact NE2-O 3.07Å; R619-L630 PolarHBondContact NH2-O 3.15Å; S626-L630 PolarHBondContact O-N 3.26Å; S626-L630 VanDerWaalsContact O-N 3.17Å; L627-L630 WeakPolarHBondContact O-CB 3.32Å; L627-L630 PolarHBondContact O-N 3.19Å; L630-N632 PolarHBondContact O-N 3.34Å
631	L	86.2	Confident	84.3	Confident	109 Å²	109	61 Å²	61	57%	0.571	35%	0.347	S	S	*	.	H	α-helix	trans	-76.7	-18.3	-176.9	-62.6	178.3	0	0	0	114.5	L627 A633	L627-L631 HydrophobicContact CD1-CD1 3.95Å; L627-L631 HydrophobicContact CD1-CG 4.04Å; L627-L631 HydrophobicContact CD2-CD1 4.46Å; L627-L631 HydrophobicContact CG-CD1 3.9Å; L627-L631 HydrophobicContact CG-CG 4.35Å; L627-L631 WeakPolarHBondContact O-CG 3.36Å; L627-L631 PolarHBondContact O-N 3.44Å; L631-A633 VanDerWaalsContact C-N 3.31Å
632	N	86.9	Confident	84.5	Confident	60 Å²	60	55.9 Å²	55.9	32%	0.321	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	35.9	-167.1	-155.5	28.5	0	0	0	113.9	R619 F622 S628 L630	R619-N632 WeakPolarHBondContact CA-OD1 3.42Å; R619-N632 HydrophobicContact CG-CB 3.9Å; R619-N632 VanDerWaalsContact CG-CG 3.43Å; R619-N632 WeakPolarHBondContact CG-OD1 3.41Å; R619-N632 PolarHBondContact N-OD1 3.42Å; F622-N632 WeakPolarHBondContact CE2-OD1 3.42Å; S628-N632 VanDerWaalsContact O-CA 3.3Å; S628-N632 WeakPolarHBondContact O-CA 3.23Å; S628-N632 PolarHBondContact O-N 3.3Å; L630-N632 PolarHBondContact O-N 3.34Å
633	A	86.8	Confident	84.3	Confident	52 Å²	52	61.6 Å²	61.6	43%	0.43	36%	0.358	S	S	.	.	S	Bend	trans	-150.9	149.6	-179.2	0	0	0	0	0	110.2	S628 L631 A635	S628-A633 WeakPolarHBondContact CA-O 3.28Å; S628-A633 WeakPolarHBondContact CB-O 3.45Å; S628-A633 PolarHBondContact O-N 3.11Å; S628-A633 PolarHBondContact OG-O 2.89Å; L631-A633 VanDerWaalsContact C-N 3.31Å; A633-A635 PolarHBondContact O-N 3.19Å; A633-A635 VanDerWaalsContact O-N 3.08Å
634	K	85.9	Confident	84.1	Confident	147 Å²	147	62.9 Å²	62.9	64%	0.639	36%	0.362	S	S	*	.			trans	-67.3	108.4	175.4	-67.7	-172.1	-169.1	-157.9	0	109.8	F622 Y638 E640	F622-K634 HydrophobicContact CE1-CG 3.81Å; F622-K634 HydrophobicContact CZ-CG 4.45Å; K634-Y638 HydrophobicContact CG-CD1 4.26Å; K634-E640 WeakPolarHBondContact CE-OE1 3.49Å; K634-E640 IonicContact NZ-OE1 3.47Å; K634-E640 PolarHBondContact NZ-OE1 3.47Å
635	A	86.2	Confident	83.9	Confident	25 Å²	25	64.2 Å²	64.2	21%	0.207	37%	0.371	C	S	.	.			trans	-71.5	158	171.5	0	0	0	0	0	111.2	L627 S628 A633 G637 Y638	L627-A635 HydrophobicContact CD2-CB 4.19Å; L627-A635 HydrophobicContact CG-CB 4.34Å; S628-A635 PolarHBondContact OG-N 3.42Å; S628-A635 VanDerWaalsContact OG-N 3.11Å; A633-A635 PolarHBondContact O-N 3.19Å; A633-A635 VanDerWaalsContact O-N 3.08Å; A635-G637 PolarHBondContact O-N 2.9Å; A635-Y638 WeakPolarHBondContact O-CB 3.2Å; A635-Y638 PolarHBondContact O-N 3.04Å; A635-Y638 VanDerWaalsContact O-N 3.12Å
636	T	82.9	Confident	83.3	Confident	152 Å²	152	71.4 Å²	71.4	93%	0.933	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	134.2	173.9	40.9	0	0	0	0	110.9	Y638	T636-Y638 VanDerWaalsContact C-N 3.26Å; T636-Y638 PolarHBondContact O-N 3.1Å
637	G	75.1	Confident	82.5	Confident	78 Å²	78	78.5 Å²	78.5	80%	0.804	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	2	-175.8	0	0	0	0	0	115.7	A635 Q639	A635-G637 PolarHBondContact O-N 2.9Å; G637-Q639 PolarHBondContact O-N 3.34Å
638	Y	83.7	Confident	81.5	Confident	41 Å²	41	75.9 Å²	75.9	16%	0.161	42%	0.42	C	S	.	.			trans	-68.1	112.9	177.2	175.2	-107.2	0	0	0	112	F622 Q623 S628 K634 A635 T636 E640	F622-Y638 WeakPolarHBondContact CA-OH 3.26Å; F622-Y638 HydrophobicContact CD1-CD1 4.48Å; F622-Y638 AromaticContact CD1-CE1 3.77Å; F622-Y638 HydrophobicContact CD1-CE1 3.77Å; F622-Y638 AromaticContact CD1-CZ 3.92Å; F622-Y638 HydrophobicContact CE1-CE1 4.24Å; Q623-Y638 HydrophobicContact CB-CE2 4.27Å; Q623-Y638 PolarHBondContact N-OH 3.05Å; S628-Y638 VanDerWaalsContact OG-CB 3.3Å; S628-Y638 WeakPolarHBondContact OG-CB 3Å; S628-Y638 WeakPolarHBondContact OG-CD2 3.39Å; K634-Y638 HydrophobicContact CG-CD1 4.26Å; A635-Y638 WeakPolarHBondContact O-CB 3.2Å; A635-Y638 PolarHBondContact O-N 3.04Å; A635-Y638 VanDerWaalsContact O-N 3.12Å; T636-Y638 VanDerWaalsContact C-N 3.26Å; T636-Y638 PolarHBondContact O-N 3.1Å; Y638-E640 HydrophobicContact CD1-CG 4.3Å; Y638-E640 HydrophobicContact CE1-CG 3.43Å; Y638-E640 VanDerWaalsContact CE1-CG 3.43Å
639	Q	78.3	Confident	80.6	Confident	101 Å²	101	78.2 Å²	78.2	47%	0.472	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-100.2	121.2	172.3	-63.9	178.2	13.6	0	0	110.4	R245 G637	R245-Q639 PolarHBondContact NH2-O 3.2Å; G637-Q639 PolarHBondContact O-N 3.34Å
640	E	82.1	Confident	79.5	Confident	97 Å²	97	82.6 Å²	82.6	45%	0.453	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-60.3	156.3	176	-75.4	162.1	-151.9	0	0	112.2	R245 K634 Y638	R245-E640 PolarHBondContact NH1-O 2.98Å; R245-E640 PolarHBondContact NH2-O 3.02Å; K634-E640 WeakPolarHBondContact CE-OE1 3.49Å; K634-E640 IonicContact NZ-OE1 3.47Å; K634-E640 PolarHBondContact NZ-OE1 3.47Å; Y638-E640 HydrophobicContact CD1-CG 4.3Å; Y638-E640 HydrophobicContact CE1-CG 3.43Å; Y638-E640 VanDerWaalsContact CE1-CG 3.43Å
641	L	83	Confident	78.5	Confident	27 Å²	27	83.4 Å²	83.4	14%	0.141	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-70.6	133	172.7	-90.2	175.1	0	0	0	109	T244 R248 H330 Q623	T244-L641 HydrophobicContact CG2-CD2 4.06Å; R248-L641 HydrophobicContact CG-CD2 4.31Å; H330-L641 HydrophobicContact CB-CD1 4.13Å; Q623-L641 HydrophobicContact CB-CD1 4.43Å; Q623-L641 HydrophobicContact CB-CG 4.45Å; Q623-L641 HydrophobicContact CG-CD1 3.8Å; Q623-L641 HydrophobicContact CG-CG 4.01Å
642	P	82.4	Confident	77.5	Confident	36 Å²	36	81.3 Å²	81.3	23%	0.234	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-59	146.9	172.5	-25	36.4	0	0	0	112.1	R245 R248 T249	R245-P642 HydrophobicContact CG-CG 4.07Å; R248-P642 HydrophobicContact CB-CB 4.45Å; R248-P642 PolarHBondContact NH1-O 2.68Å; R248-P642 VanDerWaalsContact NH1-O 3.16Å; T249-P642 HydrophobicContact CG2-CB 3.48Å; T249-P642 VanDerWaalsContact CG2-CB 3.48Å; T249-P642 HydrophobicContact CG2-CG 3.64Å
643	D	80.3	Confident	76.7	Confident	141 Å²	141	81.9 Å²	81.9	75%	0.754	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-67.6	160.4	165	-74.3	-52.3	0	0	0	111.1
644	W	81.1	Confident	76	Confident	46 Å²	46	79.8 Å²	79.8	17%	0.174	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-72.2	139.5	-179.8	-62.6	105.1	0	0	0	110.8	R248 S253 H330 L331	R248-W644 VanDerWaalsContact CD-CE2 3.48Å; S253-W644 PolarHBondContact OG-NE1 3.41Å; H330-W644 WeakPolarHBondContact O-CZ2 3.39Å; L331-W644 HydrophobicContact CB-CH2 4.48Å; L331-W644 HydrophobicContact CD2-CH2 3.56Å; L331-W644 HydrophobicContact CD2-CZ2 4.25Å; L331-W644 HydrophobicContact CD2-CZ3 4.11Å
645	P	79.8	Confident	74.7	Confident	30 Å²	30	77 Å²	77	20%	0.195	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-65.9	151.7	172.4	30.9	-38.1	0	0	0	111.4	R248 F251 L252	R248-P645 WeakPolarHBondContact O-CD 3.42Å; F251-P645 WeakPolarHBondContact O-CD 3.48Å; F251-P645 WeakPolarHBondContact O-CG 3.35Å; L252-P645 VanDerWaalsContact CD2-O 3.31Å; L252-P645 WeakPolarHBondContact CD2-O 3.34Å
646	E	68.8	Low	73.2	Confident	186 Å²	186	79.8 Å²	79.8	87%	0.869	45%	0.453	S	S	*	.	S	Bend	trans	-78.8	-31.7	175.2	-59.7	-171.4	158.3	0	0	112.3	L252	L252-E646 WeakPolarHBondContact CD2-O 3.16Å
647	E	69.4	Low	71.2	Confident	170 Å²	170	81 Å²	81	79%	0.794	45%	0.448	S	S	*	.	S	Bend	trans	-123.7	138.4	174.4	-62.5	-168.6	156.5	0	0	110.4
648	A	68.3	Low	69.4	Low	51 Å²	51	83.1 Å²	83.1	42%	0.421	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-80.2	131	177.7	0	0	0	0	0	111.2	L252	L252-A648 HydrophobicContact CD2-CB 4.47Å; L252-A648 HydrophobicContact CG-CB 4.15Å
649	P	69.5	Low	66.9	Low	49 Å²	49	86.3 Å²	86.3	32%	0.318	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-57.7	145.2	165.2	-25	36.4	0	0	0	111.6	P651	P649-P651 WeakPolarHBondContact O-CD 3Å
650	D	66.2	Low	64.7	Low	93 Å²	93	89.2 Å²	89.2	50%	0.497	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-53.2	122	-175	-174.5	-18.2	0	0	0	111.7	S652 V653	D650-S652 PolarHBondContact O-N 3.07Å; D650-S652 WeakPolarHBondContact OD1-CB 3.42Å; D650-S652 PolarHBondContact OD1-N 3.14Å; D650-S652 PolarHBondContact OD1-OG 3.21Å; D650-V653 HydrophobicContact CB-CG2 4.4Å; D650-V653 WeakPolarHBondContact O-CB 3.34Å; D650-V653 WeakPolarHBondContact O-CG2 3.29Å; D650-V653 PolarHBondContact O-N 3.38Å
651	P	66	Low	62.6	Low	60 Å²	60	95.2 Å²	95.2	39%	0.39	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-53.3	-23.1	175.6	-27.7	35.9	0	0	0	114.1	P649 V653 R654	P649-P651 WeakPolarHBondContact O-CD 3Å; P651-V653 PolarHBondContact O-N 3.06Å; P651-R654 WeakPolarHBondContact O-CB 3.32Å; P651-R654 PolarHBondContact O-N 3.11Å
652	S	64.8	Low	60.2	Low	66 Å²	66	99.6 Å²	99.6	46%	0.462	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-59.6	-25.3	174.8	-51.2	0	0	0	0	113.5	D650 R654 N655	D650-S652 PolarHBondContact O-N 3.07Å; D650-S652 WeakPolarHBondContact OD1-CB 3.42Å; D650-S652 PolarHBondContact OD1-N 3.14Å; D650-S652 PolarHBondContact OD1-OG 3.21Å; S652-R654 PolarHBondContact O-N 3.48Å; S652-R654 VanDerWaalsContact O-N 3.15Å; S652-N655 WeakPolarHBondContact O-CA 3.33Å; S652-N655 WeakPolarHBondContact O-CB 3.35Å; S652-N655 PolarHBondContact O-N 3.02Å
653	V	69.5	Low	57.7	Low	71 Å²	71	105.8 Å²	105.8	43%	0.43	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-63.6	-20.4	175.1	-176.7	0	0	0	0	111.9	H218 D650 P651	H218-V653 HydrophobicContact CB-CG1 3.96Å; H218-V653 VanDerWaalsContact CD2-CG1 3.43Å; H218-V653 WeakPolarHBondContact CD2-CG1 3.27Å; D650-V653 HydrophobicContact CB-CG2 4.4Å; D650-V653 WeakPolarHBondContact O-CB 3.34Å; D650-V653 WeakPolarHBondContact O-CG2 3.29Å; D650-V653 PolarHBondContact O-N 3.38Å; P651-V653 PolarHBondContact O-N 3.06Å
654	R	72.2	Confident	55.1	Low	8 Å²	8	105 Å²	105	3%	0.03	56%	0.558	C	S	.	*	G	3₁₀ helix	trans	-96	-7.3	175.1	-54	167.5	-156.2	138	3.7	112.3	R222 Y246 Q250 F251 D299 D301 P651 S652 V656	R222-R654 PolarHBondContact NH1-O 3.14Å; R222-R654 VanDerWaalsContact NH1-O 3.16Å; Y246-R654 PolarHBondContact OH-NE 3.38Å; Q250-R654 PolarHBondContact O-NH2 2.74Å; F251-R654 VanDerWaalsContact CE1-NH1 3.26Å; D299-R654 IonicContact OD1-NH1 3.94Å; D299-R654 IonicContact OD2-CZ 3.92Å; D299-R654 IonicContact OD2-NH1 3.58Å; D299-R654 PolarHBondContact OD2-NH1 3.36Å; D301-R654 WeakPolarHBondContact OD2-CD 3.49Å; P651-R654 WeakPolarHBondContact O-CB 3.32Å; P651-R654 PolarHBondContact O-N 3.11Å; S652-R654 PolarHBondContact O-N 3.48Å; S652-R654 VanDerWaalsContact O-N 3.15Å; R654-V656 VanDerWaalsContact C-N 3.34Å; R654-V656 PolarHBondContact O-N 3.17Å
655	N	59.3	Low	52.4	Low	90 Å²	90	108 Å²	108	48%	0.481	59%	0.587	S	S	.	*			trans	-88.7	62.5	175.8	-66.3	-21.3	0	0	0	111.4	R222 S652	R222-N655 VanDerWaalsContact CZ-OD1 3.23Å; R222-N655 PolarHBondContact NH1-OD1 2.9Å; R222-N655 PolarHBondContact NH2-OD1 3.23Å; S652-N655 WeakPolarHBondContact O-CA 3.33Å; S652-N655 WeakPolarHBondContact O-CB 3.35Å; S652-N655 PolarHBondContact O-N 3.02Å
656	V	55.3	Low	49.9	Very low	83 Å²	83	114.3 Å²	114.3	50%	0.503	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-82.1	123.6	164.5	-175.5	0	0	0	0	108.4	K219 R654 V658	K219-V656 HydrophobicContact CB-CG2 4.28Å; K219-V656 HydrophobicContact CG-CG2 4.17Å; R654-V656 VanDerWaalsContact C-N 3.34Å; R654-V656 PolarHBondContact O-N 3.17Å; V656-V658 PolarHBondContact O-N 3.07Å
657	E	40.1	Very low	47.9	Very low	178 Å²	178	117.2 Å²	117.2	83%	0.832	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-57.3	124.2	172.5	-66.4	-173.7	142.9	0	0	109.8	P659	E657-P659 VanDerWaalsContact O-CD 3.26Å; E657-P659 WeakPolarHBondContact O-CD 3.37Å
658	V	36.4	Very low	45.9	Very low	121 Å²	121	115.6 Å²	115.6	73%	0.733	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-74.2	117.3	173.8	-178.8	0	0	0	0	107.5	V656 E660	V656-V658 PolarHBondContact O-N 3.07Å; V658-E660 PolarHBondContact O-N 2.87Å
659	P	31.6	Very low	44.1	Very low	108 Å²	108	120.9 Å²	120.9	70%	0.701	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-59.2	129.8	-177.3	-25.5	35.8	0	0	0	111.4	E657 W661	E657-P659 VanDerWaalsContact O-CD 3.26Å; E657-P659 WeakPolarHBondContact O-CD 3.37Å; P659-W661 PolarHBondContact O-N 3.17Å
660	E	33.4	Very low	42.1	Very low	163 Å²	163	130.6 Å²	130.6	76%	0.762	66%	0.658	S	S	*	*	S	Bend	trans	-63.5	89.1	-179	-82.4	-151	113.6	0	0	111.7	V658 K663	V658-E660 PolarHBondContact O-N 2.87Å; E660-K663 IonicContact OE1-NZ 2.69Å
661	W	37.8	Very low	40.3	Very low	222 Å²	222	136 Å²	136	84%	0.841	68%	0.677	S	S	*	*			trans	-138.3	63.1	161.6	-140.9	-82.3	0	0	0	112.6	P659	P659-W661 PolarHBondContact O-N 3.17Å
662	T	32.7	Very low	38.4	Very low	119 Å²	119	142.2 Å²	142.2	73%	0.73	70%	0.701	S	S	*	*			trans	-129.9	30.6	170.3	-11.7	0	0	0	0	112.6
663	K	28.5	Very low	36.5	Very low	166 Å²	166	149 Å²	149	72%	0.722	72%	0.722	S	S	*	*			trans	-98.8	88	161	-75.9	171.7	-176.8	149.3	0	108.5	E660 S665	E660-K663 IonicContact OE1-NZ 2.69Å; K663-S665 PolarHBondContact O-N 2.82Å
664	C	25.5	Very low	34.6	Very low	124 Å²	124	154.2 Å²	154.2	84%	0.838	74%	0.742	S	S	*	*			trans	-63.3	117.5	176.1	-67.1	0	0	0	0	110.3	N666	C664-N666 PolarHBondContact O-N 3.26Å
665	S	24.8	Very low	32.6	Very low	110 Å²	110	163.2 Å²	163.2	77%	0.769	78%	0.781	S	S	*	*			trans	-75.5	104.4	175.6	56.8	0	0	0	0	110.9	K663	K663-S665 PolarHBondContact O-N 2.82Å
666	N	27.1	Very low	32.1	Very low	162 Å²	162	164.7 Å²	164.7	87%	0.866	80%	0.796	S	S	*	*			trans	-168.7	98.7	142	-104.6	-17.4	0	0	0	113.5	C664	C664-N666 PolarHBondContact O-N 3.26Å
667	R	27.1	Very low	30.7	Very low	248 Å²	248	169.2 Å²	169.2	94%	0.936	81%	0.809	S	S	*	*			trans	-156.5	126.2	138.9	-168.9	160.3	173.7	161.6	-4.4	109.5
668	E	27.8	Very low	30.3	Very low	135 Å²	135	169.4 Å²	169.4	63%	0.631	80%	0.803	S	S	*	*			trans	-70.6	154.6	179.6	-76.9	-156.4	100	0	0	113.7
669	K	31.4	Very low	29.8	Very low	162 Å²	162	168 Å²	168	70%	0.704	80%	0.799	S	S	*	*			trans	56.2	94.3	147.8	-67	156.8	-176.5	146.2	0	117.5
670	R	26.3	Very low	29.5	Very low	254 Å²	254	168.9 Å²	168.9	96%	0.958	80%	0.798	S	S	*	*				-143.1	144.4	117.8	-115.4	173.8	-179	174.5	-0.1	110.3
671	K	28.9	Very low	29.2	Very low	206 Å²	206	165.3 Å²	165.3	90%	0.896	79%	0.791	S	S	*	*			trans	-84.2	136.3	178.4	-70.5	-179.6	173.9	-177.3	0	109.7
672	E	25.1	Very low	28.7	Very low	191 Å²	191	164 Å²	164	89%	0.893	79%	0.794	S	S	*	*			trans	-75	164.1	157.1	-67.1	-174	125.8	0	0	111
673	K	26.6	Very low	28.3	Very low	208 Å²	208	161.6 Å²	161.6	90%	0.904	79%	0.793	S	S	*	*			trans	-126.2	137.6	157.2	-88.2	-172.2	171.2	-175.1	0	107.4
674	E	28.6	Very low	28.2	Very low	181 Å²	181	162.5 Å²	162.5	85%	0.846	80%	0.8	S	S	*	*			trans	-67.9	149.3	-173	-51.8	154	131.7	0	0	112.6
675	K	29.8	Very low	28.3	Very low	197 Å²	197	161.7 Å²	161.7	86%	0.857	80%	0.795	S	S	*	*				-176.2	147.7	108	-96.7	169.1	-176.2	-172	0	112.9
676	P	49.7	Very low	28.3	Very low	121 Å²	121	159.7 Å²	159.7	79%	0.786	79%	0.792	S	S	*	*			trans	-93.4	174.8	170.6	39.2	-35.8	0	0	0	112.3
677	F	25.1	Very low	29.2	Very low	177 Å²	177	157.5 Å²	157.5	78%	0.776	79%	0.786	S	S	*	*			trans	164.7	127.3	138.2	-176.4	-107.2	0	0	0	114.7
678	Y	31.3	Very low	29.3	Very low	182 Å²	182	151.2 Å²	151.2	71%	0.714	78%	0.776	S	S	*	*			trans	58.7	161	166.9	-96.2	-118.7	0	0	0	117.9
679	S	26.5	Very low	29.3	Very low	92 Å²	92	153.3 Å²	153.3	64%	0.643	79%	0.786	S	S	*	*			cis	-147.1	150.5	2.4	-160.4	0	0	0	0	107
680	D	24.8	Very low	29.2	Very low	127 Å²	127	151 Å²	151	68%	0.679	79%	0.79	S	S	*	*				51.3	130.6	63.5	-113.9	3.6	0	0	0	114
681	S	28.9	Very low	29.3	Very low	88 Å²	88	143.2 Å²	143.2	62%	0.615	78%	0.78	S	S	*	*			cis	-171.9	170.5	-5	-129.8	0	0	0	0	111.3
682	E	26.8	Very low	29.1	Very low	193 Å²	193	140.6 Å²	140.6	90%	0.902	78%	0.776	S	S	*	*			trans	57.6	172.9	174.5	-46.6	-72.3	81.4	0	0	114.6
683	G	24.8	Very low	29.4	Very low	69 Å²	69	136.2 Å²	136.2	71%	0.711	77%	0.766	S	S	*	*			cis	174.3	167.3	-0.9	0	0	0	0	0	106.8
684	E	25.1	Very low	29.4	Very low	186 Å²	186	135 Å²	135	87%	0.869	76%	0.764	S	S	*	*			cis	-159.3	179.6	-2.1	-91.6	-155.6	84.7	0	0	110.1
685	S	27.5	Very low	29.7	Very low	106 Å²	106	131.8 Å²	131.8	74%	0.741	76%	0.759	S	S	*	*			trans	18	138.6	155.5	65.2	0	0	0	0	124.2
686	G	25.3	Very low	29.4	Very low	68 Å²	68	130 Å²	130	70%	0.701	75%	0.753	S	S	*	*			trans	-84.8	-152.9	150.1	0	0	0	0	0	112.7
687	P	46.4	Very low	28.2	Very low	116 Å²	116	128.7 Å²	128.7	75%	0.753	75%	0.747	S	S	*	*			cis	-136.4	-133.6	7.4	43.5	-22.3	0	0	0	113.6
688	T	28.8	Very low	28.2	Very low	116 Å²	116	128.9 Å²	128.9	71%	0.712	75%	0.75	S	S	*	*			trans	78	121	-176.9	68.1	0	0	0	0	115.1
689	E	28.3	Very low	27.8	Very low	180 Å²	180	124.7 Å²	124.7	84%	0.841	75%	0.747	S	S	*	*				83.2	137.6	52.6	-69.6	171.6	-113.1	0	0	112.7
690	S	29.6	Very low	27.7	Very low	112 Å²	112	128.4 Å²	128.4	78%	0.783	76%	0.755	S	S	*	*			cis	-156.9	-170.6	17.6	60.6	0	0	0	0	113.7
691	A	27.1	Very low	27.6	Very low	91 Å²	91	127.1 Å²	127.1	75%	0.752	76%	0.756	S	S	*	*			trans	80.7	145.5	166.9	0	0	0	0	0	117.1
692	D	25.6	Very low	27.5	Very low	151 Å²	151	131.3 Å²	131.3	81%	0.807	77%	0.766	S	S	*	*			cis	164.5	148.6	-16.8	-119.2	-32.1	0	0	0	104.1
693	S	30.1	Very low	27.4	Very low	100 Å²	100	127.1 Å²	127.1	70%	0.699	76%	0.758	S	S	*	*			cis	-149.1	169.1	-11.6	-44	0	0	0	0	108.5
694	E	26.8	Very low	27.4	Very low	183 Å²	183	133.3 Å²	133.3	86%	0.855	77%	0.765	S	S	*	*			trans	-80.5	166.8	168.5	-120	175.2	-128.9	0	0	112.1
695	P	35.2	Very low	27.4	Very low	113 Å²	113	130.3 Å²	130.3	73%	0.734	77%	0.765	S	S	*	*				-158.1	157	93.4	38.6	-17.4	0	0	0	120.1
696	E	23.8	Very low	27.3	Very low	159 Å²	159	130.6 Å²	130.6	74%	0.743	77%	0.766	S	S	*	*			trans	68.4	108.3	139.2	-62.2	-79.5	171.4	0	0	123.3
697	S	25	Very low	27.3	Very low	93 Å²	93	131.2 Å²	131.2	65%	0.65	76%	0.76	S	S	*	*				65.9	159.1	107.6	-53.1	0	0	0	0	126
698	E	24	Very low	26.2	Very low	181 Å²	181	133.2 Å²	133.2	85%	0.846	76%	0.76	S	S	*	*			trans	64.9	120.5	166.8	-53.1	-157.4	159.1	0	0	117.9
699	S	23.1	Very low	26	Very low	94 Å²	94	132.8 Å²	132.8	66%	0.657	76%	0.761	S	S	*	*			cis	89.1	120.4	37.7	76.6	0	0	0	0	115.3
700	E	24.6	Very low	25.8	Very low	170 Å²	170	127.3 Å²	127.3	79%	0.794	75%	0.753	S	S	*	*			trans	171.8	145.4	139.7	-104.2	-63.7	102.7	0	0	115.4
701	S	23.3	Very low	25.5	Very low	101 Å²	101	128.3 Å²	128.3	71%	0.706	76%	0.76	S	S	*	*			trans	66.5	145.6	147.1	78.4	0	0	0	0	124
702	E	26.5	Very low	25.3	Very low	175 Å²	175	127.3 Å²	127.3	82%	0.818	76%	0.758	S	S	*	*			trans	-103.1	153.6	150	-69.2	-166.4	175.1	0	0	110.2
703	S	24.1	Very low	25.2	Very low	105 Å²	105	130 Å²	130	73%	0.734	77%	0.766	S	S	*	*				171	135.4	108.5	50.2	0	0	0	0	116.9
704	K	26.2	Very low	24.9	Very low	199 Å²	199	130.8 Å²	130.8	87%	0.865	77%	0.772	S	S	*	*			trans	34.8	123.7	141.6	-57.6	173.7	-174.2	169	0	121.2
705	S	23.4	Very low	24.8	Very low	124 Å²	124	128 Å²	128	87%	0.867	77%	0.773	S	S	*	*			trans	-147	148	132.5	63.9	0	0	0	0	112.8
706	S	26.7	Very low	24.2	Very low	111 Å²	111	127.2 Å²	127.2	78%	0.776	77%	0.77	S	S	*	*			trans	-93	-179.9	171.3	67.9	0	0	0	0	109.9
707	S	25.2	Very low	24.2	Very low	82 Å²	82	126.1 Å²	126.1	57%	0.573	77%	0.769	S	S	*	*			cis	-160.9	-164.3	-3.4	36.1	0	0	0	0	108.2
708	E	23.7	Very low	24.2	Very low	158 Å²	158	126.4 Å²	126.4	74%	0.738	77%	0.771	S	S	*	*			trans	74.4	156.6	165.3	-47.8	-44.1	126.7	0	0	117.6
709	S	23.4	Very low	24.1	Very low	106 Å²	106	124.6 Å²	124.6	74%	0.741	77%	0.767	S	S	*	*			cis	-168.9	162.8	-39.1	-102.7	0	0	0	0	109.1
710	G	24.2	Very low	24.1	Very low	65 Å²	65	126.4 Å²	126.4	67%	0.67	77%	0.769	S	S	*	*			trans	99.2	123.2	179.8	0	0	0	0	0	112.2
711	S	22.7	Very low	24.1	Very low	134 Å²	134	126.4 Å²	126.4	94%	0.937	77%	0.769	S	S	*	*			cis	71.9	108.4	35.6	-47	0	0	0	0	113.1
712	G	22.7	Very low	24.1	Very low	69 Å²	69	127.5 Å²	127.5	71%	0.711	77%	0.767	S	S	*	*			trans	176	93	177.9	0	0	0	0	0	114.6
713	E	23.9	Very low	24.1	Very low	207 Å²	207	127 Å²	127	97%	0.967	77%	0.765	S	S	*	*			trans	65.1	145.8	139.9	-68.1	168.1	-153.2	0	0	122.3
714	S	23.8	Very low	24.1	Very low	117 Å²	117	129.1 Å²	129.1	82%	0.818	77%	0.768	S	S	*	*			trans	-119.4	147.4	-176.3	54.6	0	0	0	0	110.7
715	S	24.7	Very low	24.2	Very low	125 Å²	125	126.1 Å²	126.1	87%	0.874	76%	0.757	S	S	*	*			trans	-148.8	155.8	149.8	56.2	0	0	0	0	110.5
716	S	24.2	Very low	24.3	Very low	96 Å²	96	127.5 Å²	127.5	67%	0.671	75%	0.75	S	S	*	*			trans	-127.1	173.4	-178	55.3	0	0	0	0	111
717	D	23.7	Very low	24.3	Very low	136 Å²	136	129.6 Å²	129.6	73%	0.727	75%	0.745	S	S	*	*			trans	75.7	120	159.9	-53.5	-60	0	0	0	118.8
718	S	24.3	Very low	24.3	Very low	99 Å²	99	129.4 Å²	129.4	69%	0.692	76%	0.756	S	S	*	*				61.5	147	123	-49.5	0	0	0	0	119.8
719	D	22.1	Very low	24.4	Very low	143 Å²	143	126.1 Å²	126.1	77%	0.765	77%	0.765	S	S	*	*			cis	-148.7	-161.3	40	-123.7	-57.4	0	0	0	115
720	N	22.7	Very low	24.5	Very low	133 Å²	133	124.1 Å²	124.1	71%	0.711	76%	0.761	S	S	*	*			trans	-91.5	-162.3	-162.7	-69.9	-88.9	0	0	0	115.8
721	E	24.1	Very low	24.5	Very low	170 Å²	170	125.8 Å²	125.8	79%	0.794	76%	0.762	S	S	*	*			trans	85.1	131.9	162.5	-60.9	166.9	-169	0	0	115.8
722	D	23	Very low	24.7	Very low	123 Å²	123	126.9 Å²	126.9	66%	0.658	75%	0.752	S	S	*	*			cis	-159.3	163.6	1.5	-110.7	-21.1	0	0	0	115.3
723	E	26.5	Very low	24.8	Very low	166 Å²	166	127.8 Å²	127.8	78%	0.776	75%	0.748	S	S	*	*			trans	49.2	154.2	147.5	-63.5	-177.6	153.5	0	0	121.1
724	D	25.1	Very low	24.8	Very low	149 Å²	149	124.5 Å²	124.5	80%	0.797	73%	0.733	S	S	*	*			cis	-159.9	-179.9	43.5	-152.2	-19	0	0	0	114.3
725	E	27.7	Very low	24.8	Very low	135 Å²	135	126.9 Å²	126.9	63%	0.631	73%	0.731	S	S	*	*			trans	-78.3	164.6	-162.8	-48.3	-169.5	143.2	0	0	119.6	K727	E725-K727 IonicContact OE2-NZ 3.33Å; E725-K727 PolarHBondContact OE2-NZ 3.25Å
726	E	26.7	Very low	24.8	Very low	154 Å²	154	125.2 Å²	125.2	72%	0.72	72%	0.719	S	S	*	*				-167.6	121.9	103.5	-89.6	-121.8	116.5	0	0	114.3
727	K	26.9	Very low	24.8	Very low	154 Å²	154	129.3 Å²	129.3	67%	0.67	73%	0.728	S	S	*	*			trans	29.5	141.8	135.7	-53.3	176.2	-173.9	65.5	0	120.3	E725	E725-K727 IonicContact OE2-NZ 3.33Å; E725-K727 PolarHBondContact OE2-NZ 3.25Å
728	G	24.7	Very low	24.9	Very low	79 Å²	79	131.8 Å²	131.8	81%	0.814	74%	0.735	S	S	*	*			cis	174.8	147.4	1.6	0	0	0	0	0	108.4
729	G	25	Very low	24.8	Very low	89 Å²	89	135 Å²	135	92%	0.918	74%	0.739	S	S	*	*				103	135	81.3	0	0	0	0	0	110.4
730	G	25.7	Very low	24.8	Very low	64 Å²	64	131 Å²	131	66%	0.66	73%	0.732	S	S	*	*			cis	-142.3	176.1	-1.3	0	0	0	0	0	111.5
731	S	25.1	Very low	24.8	Very low	100 Å²	100	127.7 Å²	127.7	70%	0.699	73%	0.729	S	S	*	*				90.9	141.8	86	-72.4	0	0	0	0	112.4
732	E	25.9	Very low	24.8	Very low	156 Å²	156	128.9 Å²	128.9	73%	0.729	73%	0.731	S	S	*	*			cis	-158.4	136.1	3	-114.7	142.6	-132.4	0	0	106.7
733	S	24	Very low	24.7	Very low	89 Å²	89	131.9 Å²	131.9	62%	0.622	74%	0.739	S	S	*	*				94.9	164.2	76.5	90.3	0	0	0	0	112.9
734	E	24.7	Very low	24.6	Very low	137 Å²	137	132.6 Å²	132.6	64%	0.64	74%	0.739	S	S	*	*			cis	-165.7	160	5.8	-135.3	153.1	161.4	0	0	115.9
735	Q	24.6	Very low	24.3	Very low	168 Å²	168	131 Å²	131	79%	0.785	74%	0.735	S	S	*	*			trans	53.1	162.4	143.4	-84.6	156.3	31.9	0	0	123.7
736	S	24.9	Very low	24	Very low	90 Å²	90	134.1 Å²	134.1	63%	0.629	75%	0.746	S	S	*	*			cis	-129.2	-160	13.3	54.4	0	0	0	0	113.6
737	E	24.3	Very low	23.7	Very low	181 Å²	181	135.4 Å²	135.4	85%	0.846	75%	0.749	S	S	*	*			cis	-161.3	-167.9	9.4	-144.5	149.8	-71.4	0	0	113.1
738	E	23.9	Very low	23.4	Very low	188 Å²	188	136.5 Å²	136.5	88%	0.879	75%	0.754	S	S	*	*			trans	-104.1	-173.8	-178.9	-50.1	-169.1	88	0	0	114.2
739	E	23.5	Very low	23.4	Very low	167 Å²	167	138.8 Å²	138.8	78%	0.78	75%	0.752	S	S	*	*			cis	-154.4	163	-2.5	-155.8	-99.5	140	0	0	106.3	G741	E739-G741 PolarHBondContact OE1-N 3.23Å
740	G	22.3	Very low	23.6	Very low	60 Å²	60	140 Å²	140	62%	0.619	74%	0.744	S	S	*	*			cis	150.8	-170.6	-7	0	0	0	0	0	112.3
741	G	22.6	Very low	23.7	Very low	62 Å²	62	146.2 Å²	146.2	64%	0.639	76%	0.756	S	S	*	*			trans	69.5	157.6	-179.4	0	0	0	0	0	116.8	E739	E739-G741 PolarHBondContact OE1-N 3.23Å
742	K	23.3	Very low	23.6	Very low	195 Å²	195	144.3 Å²	144.3	85%	0.848	75%	0.752	S	S	*	*			cis	-162.9	124.4	1.4	-125.5	167.3	-168.3	149.6	0	113.1
743	K	22	Very low	23.5	Very low	187 Å²	187	146 Å²	146	81%	0.813	76%	0.76	S	S	*	*			trans	64.1	133.9	144.1	-82.1	-179.6	177	174.4	0	124.2
744	K	22.6	Very low	23.4	Very low	181 Å²	181	151 Å²	151	79%	0.787	77%	0.765	S	S	*	*			trans	110.6	89.6	130.1	-88.7	-177.7	173.1	-173	0	123.3
745	T	20.7	Very low	23.3	Very low	115 Å²	115	152 Å²	152	71%	0.706	77%	0.77	S	S	*	*				57.5	132.9	117.8	57	0	0	0	0	125.4
746	K	21.4	Very low	23.2	Very low	201 Å²	201	147.3 Å²	147.3	87%	0.874	77%	0.767	S	S	*	*			trans	75.4	157.1	150.5	-70	176.2	179.6	-178.9	0	118.8
747	K	19.9	Very low	23	Very low	180 Å²	180	148.6 Å²	148.6	78%	0.783	78%	0.775	S	S	*	*			cis	-176.4	146.4	-32.9	-163.9	-179.5	-177.9	172.6	0	108.7
748	K	21.1	Very low	22.9	Very low	177 Å²	177	144.9 Å²	144.9	77%	0.77	77%	0.77	S	S	*	*			trans	74.4	143.7	173.8	-66.7	-163.7	171.6	-168.6	0	115.7
749	V	23.6	Very low	22.8	Very low	128 Å²	128	140.4 Å²	140.4	78%	0.776	76%	0.759	S	S	*	*			cis	82.6	136.7	28.6	176.4	0	0	0	0	112.7
750	P	28.9	Very low	22.7	Very low	115 Å²	115	141 Å²	141	75%	0.747	76%	0.762	S	S	*	*			cis	-131.7	-171.7	-2	38.5	-19.2	0	0	0	115.3
751	E	28.5	Very low	22.8	Very low	193 Å²	193	147 Å²	147	90%	0.902	77%	0.774	S	S	*	*			trans	-71.3	169.2	146.1	-67.4	-174.2	114.4	0	0	111.5
752	G	23.8	Very low	23	Very low	61 Å²	61	147 Å²	147	63%	0.629	77%	0.773	S	S	*	*			trans	170.7	105.7	158.1	0	0	0	0	0	118.4
753	H	23.1	Very low	23	Very low	191 Å²	191	142.9 Å²	142.9	88%	0.884	77%	0.769	S	S	*	*			trans	67.1	164.1	145.1	-73.4	-57	0	0	0	117.5
754	R	22.5	Very low	23.1	Very low	193 Å²	193	141 Å²	141	73%	0.728	77%	0.768	S	S	*	*			cis	-153.3	179.8	18.5	-142.8	172.5	-175.4	157.1	8.1	112
755	E	22.5	Very low	23.1	Very low	159 Å²	159	136.7 Å²	136.7	74%	0.743	76%	0.761	S	S	*	*			trans	8.5	146	153.1	-68.1	136.6	-148.9	0	0	120.3
756	G	22.3	Very low	23.3	Very low	70 Å²	70	135.7 Å²	135.7	72%	0.722	76%	0.759	S	S	*	*			cis	145.6	132	-1.9	0	0	0	0	0	113.8
757	S	20.8	Very low	23.4	Very low	116 Å²	116	130.8 Å²	130.8	81%	0.811	75%	0.75	S	S	*	*			trans	70.9	147.3	166.1	-165.8	0	0	0	0	120
758	S	21.5	Very low	23.5	Very low	104 Å²	104	126.6 Å²	126.6	73%	0.727	74%	0.743	S	S	*	*			trans	63.3	148.9	158.6	44.3	0	0	0	0	120.4
759	S	21.1	Very low	23.6	Very low	94 Å²	94	123.3 Å²	123.3	66%	0.657	74%	0.742	S	S	*	*			cis	-177.5	159.6	-29.2	49.4	0	0	0	0	109
760	E	22.3	Very low	23.6	Very low	180 Å²	180	121.6 Å²	121.6	84%	0.841	74%	0.736	S	S	*	*			trans	67.5	156.9	166.6	-45.5	-175.9	147.6	0	0	114.9
761	E	25.4	Very low	23.2	Very low	185 Å²	185	125.1 Å²	125.1	86%	0.864	74%	0.743	S	S	*	*			cis	-117.5	163	-17.1	-69.6	-171.9	137.7	0	0	108.7
762	G	26.3	Very low	23	Very low	61 Å²	61	120.7 Å²	120.7	63%	0.629	73%	0.733	S	S	*	*				119.4	121.2	89.1	0	0	0	0	0	108.8
763	S	23.7	Very low	22.9	Very low	109 Å²	109	126 Å²	126	76%	0.762	74%	0.741	S	S	*	*				49.5	119.6	90.7	66.7	0	0	0	0	113.3
764	D	22.9	Very low	22.8	Very low	148 Å²	148	122.3 Å²	122.3	79%	0.791	73%	0.732	S	S	*	*			cis	-162.7	-175.9	15.9	-136.2	-34.4	0	0	0	115
765	S	23.9	Very low	22.7	Very low	90 Å²	90	119.1 Å²	119.1	63%	0.629	73%	0.734	S	S	*	*			trans	-10	148.9	152.3	68	0	0	0	0	118.5
766	S	24.5	Very low	22.7	Very low	95 Å²	95	115.5 Å²	115.5	66%	0.664	73%	0.726	S	S	*	*			cis	-179.8	-174.3	-6.3	49.3	0	0	0	0	108.5
767	S	23.1	Very low	22.6	Very low	98 Å²	98	120.6 Å²	120.6	69%	0.685	73%	0.731	S	S	*	*			trans	50.4	136.4	138.5	63.7	0	0	0	0	120.9
768	S	22.3	Very low	22.6	Very low	92 Å²	92	119 Å²	119	64%	0.643	72%	0.72	S	S	*	*			cis	174.2	159.4	-3.5	47.3	0	0	0	0	107.5
769	S	23.3	Very low	22.7	Very low	107 Å²	107	122.3 Å²	122.3	75%	0.748	72%	0.724	S	S	*	*			trans	69	158	152.7	-56.9	0	0	0	0	117.2
770	S	22.2	Very low	22.7	Very low	92 Å²	92	126.3 Å²	126.3	64%	0.643	73%	0.733	S	S	*	*			cis	-166.2	160.4	-26.9	-88.1	0	0	0	0	107.2
771	E	22.1	Very low	22.7	Very low	190 Å²	190	125.9 Å²	125.9	89%	0.888	73%	0.73	S	S	*	*			trans	66.8	163.6	167.4	-30.1	-162.6	151.4	0	0	112.5
772	S	23.9	Very low	22.5	Very low	100 Å²	100	126.1 Å²	126.1	70%	0.699	73%	0.732	S	S	*	*			cis	-135.7	133.3	4.1	59.1	0	0	0	0	108.7
773	E	21.5	Very low	22.2	Very low	172 Å²	172	127.8 Å²	127.8	80%	0.804	74%	0.739	S	S	*	*				62.5	134.8	101.6	-63.7	-141.5	126.2	0	0	118.2
774	V	21	Very low	22	Very low	113 Å²	113	130.7 Å²	130.7	69%	0.685	74%	0.741	S	S	*	*			trans	60.7	132.2	149.1	-61.7	0	0	0	0	123.2
775	T	20.8	Very low	22.6	Very low	127 Å²	127	129.1 Å²	129.1	78%	0.779	74%	0.739	S	S	*	*			trans	64.4	152.5	139.1	51	0	0	0	0	120.7
776	S	21.1	Very low	22.6	Very low	82 Å²	82	128.4 Å²	128.4	57%	0.573	74%	0.738	S	S	*	*			cis	-179.7	146	-26.4	49.8	0	0	0	0	107.8
777	E	21	Very low	22.4	Very low	178 Å²	178	129.2 Å²	129.2	83%	0.832	74%	0.744	S	S	*	*			trans	63.2	160.9	159.2	-66.5	160.6	-161	0	0	115.4
778	S	21.6	Very low	22.5	Very low	83 Å²	83	134.6 Å²	134.6	58%	0.58	75%	0.749	S	S	*	*			cis	-161.1	156.7	-25.2	-98.2	0	0	0	0	108.6
779	E	22.3	Very low	22.5	Very low	173 Å²	173	140 Å²	140	81%	0.808	76%	0.756	S	S	*	*			trans	62.9	162.3	153.4	-69.1	149.2	-169.9	0	0	117.1
780	E	21.8	Very low	22.5	Very low	178 Å²	178	143.4 Å²	143.4	83%	0.832	76%	0.757	S	S	*	*			cis	-146	-170	-3.2	-138.4	176.2	-163.7	0	0	111.2
781	E	21.8	Very low	22.5	Very low	170 Å²	170	148 Å²	148	79%	0.794	77%	0.765	S	S	*	*			trans	-75.1	162.8	-170	-47.9	-178.8	130	0	0	116.8
782	Q	20.9	Very low	22.4	Very low	191 Å²	191	145 Å²	145	89%	0.893	76%	0.76	S	S	*	*				-168.7	136	118.2	-110.7	168.5	69.1	0	0	118.3
783	A	20.2	Very low	23.1	Very low	96 Å²	96	145.8 Å²	145.8	79%	0.793	76%	0.763	S	S	*	*			trans	83.7	132.2	139.7	0	0	0	0	0	124
784	E	20.1	Very low	23.6	Very low	170 Å²	170	142.7 Å²	142.7	79%	0.794	76%	0.757	S	S	*	*			trans	-86.3	-168.8	169	-132.2	-147.8	-118.4	0	0	110.3	A786	E784-A786 PolarHBondContact OE2-N 3Å
785	P	36.1	Very low	23.7	Very low	114 Å²	114	142.4 Å²	142.4	74%	0.74	76%	0.761	S	S	*	*			cis	-151.2	174.7	28.1	45.4	-23	0	0	0	123.4
786	A	22.9	Very low	23.7	Very low	75 Å²	75	142.2 Å²	142.2	62%	0.62	77%	0.765	S	S	*	*			trans	95.8	117.1	136.6	0	0	0	0	0	124.4	E784	E784-A786 PolarHBondContact OE2-N 3Å
787	S	21.5	Very low	23.8	Very low	113 Å²	113	148 Å²	148	79%	0.79	78%	0.779	S	S	*	*				159.4	117.4	90.5	58	0	0	0	0	120.8
788	R	23.7	Very low	23.8	Very low	211 Å²	211	145.6 Å²	145.6	80%	0.796	78%	0.782	S	S	*	*			trans	64	112.3	135.5	-64.7	-178.1	171.6	-174.5	0.6	126.7
789	R	23.8	Very low	23.7	Very low	206 Å²	206	146.1 Å²	146.1	78%	0.777	79%	0.791	S	S	*	*				71.8	154.4	122.9	-65.1	176.2	175.3	-174.4	-2.3	120.3
790	K	22.2	Very low	24.6	Very low	178 Å²	178	143.5 Å²	143.5	77%	0.774	79%	0.79	S	S	*	*			cis	-164.8	134.7	3.9	-129.7	-177.1	178.6	-169.7	0	115.8
791	K	22.6	Very low	24.7	Very low	189 Å²	189	142.4 Å²	142.4	82%	0.822	80%	0.795	S	S	*	*			trans	21.8	121.5	147.1	-60.5	-168.9	176.7	-169.4	0	126.5
792	T	19	Very low	24.8	Very low	126 Å²	126	138.2 Å²	138.2	77%	0.773	79%	0.789	S	S	*	*				15.1	171	115.5	60.2	0	0	0	0	122.9
793	P	39.4	Very low	25	Very low	116 Å²	116	137.2 Å²	137.2	75%	0.753	78%	0.782	S	S	*	*			cis	-133.1	-137.7	8.2	39.6	-15.4	0	0	0	112.5
794	P	33	Very low	25.1	Very low	107 Å²	107	139.9 Å²	139.9	70%	0.695	78%	0.778	S	S	*	*			cis	-141	164.4	-19.6	40.6	-20.5	0	0	0	120.2
795	S	21.4	Very low	25.5	Very low	108 Å²	108	139.6 Å²	139.6	76%	0.755	78%	0.78	S	S	*	*			trans	34.8	131.5	145.9	69.8	0	0	0	0	126.6
796	S	21.7	Very low	25	Very low	123 Å²	123	140 Å²	140	86%	0.86	79%	0.786	S	S	*	*				176.7	169.3	90.6	60.9	0	0	0	0	116.5
797	K	23	Very low	25.4	Very low	202 Å²	202	143 Å²	143	88%	0.878	79%	0.791	S	S	*	*			trans	-62.2	148.1	-162.5	-53.6	164	178.3	176.2	0	118.8
798	S	22	Very low	25.9	Very low	128 Å²	128	145.7 Å²	145.7	90%	0.895	80%	0.795	S	S	*	*				169.4	172.9	121	51.2	0	0	0	0	113.6
799	A	19.5	Very low	26.4	Very low	94 Å²	94	142.7 Å²	142.7	78%	0.777	80%	0.795	S	S	*	*			trans	-162	-178.9	179	0	0	0	0	0	109
800	P	39.4	Very low	26.7	Very low	119 Å²	119	139.5 Å²	139.5	77%	0.773	79%	0.793	S	S	*	*			cis	-126.4	169.3	-24.6	39.3	-25.3	0	0	0	113.4
801	V	24.7	Very low	27.2	Very low	155 Å²	155	140.3 Å²	140.3	94%	0.939	80%	0.799	S	S	*	*			trans	-140.6	156.4	160.2	-174.2	0	0	0	0	109.2
802	A	23.5	Very low	27.5	Very low	82 Å²	82	137.6 Å²	137.6	68%	0.678	79%	0.794	S	S	*	*			trans	-131	179.1	-170.7	0	0	0	0	0	113.2
803	K	24.8	Very low	27.9	Very low	170 Å²	170	141.1 Å²	141.1	74%	0.739	80%	0.799	S	S	*	*			trans	76.7	148.5	179.2	-63	164.8	153.4	-94.6	0	114.4
804	E	23.5	Very low	27.5	Very low	152 Å²	152	141.2 Å²	141.2	71%	0.71	80%	0.797	S	S	*	*			cis	-151.2	140.8	-6.8	-126.4	147.7	-160.1	0	0	109.4
805	I	27.9	Very low	27.3	Very low	163 Å²	163	141.9 Å²	141.9	84%	0.836	80%	0.801	S	S	*	*			trans	-115.5	119.4	174.1	-58.9	177.5	0	0	0	108.1
806	S	25.7	Very low	27.6	Very low	123 Å²	123	142.4 Å²	142.4	86%	0.86	80%	0.802	S	S	*	*			trans	-79	126.3	171.5	-69.1	0	0	0	0	109.6
807	L	30.6	Very low	27.8	Very low	138 Å²	138	142.1 Å²	142.1	72%	0.723	80%	0.8	S	S	*	*			trans	-109	80.8	-169	-152.9	176.2	0	0	0	110.3
808	L	33.4	Very low	28	Very low	169 Å²	169	139.1 Å²	139.1	89%	0.885	80%	0.799	S	S	*	*			trans	-141.3	59.2	175.1	-76.7	179.9	0	0	0	111.5
809	D	32.6	Very low	28.2	Very low	148 Å²	148	140.8 Å²	140.8	79%	0.791	79%	0.793	S	S	*	*			trans	-159	116.8	150.6	-118.3	-23.5	0	0	0	110
810	L	30.2	Very low	28.6	Very low	140 Å²	140	142.6 Å²	142.6	73%	0.733	80%	0.796	S	S	*	*			trans	-161.5	57.8	171.2	-89.6	-170.7	0	0	0	109.8	D812	L810-D812 VanDerWaalsContact C-N 3.31Å; L810-D812 PolarHBondContact O-N 2.74Å
811	E	34.1	Very low	28	Very low	195 Å²	195	143.6 Å²	143.6	91%	0.911	80%	0.8	S	S	*	*			trans	-86.3	76.3	152	-74.4	-158.2	157	0	0	109.1
812	D	28.3	Very low	28	Very low	131 Å²	131	141.2 Å²	141.2	70%	0.701	79%	0.79	S	S	*	*			trans	-154.4	112.2	166.3	-135.2	-19.3	0	0	0	111.2	L810	L810-D812 VanDerWaalsContact C-N 3.31Å; L810-D812 PolarHBondContact O-N 2.74Å
813	F	27.9	Very low	28.1	Very low	200 Å²	200	142.6 Å²	142.6	88%	0.877	79%	0.792	S	S	*	*			trans	-148.8	117.1	169.1	-99.9	-75.4	0	0	0	110.2
814	T	31.1	Very low	28.4	Very low	118 Å²	118	140.8 Å²	140.8	72%	0.724	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-72.2	154	174.7	45.4	0	0	0	0	111.7
815	P	28	Very low	28.7	Very low	121 Å²	121	137.3 Å²	137.3	79%	0.786	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-71.6	130.7	-175.1	27.8	-34.6	0	0	0	112
816	P	28.1	Very low	28.8	Very low	119 Å²	119	136.2 Å²	136.2	77%	0.773	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-73.7	153.6	171.4	31.5	-34.7	0	0	0	111.4
817	S	26.3	Very low	28.9	Very low	117 Å²	117	136.5 Å²	136.5	82%	0.818	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-71.2	146.7	173.5	53.6	0	0	0	0	111.8
818	V	26.6	Very low	28.9	Very low	140 Å²	140	134.2 Å²	134.2	85%	0.848	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-86.1	123.9	-177.5	-179	0	0	0	0	110.4
819	Q	26.9	Very low	29.1	Very low	163 Å²	163	132 Å²	132	76%	0.762	77%	0.768	S	S	*	*			trans	-113.6	145.6	157	-72.3	-170.8	-17	0	0	109.1	V821	Q819-V821 PolarHBondContact O-N 3.28Å
820	P	27.9	Very low	29.3	Very low	131 Å²	131	129.5 Å²	129.5	85%	0.851	76%	0.762	S	S	*	*			trans	-71.9	127.8	-177	28.9	-34	0	0	0	111.4
821	V	25	Very low	29.6	Very low	141 Å²	141	128.7 Å²	128.7	86%	0.855	76%	0.758	S	S	*	*			trans	-107.9	128.9	175.3	-178.2	0	0	0	0	109	Q819	Q819-V821 PolarHBondContact O-N 3.28Å
822	S	25	Very low	29.9	Very low	105 Å²	105	122.2 Å²	122.2	73%	0.734	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-78.4	148.6	177.6	44.1	0	0	0	0	112.5
823	P	27.1	Very low	30.4	Very low	111 Å²	111	119.5 Å²	119.5	72%	0.721	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-76	154.4	177.8	31.9	-35.4	0	0	0	112.3
824	P	29.6	Very low	30.5	Very low	132 Å²	132	116.2 Å²	116.2	86%	0.857	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-76	149.3	178.5	31.9	-35.3	0	0	0	112.8
825	M	29.7	Very low	30.9	Very low	79 Å²	79	116.8 Å²	116.8	39%	0.389	72%	0.723	S	S	.	*			trans	-118.9	100.7	-178	-69.7	155.8	43.7	0	0	111.7	L849 L850	M825-L849 HydrophobicContact CE-CB 3.77Å; M825-L849 WeakPolarHBondContact CE-O 3.4Å; M825-L849 HydrophobicContact CG-CB 4.41Å; M825-L849 HydrophobicContact SD-CB 3.64Å; M825-L849 HydrophobicContact SD-CD1 4.1Å; M825-L850 WeakPolarHBondContact CE-O 3.08Å
826	V	30.8	Very low	31.5	Very low	140 Å²	140	117.1 Å²	117.1	85%	0.848	71%	0.714	S	S	*	*			trans	-149.6	116.3	157.6	-169.4	0	0	0	0	110.1
827	V	28	Very low	31.8	Very low	129 Å²	129	114.7 Å²	114.7	78%	0.782	71%	0.711	S	S	*	*			trans	-144.4	144.7	157.6	-79.2	0	0	0	0	108.8
828	S	29.6	Very low	32	Very low	89 Å²	89	116.7 Å²	116.7	62%	0.622	71%	0.712	S	S	*	*			trans	-83.6	140.3	-173.9	-60.5	0	0	0	0	112.5	S830 L831	S828-S830 VanDerWaalsContact C-N 3.26Å; S828-S830 PolarHBondContact O-N 3.2Å; S828-S830 VanDerWaalsContact O-N 3.14Å; S828-L831 PolarHBondContact O-N 3.27Å
829	T	37.6	Very low	32.1	Very low	123 Å²	123	115.4 Å²	115.4	76%	0.755	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-22.4	-171.2	44.4	0	0	0	0	115.6
830	S	37.4	Very low	32.5	Very low	95 Å²	95	116 Å²	116	66%	0.664	71%	0.712	S	S	*	*	H	α-helix	trans	-71.2	-29.1	-178.3	-53.8	0	0	0	0	114.4	S828	S828-S830 VanDerWaalsContact C-N 3.26Å; S828-S830 PolarHBondContact O-N 3.2Å; S828-S830 VanDerWaalsContact O-N 3.14Å
831	L	37.1	Very low	32.5	Very low	124 Å²	124	116.1 Å²	116.1	65%	0.649	71%	0.71	S	S	*	*	H	α-helix	trans	-80.9	-18	-175.7	-79.6	164.9	0	0	0	113.8	S828 L835	S828-L831 PolarHBondContact O-N 3.27Å; L831-L835 WeakPolarHBondContact O-CD1 3.34Å
832	A	40.1	Very low	32.8	Very low	59 Å²	59	115.7 Å²	115.7	49%	0.488	70%	0.703	S	S	.	*	H	α-helix	trans	-71.3	-36.6	179	0	0	0	0	0	112.2	D834 L835	A832-D834 PolarHBondContact O-N 2.83Å; A832-L835 PolarHBondContact O-N 3.4Å
833	A	38.8	Very low	33	Very low	73 Å²	73	115.4 Å²	115.4	60%	0.603	70%	0.701	S	S	*	*	H	α-helix	trans	-66.6	-34.6	-175.3	0	0	0	0	0	113.4
834	D	30.8	Very low	33.1	Very low	132 Å²	132	114.8 Å²	114.8	71%	0.706	70%	0.699	S	S	*	*	H	α-helix	trans	-79.3	-22.5	-178	-72.7	-25.2	0	0	0	113.3	A832	A832-D834 PolarHBondContact O-N 2.83Å
835	L	38.7	Very low	32.9	Very low	130 Å²	130	115.8 Å²	115.8	68%	0.681	70%	0.697	S	S	*	*	H	α-helix	trans	-86	-23.5	-179.9	-91.1	91.3	0	0	0	114.4	L831 A832 G837	L831-L835 WeakPolarHBondContact O-CD1 3.34Å; A832-L835 PolarHBondContact O-N 3.4Å; L835-G837 PolarHBondContact O-N 3.16Å
836	E	40.1	Very low	32.8	Very low	127 Å²	127	118.7 Å²	118.7	59%	0.593	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-71.6	-14.4	-179	-71	-173.4	166.6	0	0	113.5	L838	E836-L838 PolarHBondContact O-N 3.15Å; E836-L838 VanDerWaalsContact O-N 3.16Å
837	G	34.7	Very low	32.9	Very low	68 Å²	68	114.6 Å²	114.6	70%	0.701	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-71.5	-2.2	-176.4	0	0	0	0	0	116.9	L835	L835-G837 PolarHBondContact O-N 3.16Å
838	L	30.8	Very low	32.8	Very low	160 Å²	160	113 Å²	113	84%	0.838	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-132.1	5.3	-165.8	-72	175.9	0	0	0	117	E836	E836-L838 PolarHBondContact O-N 3.15Å; E836-L838 VanDerWaalsContact O-N 3.16Å
839	T	28.2	Very low	32.8	Very low	112 Å²	112	114.8 Å²	114.8	69%	0.687	69%	0.691	S	S	*	*			trans	-119.5	117.5	-177.5	55.5	0	0	0	0	114.1
840	L	34.8	Very low	32.5	Very low	177 Å²	177	114 Å²	114	93%	0.927	68%	0.682	S	S	*	*			trans	-114.9	80.1	179.5	-73.3	173.5	0	0	0	112.9
841	T	27.9	Very low	32.3	Very low	132 Å²	132	113.6 Å²	113.6	81%	0.81	68%	0.679	S	S	*	*			trans	-158.8	137	160.4	38.3	0	0	0	0	111.2	S843	T841-S843 PolarHBondContact O-N 2.65Å
842	D	32.5	Very low	32.2	Very low	132 Å²	132	112.1 Å²	112.1	71%	0.706	68%	0.677	S	S	*	*			trans	-67.3	119.1	173.4	-66.2	-58.6	0	0	0	111.7
843	S	29	Very low	32.3	Very low	99 Å²	99	111.8 Å²	111.8	69%	0.692	67%	0.669	S	S	*	*			trans	-160.9	131.7	163.5	-79.7	0	0	0	0	109.7	T841 L845	T841-S843 PolarHBondContact O-N 2.65Å; S843-L845 PolarHBondContact O-N 3.11Å
844	S	27.9	Very low	32.4	Very low	98 Å²	98	113.4 Å²	113.4	69%	0.685	68%	0.676	S	S	*	*			trans	-69.5	104.4	-175.9	59.4	0	0	0	0	111.6
845	L	27.4	Very low	33.3	Very low	154 Å²	154	109.9 Å²	109.9	81%	0.806	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-68.5	132.7	176.6	-66.7	172.2	0	0	0	111	S843 P847	S843-L845 PolarHBondContact O-N 3.11Å; L845-P847 WeakPolarHBondContact O-CD 3.09Å
846	V	25.7	Very low	34.1	Very low	140 Å²	140	107.2 Å²	107.2	85%	0.848	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-77.8	119.1	167.5	-179.8	0	0	0	0	107.7
847	P	33.2	Very low	35.2	Very low	54 Å²	54	103.9 Å²	103.9	35%	0.351	65%	0.646	S	S	.	*	P	Polyproline II helix	trans	-79.5	141.3	-169.5	32.4	-36.9	0	0	0	112.4	L845 L849 F975	L845-P847 WeakPolarHBondContact O-CD 3.09Å; P847-L849 PolarHBondContact O-N 3.5Å; P847-F975 HydrophobicContact CB-CB 3.89Å; P847-F975 HydrophobicContact CB-CD1 3.69Å; P847-F975 HydrophobicContact CB-CD2 3.55Å; P847-F975 HydrophobicContact CB-CE1 4Å; P847-F975 HydrophobicContact CB-CE2 3.88Å; P847-F975 HydrophobicContact CB-CG 3.45Å; P847-F975 VanDerWaalsContact CB-CG 3.45Å; P847-F975 HydrophobicContact CB-CZ 4.08Å; P847-F975 HydrophobicContact CG-CB 3.91Å; P847-F975 HydrophobicContact CG-CD1 4.4Å; P847-F975 HydrophobicContact CG-CD2 3.36Å; P847-F975 HydrophobicContact CG-CE2 3.88Å; P847-F975 HydrophobicContact CG-CG 3.66Å
848	S	25.5	Very low	37.4	Very low	96 Å²	96	107.9 Å²	107.9	67%	0.671	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-62.4	123.5	161	50	0	0	0	0	109.3	L850	S848-L850 PolarHBondContact O-N 2.85Å
849	L	30.1	Very low	40.1	Very low	126 Å²	126	103.5 Å²	103.5	66%	0.66	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-54.1	134.4	177.9	-74.7	167.1	0	0	0	111	M825 P847	M825-L849 HydrophobicContact CE-CB 3.77Å; M825-L849 WeakPolarHBondContact CE-O 3.4Å; M825-L849 HydrophobicContact CG-CB 4.41Å; M825-L849 HydrophobicContact SD-CB 3.64Å; M825-L849 HydrophobicContact SD-CD1 4.1Å; P847-L849 PolarHBondContact O-N 3.5Å
850	L	32.6	Very low	43	Very low	105 Å²	105	103.8 Å²	103.8	55%	0.55	61%	0.609	S	S	.	*	P	Polyproline II helix	trans	-71.7	146.1	163.8	-69.4	166	0	0	0	108.9	M825 S848 F975	M825-L850 WeakPolarHBondContact CE-O 3.08Å; S848-L850 PolarHBondContact O-N 2.85Å; L850-F975 HydrophobicContact CD1-CZ 4.07Å; L850-F975 HydrophobicContact CG-CZ 4.3Å
851	S	31.8	Very low	45.6	Very low	87 Å²	87	96.4 Å²	96.4	61%	0.608	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-50.3	132.7	168.1	-52	0	0	0	0	109.5	V853	S851-V853 PolarHBondContact O-N 3.09Å
852	P	36.4	Very low	48.5	Very low	93 Å²	93	90.9 Å²	90.9	60%	0.604	54%	0.536	S	S	*	.			trans	-59.5	113	-176.8	23.2	-32.9	0	0	0	109.5	S854	P852-S854 PolarHBondContact O-N 2.78Å
853	V	40.7	Very low	51.2	Low	53 Å²	53	88.2 Å²	88.2	32%	0.321	52%	0.519	S	S	.	.			trans	-57.3	126.2	174.6	177	0	0	0	0	107	S851 S855 T1015 A1016	S851-V853 PolarHBondContact O-N 3.09Å; V853-S855 PolarHBondContact O-N 3.08Å; V853-T1015 HydrophobicContact CG2-CG2 4.05Å; V853-A1016 HydrophobicContact CG1-CB 4.01Å
854	S	42.1	Very low	53.9	Low	106 Å²	106	89.7 Å²	89.7	74%	0.741	51%	0.51	S	S	*	.			trans	-42.8	121	-170.8	52.6	0	0	0	0	111.4	P852	P852-S854 PolarHBondContact O-N 2.78Å
855	S	48.2	Very low	56.5	Low	59 Å²	59	90.4 Å²	90.4	41%	0.413	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-52	147.8	178.6	49.9	0	0	0	0	111.2	V853 G857 F876	V853-S855 PolarHBondContact O-N 3.08Å; S855-G857 PolarHBondContact O-N 2.99Å; S855-F876 VanDerWaalsContact CB-O 3.25Å; S855-F876 WeakPolarHBondContact CB-O 3.39Å
856	I	55.6	Low	59.2	Low	74 Å²	74	86 Å²	86	38%	0.379	50%	0.496	S	S	.	.	S	Bend	trans	-50.4	131.7	170.3	-66.1	170.2	0	0	0	107.7	P966	I856-P966 HydrophobicContact CD1-CG 4.36Å
857	G	64.6	Low	61.8	Low	56 Å²	56	79.5 Å²	79.5	58%	0.577	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-53.2	149.8	-169.9	0	0	0	0	0	112.9	S855 Q859	S855-G857 PolarHBondContact O-N 2.99Å; G857-Q859 PolarHBondContact O-N 2.91Å
858	R	81	Confident	64	Low	152 Å²	152	82.6 Å²	82.6	57%	0.574	47%	0.466	S	S	*	.			trans	-43.4	122.3	-177.7	-71.3	-173.7	-176.3	-179.3	1.3	111.2	D873 Y893	R858-D873 HydrophobicContact CB-CB 4.2Å; R858-Y893 HydrophobicContact CG-CD2 4.48Å; R858-Y893 HydrophobicContact CG-CE2 4.32Å
859	Q	86.1	Confident	66.7	Low	69 Å²	69	78.5 Å²	78.5	32%	0.322	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	136.2	177.2	-62.7	-171.4	22.6	0	0	109.1	G857 L861 D873 Y874	G857-Q859 PolarHBondContact O-N 2.91Å; Q859-L861 PolarHBondContact O-N 2.69Å; Q859-D873 CarbonylContact O-C 3.48Å; Q859-D873 VanDerWaalsContact O-CA 3.26Å; Q859-D873 WeakPolarHBondContact O-CA 3.26Å; Q859-Y874 HydrophobicContact CB-CD1 3.86Å; Q859-Y874 HydrophobicContact CB-CE1 3.44Å; Q859-Y874 VanDerWaalsContact CB-CE1 3.44Å; Q859-Y874 HydrophobicContact CG-CE1 4.48Å; Q859-Y874 PolarHBondContact N-O 3.12Å; Q859-Y874 VanDerWaalsContact O-CD1 3.29Å; Q859-Y874 WeakPolarHBondContact O-CD1 3.31Å; Q859-Y874 PolarHBondContact O-N 2.98Å; Q859-Y874 PolarHBondContact OE1-OH 2.95Å
860	E	89.4	Confident	69.5	Low	117 Å²	117	72.6 Å²	72.6	55%	0.547	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	123.5	176.9	-171.6	175.4	89.6	0	0	109.7	H863	E860-H863 VanDerWaalsContact OE1-CB 3.28Å; E860-H863 WeakPolarHBondContact OE1-CB 3.32Å; E860-H863 IonicContact OE1-CD2 2.71Å; E860-H863 IonicContact OE1-CG 3.49Å; E860-H863 IonicContact OE2-CD2 2.92Å; E860-H863 PolarHBondContact OE2-CD2 2.69Å; E860-H863 VanDerWaalsContact OE2-CD2 3.29Å
861	L	89.2	Confident	72.2	Confident	22 Å²	22	67.9 Å²	67.9	12%	0.115	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-32.6	176.1	-169.7	62	0	0	0	111.7	Q859 V872 Y874 F950 L952 V961 S962 I963	Q859-L861 PolarHBondContact O-N 2.69Å; L861-V872 WeakPolarHBondContact CA-O 3.44Å; L861-V872 HydrophobicContact CB-CB 4.32Å; L861-V872 HydrophobicContact CB-CG1 4.23Å; L861-V872 WeakPolarHBondContact CB-O 3.29Å; L861-V872 HydrophobicContact CD2-CG1 4.12Å; L861-V872 PolarHBondContact N-O 2.9Å; L861-Y874 HydrophobicContact CB-CD1 3.92Å; L861-Y874 HydrophobicContact CD1-CD1 4.18Å; L861-Y874 HydrophobicContact CD1-CE1 4.21Å; L861-Y874 HydrophobicContact CG-CD1 4.49Å; L861-F950 HydrophobicContact CD2-CZ 4.22Å; L861-L952 HydrophobicContact CD2-CD1 4.5Å; L861-V961 HydrophobicContact CD1-CB 3.97Å; L861-V961 HydrophobicContact CD2-CB 4.3Å; L861-V961 HydrophobicContact CD2-CG2 4.36Å; L861-V961 HydrophobicContact CG-CB 3.92Å; L861-V961 HydrophobicContact CG-CG1 4Å; L861-S962 WeakPolarHBondContact CD1-O 3.42Å; L861-I963 HydrophobicContact CD1-CD1 4.34Å; L861-I963 HydrophobicContact CD1-CG1 3.64Å; L861-I963 HydrophobicContact CD2-CD1 4.19Å; L861-I963 HydrophobicContact CD2-CG1 4.38Å
862	L	89.6	Confident	75.1	Confident	17 Å²	17	63.8 Å²	63.8	9%	0.089	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	112	176.6	-176.6	65.8	0	0	0	110.2	A866 L870 A871 V872 F959	L862-A866 HydrophobicContact CD1-CB 3.84Å; L862-L870 HydrophobicContact CD2-CD2 4.34Å; L862-A871 WeakPolarHBondContact O-CA 3.34Å; L862-V872 HydrophobicContact CB-CB 3.95Å; L862-V872 HydrophobicContact CB-CG2 3.97Å; L862-V872 HydrophobicContact CD2-CG2 4.15Å; L862-V872 PolarHBondContact N-O 3.47Å; L862-V872 PolarHBondContact O-N 3.32Å; L862-F959 HydrophobicContact CD2-CB 3.99Å; L862-F959 HydrophobicContact CD2-CD1 4.1Å; L862-F959 HydrophobicContact CD2-CD2 4.13Å; L862-F959 HydrophobicContact CD2-CG 3.81Å
863	H	88.9	Confident	77.8	Confident	76 Å²	76	61.4 Å²	61.4	35%	0.352	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	144.1	176	-173.2	-128.2	0	0	0	112.1	E860 V865 A866 G867	E860-H863 VanDerWaalsContact OE1-CB 3.28Å; E860-H863 WeakPolarHBondContact OE1-CB 3.32Å; E860-H863 IonicContact OE1-CD2 2.71Å; E860-H863 IonicContact OE1-CG 3.49Å; E860-H863 IonicContact OE2-CD2 2.92Å; E860-H863 PolarHBondContact OE2-CD2 2.69Å; E860-H863 VanDerWaalsContact OE2-CD2 3.29Å; H863-V865 PolarHBondContact O-N 3.49Å; H863-A866 PolarHBondContact O-N 2.93Å; H863-G867 PolarHBondContact O-N 3.4Å
864	R	85.4	Confident	80.3	Confident	130 Å²	130	59.5 Å²	59.5	49%	0.491	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.4	-31.3	-179.9	76.4	-173.3	72	-137.3	-2.3	115.2	G869 A871 N897	R864-G869 WeakPolarHBondContact O-CA 3.23Å; R864-G869 PolarHBondContact O-N 2.65Å; R864-A871 HydrophobicContact CB-CB 3.87Å; R864-N897 PolarHBondContact NH1-OD1 3.34Å
865	V	83.6	Confident	82.6	Confident	113 Å²	113	54.8 Å²	54.8	69%	0.685	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	-31.5	-180	178.7	0	0	0	0	111.9	H863	H863-V865 PolarHBondContact O-N 3.49Å
866	A	83.4	Confident	84.6	Confident	62 Å²	62	52.2 Å²	52.2	51%	0.512	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	-31.5	177.3	0	0	0	0	0	112.2	L862 H863 E868	L862-A866 HydrophobicContact CD1-CB 3.84Å; H863-A866 PolarHBondContact O-N 2.93Å; A866-E868 VanDerWaalsContact C-N 3.32Å; A866-E868 PolarHBondContact O-N 3.31Å
867	G	79.9	Confident	85.9	Confident	3 Å²	3	49.5 Å²	49.5	3%	0.031	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	14.1	176.3	0	0	0	0	0	115.7	H863 G869 L870	H863-G867 PolarHBondContact O-N 3.4Å; G867-G869 PolarHBondContact O-N 2.85Å; G867-G869 VanDerWaalsContact O-N 3.1Å; G867-L870 WeakPolarHBondContact CA-O 3.29Å; G867-L870 WeakPolarHBondContact O-CB 3.03Å; G867-L870 PolarHBondContact O-N 3.28Å
868	E	80.6	Confident	86.7	Confident	118 Å²	118	48.7 Å²	48.7	55%	0.551	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.3	33.9	-175.8	-62.4	-174.6	142	0	0	113.7	A866 R957	A866-E868 VanDerWaalsContact C-N 3.32Å; A866-E868 PolarHBondContact O-N 3.31Å; E868-R957 VanDerWaalsContact CD-NH2 3.3Å; E868-R957 IonicContact OE1-CZ 2.71Å; E868-R957 IonicContact OE1-NE 2.94Å; E868-R957 IonicContact OE1-NH2 2.73Å; E868-R957 PolarHBondContact OE1-NH2 3.26Å; E868-R957 IonicContact OE2-CZ 3.15Å; E868-R957 VanDerWaalsContact OE2-CZ 3.29Å; E868-R957 IonicContact OE2-NE 2.92Å; E868-R957 PolarHBondContact OE2-NE 3.29Å; E868-R957 IonicContact OE2-NH2 3.99Å; E868-R957 PolarHBondContact OE2-NH2 3.43Å
869	G	81.1	Confident	86.5	Confident	11 Å²	11	47.1 Å²	47.1	11%	0.113	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.3	-21.2	-176.5	0	0	0	0	0	114.4	R864 G867 A871 N897	R864-G869 WeakPolarHBondContact O-CA 3.23Å; R864-G869 PolarHBondContact O-N 2.65Å; G867-G869 PolarHBondContact O-N 2.85Å; G867-G869 VanDerWaalsContact O-N 3.1Å; G869-A871 PolarHBondContact O-N 3.49Å; G869-N897 WeakPolarHBondContact O-CA 3.29Å; G869-N897 VanDerWaalsContact O-CB 3.3Å; G869-N897 WeakPolarHBondContact O-CB 3.25Å; G869-N897 PolarHBondContact O-N 3.46Å; G869-N897 PolarHBondContact O-ND2 3.45Å
870	L	88.6	Confident	86.1	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	128.4	163.2	-174	60.6	0	0	0	109	L862 G867 V872 F894 I902 L905 L927 F959	L862-L870 HydrophobicContact CD2-CD2 4.34Å; G867-L870 WeakPolarHBondContact CA-O 3.29Å; G867-L870 WeakPolarHBondContact O-CB 3.03Å; G867-L870 PolarHBondContact O-N 3.28Å; L870-V872 HydrophobicContact CD1-CG2 4.31Å; L870-V872 HydrophobicContact CD2-CG2 4.08Å; L870-V872 HydrophobicContact CG-CG2 3.85Å; L870-F894 HydrophobicContact CD1-CB 4.47Å; L870-I902 HydrophobicContact CB-CD1 3.83Å; L870-I902 HydrophobicContact CD1-CD1 3.93Å; L870-I902 HydrophobicContact CG-CD1 4.38Å; L870-L905 HydrophobicContact CD2-CD1 4.42Å; L870-L927 HydrophobicContact CD1-CD2 4.43Å; L870-F959 HydrophobicContact CD2-CD2 4.41Å; L870-F959 HydrophobicContact CD2-CE2 4.18Å
871	A	91.1	Very high	85.8	Confident	7 Å²	7	43 Å²	43	6%	0.058	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.6	165.2	0	0	0	0	0	109.7	L862 R864 G869 S895	L862-A871 WeakPolarHBondContact O-CA 3.34Å; R864-A871 HydrophobicContact CB-CB 3.87Å; G869-A871 PolarHBondContact O-N 3.49Å; A871-S895 PolarHBondContact N-O 3.47Å; A871-S895 PolarHBondContact O-N 3.31Å; A871-S895 PolarHBondContact O-OG 3.35Å
872	V	92.3	Very high	85.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	122.3	-173.7	-168.3	0	0	0	0	109.7	L861 L862 L870 I892 Y893 F894 L952	L861-V872 WeakPolarHBondContact CA-O 3.44Å; L861-V872 HydrophobicContact CB-CB 4.32Å; L861-V872 HydrophobicContact CB-CG1 4.23Å; L861-V872 WeakPolarHBondContact CB-O 3.29Å; L861-V872 HydrophobicContact CD2-CG1 4.12Å; L861-V872 PolarHBondContact N-O 2.9Å; L862-V872 HydrophobicContact CB-CB 3.95Å; L862-V872 HydrophobicContact CB-CG2 3.97Å; L862-V872 HydrophobicContact CD2-CG2 4.15Å; L862-V872 PolarHBondContact N-O 3.47Å; L862-V872 PolarHBondContact O-N 3.32Å; L870-V872 HydrophobicContact CD1-CG2 4.31Å; L870-V872 HydrophobicContact CD2-CG2 4.08Å; L870-V872 HydrophobicContact CG-CG2 3.85Å; V872-I892 HydrophobicContact CG1-CG2 3.39Å; V872-Y893 WeakPolarHBondContact CA-O 3.23Å; V872-F894 HydrophobicContact CB-CD1 4.29Å; V872-F894 HydrophobicContact CG1-CD1 3.67Å; V872-F894 HydrophobicContact CG1-CE1 3.63Å; V872-F894 HydrophobicContact CG2-CD1 3.71Å; V872-F894 HydrophobicContact CG2-CE1 4.12Å; V872-L952 HydrophobicContact CG1-CD1 4.32Å; V872-L952 HydrophobicContact CG2-CD1 4.23Å
873	D	92.9	Very high	84.6	Confident	44 Å²	44	49.9 Å²	49.9	24%	0.235	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	162.2	169.1	-53.9	-32.6	0	0	0	110	R858 Q859 Y893	R858-D873 HydrophobicContact CB-CB 4.2Å; Q859-D873 CarbonylContact O-C 3.48Å; Q859-D873 VanDerWaalsContact O-CA 3.26Å; Q859-D873 WeakPolarHBondContact O-CA 3.26Å; D873-Y893 HydrophobicContact CB-CD2 4.39Å; D873-Y893 PolarHBondContact N-O 2.89Å; D873-Y893 PolarHBondContact O-N 3Å
874	Y	92.6	Very high	84.2	Confident	12 Å²	12	48.1 Å²	48.1	5%	0.047	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	158.5	169.5	77.9	-71.9	0	0	0	113	Q859 L861 F876 I890 H891 I963	Q859-Y874 HydrophobicContact CB-CD1 3.86Å; Q859-Y874 HydrophobicContact CB-CE1 3.44Å; Q859-Y874 VanDerWaalsContact CB-CE1 3.44Å; Q859-Y874 HydrophobicContact CG-CE1 4.48Å; Q859-Y874 PolarHBondContact N-O 3.12Å; Q859-Y874 VanDerWaalsContact O-CD1 3.29Å; Q859-Y874 WeakPolarHBondContact O-CD1 3.31Å; Q859-Y874 PolarHBondContact O-N 2.98Å; Q859-Y874 PolarHBondContact OE1-OH 2.95Å; L861-Y874 HydrophobicContact CB-CD1 3.92Å; L861-Y874 HydrophobicContact CD1-CD1 4.18Å; L861-Y874 HydrophobicContact CD1-CE1 4.21Å; L861-Y874 HydrophobicContact CG-CD1 4.49Å; Y874-F876 HydrophobicContact CD2-CE2 4.4Å; Y874-F876 HydrophobicContact CE2-CD2 4.43Å; Y874-F876 AromaticContact CE2-CE2 3.64Å; Y874-F876 HydrophobicContact CE2-CE2 3.64Å; Y874-F876 AromaticContact CE2-CZ 3.77Å; Y874-F876 HydrophobicContact CE2-CZ 3.77Å; Y874-I890 HydrophobicContact CD2-CG2 3.85Å; Y874-I890 HydrophobicContact CG-CG2 4.49Å; Y874-H891 CarbonylContact C-O 3.59Å; Y874-H891 VanDerWaalsContact CA-O 3.24Å; Y874-H891 WeakPolarHBondContact CA-O 3.47Å; Y874-I963 HydrophobicContact CD2-CD1 3.98Å; Y874-I963 HydrophobicContact CD2-CG1 4.19Å; Y874-I963 HydrophobicContact CD2-CG2 4.18Å; Y874-I963 HydrophobicContact CE1-CG1 4.48Å; Y874-I963 HydrophobicContact CE2-CB 4.32Å; Y874-I963 HydrophobicContact CE2-CD1 4.28Å; Y874-I963 HydrophobicContact CE2-CG1 4.02Å; Y874-I963 HydrophobicContact CE2-CG2 3.53Å; Y874-I963 HydrophobicContact CG-CD1 4.26Å; Y874-I963 HydrophobicContact CG-CG1 4.49Å
875	A	90.8	Very high	84	Confident	7 Å²	7	45.8 Å²	45.8	6%	0.058	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	139	172.9	0	0	0	0	0	111.2	H891 Y893	A875-H891 PolarHBondContact N-O 3.49Å; A875-H891 PolarHBondContact O-N 3.27Å; A875-Y893 HydrophobicContact CB-CE2 4.11Å
876	F	89.3	Confident	84.1	Confident	5 Å²	5	44.7 Å²	44.7	2%	0.022	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	136.4	171.7	-61	-85	0	0	0	110.2	S855 Y874 V888 I890 I963 P965 P966 E969	S855-F876 VanDerWaalsContact CB-O 3.25Å; S855-F876 WeakPolarHBondContact CB-O 3.39Å; Y874-F876 HydrophobicContact CD2-CE2 4.4Å; Y874-F876 HydrophobicContact CE2-CD2 4.43Å; Y874-F876 AromaticContact CE2-CE2 3.64Å; Y874-F876 HydrophobicContact CE2-CE2 3.64Å; Y874-F876 AromaticContact CE2-CZ 3.77Å; Y874-F876 HydrophobicContact CE2-CZ 3.77Å; F876-V888 HydrophobicContact CD1-CG1 3.79Å; F876-V888 HydrophobicContact CE1-CG1 4.34Å; F876-I890 HydrophobicContact CD1-CD1 4Å; F876-I890 HydrophobicContact CD1-CG1 3.86Å; F876-I890 HydrophobicContact CE1-CD1 3.62Å; F876-I890 HydrophobicContact CE1-CG1 4.03Å; F876-I890 HydrophobicContact CZ-CD1 4.46Å; F876-I963 HydrophobicContact CE1-CG2 4.37Å; F876-I963 HydrophobicContact CZ-CG2 3.97Å; F876-P965 HydrophobicContact CE1-CB 4.44Å; F876-P965 HydrophobicContact CZ-CB 4.46Å; F876-P966 HydrophobicContact CE2-CG 4.33Å; F876-E969 HydrophobicContact CB-CB 4.26Å; F876-E969 HydrophobicContact CB-CG 3.89Å; F876-E969 VanDerWaalsContact CB-OE2 3.29Å; F876-E969 WeakPolarHBondContact CB-OE2 3.42Å; F876-E969 HydrophobicContact CD1-CB 3.93Å; F876-E969 HydrophobicContact CD1-CG 4.16Å; F876-E969 HydrophobicContact CD2-CB 4.45Å; F876-E969 HydrophobicContact CD2-CG 3.8Å; F876-E969 HydrophobicContact CE1-CB 4.39Å; F876-E969 HydrophobicContact CE2-CG 4.38Å; F876-E969 HydrophobicContact CG-CB 3.96Å; F876-E969 HydrophobicContact CG-CG 3.68Å
877	S	83.3	Confident	84.3	Confident	17 Å²	17	42.7 Å²	42.7	12%	0.119	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-17.4	-175.7	65	0	0	0	0	114.6	Q879 S889	S877-Q879 PolarHBondContact O-N 2.83Å; S877-Q879 PolarHBondContact OG-N 3.05Å; S877-Q879 VanDerWaalsContact OG-N 3.14Å; S877-Q879 PolarHBondContact OG-O 3.15Å; S877-S889 WeakPolarHBondContact CB-O 3.45Å; S877-S889 PolarHBondContact N-O 2.94Å; S877-S889 VanDerWaalsContact OG-CB 3.23Å; S877-S889 WeakPolarHBondContact OG-CB 3.47Å; S877-S889 PolarHBondContact OG-O 3.08Å; S877-S889 PolarHBondContact OG-OG 2.89Å
878	R	81.4	Confident	84.7	Confident	39 Å²	39	42.9 Å²	42.9	15%	0.147	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	54.6	23.4	-166.2	-65.8	179.8	177.2	-161.8	4	114.6	E969 T1015 A1016	R878-E969 WeakPolarHBondContact CG-OE2 3.26Å; R878-E969 IonicContact CZ-OE1 3.38Å; R878-E969 VanDerWaalsContact CZ-OE1 3.25Å; R878-E969 IonicContact NE-OE1 3.22Å; R878-E969 PolarHBondContact NE-OE1 2.94Å; R878-E969 IonicContact NE-OE2 2.74Å; R878-E969 PolarHBondContact NE-OE2 3.07Å; R878-E969 VanDerWaalsContact NE-OE2 3.08Å; R878-E969 IonicContact NH2-OE1 3.57Å; R878-E969 PolarHBondContact NH2-OE1 3.47Å; R878-T1015 PolarHBondContact NH1-O 3.09Å; R878-A1016 VanDerWaalsContact CZ-O 3.24Å; R878-A1016 PolarHBondContact NH1-O 3.49Å; R878-A1016 PolarHBondContact NH2-O 3.31Å
879	Q	77.1	Confident	85.1	Confident	119 Å²	119	37.6 Å²	37.6	56%	0.556	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	147.8	172.5	-64.3	-178	-0.4	0	0	109.9	S877 S889	S877-Q879 PolarHBondContact O-N 2.83Å; S877-Q879 PolarHBondContact OG-N 3.05Å; S877-Q879 VanDerWaalsContact OG-N 3.14Å; S877-Q879 PolarHBondContact OG-O 3.15Å; Q879-S889 WeakPolarHBondContact O-CB 3.33Å; Q879-S889 PolarHBondContact O-N 3.18Å
880	P	77.4	Confident	85.6	Confident	72 Å²	72	37.1 Å²	37.1	47%	0.468	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	145.9	168.8	26.8	-33.4	0	0	0	110.2	P885	P880-P885 HydrophobicContact CB-CB 4.31Å
881	F	83.7	Confident	85.7	Confident	28 Å²	28	39.7 Å²	39.7	12%	0.123	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	135.4	177.6	-174.3	-98.7	0	0	0	111.7	G883 D884 M887 Q919 V936	F881-G883 VanDerWaalsContact CD1-N 3.27Å; F881-G883 PolarHBondContact O-N 2.66Å; F881-D884 CarbonylContact O-C 3.47Å; F881-D884 VanDerWaalsContact O-C 3.27Å; F881-D884 PolarHBondContact O-N 2.8Å; F881-D884 VanDerWaalsContact O-N 3.11Å; F881-D884 VanDerWaalsContact O-O 3.1Å; F881-M887 HydrophobicContact CB-CB 3.95Å; F881-M887 PolarHBondContact N-O 2.9Å; F881-M887 VanDerWaalsContact N-O 3.07Å; F881-Q919 HydrophobicContact CE1-CB 4.35Å; F881-Q919 VanDerWaalsContact CE1-CD 3.48Å; F881-Q919 HydrophobicContact CE1-CG 4.06Å; F881-Q919 VanDerWaalsContact CE1-OE1 3.25Å; F881-Q919 HydrophobicContact CZ-CG 4.32Å; F881-V936 HydrophobicContact CD2-CG1 4.25Å; F881-V936 HydrophobicContact CE2-CG1 4.03Å
882	S	78.8	Confident	85.8	Confident	130 Å²	130	39.3 Å²	39.3	91%	0.909	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-15.9	-171.2	-48.1	0	0	0	0	115
883	G	75.6	Confident	85.8	Confident	54 Å²	54	41.8 Å²	41.8	56%	0.557	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-26.8	174.4	0	0	0	0	0	115.1	F881	F881-G883 VanDerWaalsContact CD1-N 3.27Å; F881-G883 PolarHBondContact O-N 2.66Å
884	D	79.8	Confident	85.7	Confident	38 Å²	38	39.7 Å²	39.7	20%	0.203	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	116.6	179.5	175.1	11.7	0	0	0	109.6	F881 H886 M887	F881-D884 CarbonylContact O-C 3.47Å; F881-D884 VanDerWaalsContact O-C 3.27Å; F881-D884 PolarHBondContact O-N 2.8Å; F881-D884 VanDerWaalsContact O-N 3.11Å; F881-D884 VanDerWaalsContact O-O 3.1Å; D884-H886 PolarHBondContact O-N 3.14Å; D884-H886 VanDerWaalsContact O-N 3.11Å; D884-H886 IonicContact OD1-CE1 3.95Å; D884-H886 IonicContact OD1-CG 2.74Å; D884-H886 PolarHBondContact OD1-N 2.68Å; D884-H886 IonicContact OD1-ND1 2.87Å; D884-H886 PolarHBondContact OD1-ND1 2.83Å; D884-M887 HydrophobicContact CB-CE 4.12Å; D884-M887 HydrophobicContact CB-CG 4Å; D884-M887 PolarHBondContact O-N 2.63Å; D884-M887 VanDerWaalsContact O-N 3.14Å; D884-M887 WeakPolarHBondContact OD2-CE 3.31Å
885	P	81.4	Confident	85.6	Confident	82 Å²	82	40.4 Å²	40.4	53%	0.532	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	-12.6	-177.5	28	-36	0	0	0	114.6	P880 M887	P880-P885 HydrophobicContact CB-CB 4.31Å; P885-M887 VanDerWaalsContact C-N 3.31Å
886	H	84.5	Confident	85.6	Confident	90 Å²	90	40.1 Å²	40.1	42%	0.417	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-3.6	177.3	-50.6	91.9	0	0	0	113.5	D884 T1039	D884-H886 PolarHBondContact O-N 3.14Å; D884-H886 VanDerWaalsContact O-N 3.11Å; D884-H886 IonicContact OD1-CE1 3.95Å; D884-H886 IonicContact OD1-CG 2.74Å; D884-H886 PolarHBondContact OD1-N 2.68Å; D884-H886 IonicContact OD1-ND1 2.87Å; D884-H886 PolarHBondContact OD1-ND1 2.83Å; H886-T1039 HydrophobicContact CB-CG2 4.42Å; H886-T1039 PolarHBondContact O-OG1 2.96Å
887	M	87.8	Confident	85.6	Confident	20 Å²	20	43.7 Å²	43.7	10%	0.099	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	144.2	178	-55.5	-156.1	-165.9	0	0	112.8	F881 D884 P885 Q919 N940	F881-M887 HydrophobicContact CB-CB 3.95Å; F881-M887 PolarHBondContact N-O 2.9Å; F881-M887 VanDerWaalsContact N-O 3.07Å; D884-M887 HydrophobicContact CB-CE 4.12Å; D884-M887 HydrophobicContact CB-CG 4Å; D884-M887 PolarHBondContact O-N 2.63Å; D884-M887 VanDerWaalsContact O-N 3.14Å; D884-M887 WeakPolarHBondContact OD2-CE 3.31Å; P885-M887 VanDerWaalsContact C-N 3.31Å; M887-Q919 HydrophobicContact SD-CB 4.17Å; M887-N940 HydrophobicContact CE-CB 4.45Å; M887-N940 HydrophobicContact CG-CB 3.91Å; M887-N940 HydrophobicContact SD-CB 4.21Å
888	V	88.3	Confident	85.6	Confident	6 Å²	6	44 Å²	44	4%	0.036	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	126.2	172.4	-175.1	0	0	0	0	109	F876 I890 I939 F941 L970 L1038	F876-V888 HydrophobicContact CD1-CG1 3.79Å; F876-V888 HydrophobicContact CE1-CG1 4.34Å; V888-I890 HydrophobicContact CG1-CG1 4.29Å; V888-I939 PolarHBondContact N-O 2.95Å; V888-I939 PolarHBondContact O-N 3.1Å; V888-F941 HydrophobicContact CB-CD2 4.32Å; V888-F941 HydrophobicContact CB-CE2 4.19Å; V888-F941 HydrophobicContact CG2-CD2 3.88Å; V888-F941 HydrophobicContact CG2-CE2 4.2Å; V888-L970 HydrophobicContact CG2-CD2 4.15Å; V888-L1038 HydrophobicContact CG2-CD1 3.91Å
889	S	90.1	Very high	85.7	Confident	8 Å²	8	51.4 Å²	51.4	6%	0.056	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	123.8	174.7	173.4	0	0	0	0	111.5	S877 Q879 V936	S877-S889 WeakPolarHBondContact CB-O 3.45Å; S877-S889 PolarHBondContact N-O 2.94Å; S877-S889 VanDerWaalsContact OG-CB 3.23Å; S877-S889 WeakPolarHBondContact OG-CB 3.47Å; S877-S889 PolarHBondContact OG-O 3.08Å; S877-S889 PolarHBondContact OG-OG 2.89Å; Q879-S889 WeakPolarHBondContact O-CB 3.33Å; Q879-S889 PolarHBondContact O-N 3.18Å; S889-V936 VanDerWaalsContact OG-CG1 3.29Å; S889-V936 WeakPolarHBondContact OG-CG1 3.35Å
890	I	91.1	Very high	86	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.4	-177.4	-55.5	-176.8	0	0	0	109.5	Y874 F876 V888 I892 V936 M937 I939 F941 I963	Y874-I890 HydrophobicContact CD2-CG2 3.85Å; Y874-I890 HydrophobicContact CG-CG2 4.49Å; F876-I890 HydrophobicContact CD1-CD1 4Å; F876-I890 HydrophobicContact CD1-CG1 3.86Å; F876-I890 HydrophobicContact CE1-CD1 3.62Å; F876-I890 HydrophobicContact CE1-CG1 4.03Å; F876-I890 HydrophobicContact CZ-CD1 4.46Å; V888-I890 HydrophobicContact CG1-CG1 4.29Å; I890-I892 HydrophobicContact CG2-CG1 4.31Å; I890-V936 WeakPolarHBondContact O-CA 3.35Å; I890-M937 PolarHBondContact N-O 3.43Å; I890-M937 PolarHBondContact O-N 3.41Å; I890-I939 HydrophobicContact CD1-CB 4.47Å; I890-I939 HydrophobicContact CD1-CD1 3.66Å; I890-I939 HydrophobicContact CD1-CG1 3.95Å; I890-F941 HydrophobicContact CD1-CE2 4.43Å; I890-F941 HydrophobicContact CD1-CZ 4.42Å; I890-I963 HydrophobicContact CD1-CD1 4.37Å; I890-I963 HydrophobicContact CD1-CG2 3.97Å; I890-I963 HydrophobicContact CG2-CD1 4.49Å
891	H	91.5	Very high	86.4	Confident	55 Å²	55	49.9 Å²	49.9	26%	0.255	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	128.5	168.4	-66.1	-82.5	0	0	0	109.5	Y874 A875 Y893 T934 A935	Y874-H891 CarbonylContact C-O 3.59Å; Y874-H891 VanDerWaalsContact CA-O 3.24Å; Y874-H891 WeakPolarHBondContact CA-O 3.47Å; A875-H891 PolarHBondContact N-O 3.49Å; A875-H891 PolarHBondContact O-N 3.27Å; H891-Y893 HydrophobicContact CB-CE2 3.9Å; H891-T934 HydrophobicContact CB-CG2 4.2Å; H891-A935 WeakPolarHBondContact CA-O 3.42Å
892	I	92.3	Very high	86.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125.2	174.7	-52.2	178.4	0	0	0	107.9	V872 I890 F894 F921 T934 A935 M937	V872-I892 HydrophobicContact CG1-CG2 3.39Å; I890-I892 HydrophobicContact CG2-CG1 4.31Å; I892-F894 HydrophobicContact CB-CE2 4.18Å; I892-F894 HydrophobicContact CB-CZ 4.03Å; I892-F894 HydrophobicContact CG2-CD1 4.29Å; I892-F894 HydrophobicContact CG2-CE1 3.61Å; I892-F894 HydrophobicContact CG2-CE2 3.89Å; I892-F894 HydrophobicContact CG2-CZ 3.38Å; I892-F921 HydrophobicContact CD1-CD1 4.35Å; I892-F921 HydrophobicContact CD1-CE1 4.24Å; I892-T934 CarbonylContact O-C 3.57Å; I892-T934 WeakPolarHBondContact O-CA 3.47Å; I892-A935 PolarHBondContact N-O 2.83Å; I892-A935 PolarHBondContact O-N 2.81Å; I892-M937 HydrophobicContact CD1-CB 3.91Å; I892-M937 HydrophobicContact CD1-CE 4Å; I892-M937 HydrophobicContact CD1-SD 3.83Å
893	Y	91.8	Very high	87	Confident	51 Å²	51	48.5 Å²	48.5	20%	0.2	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	113.6	-178.5	-57.1	-91	0	0	0	109	R858 V872 D873 A875 H891 T934	R858-Y893 HydrophobicContact CG-CD2 4.48Å; R858-Y893 HydrophobicContact CG-CE2 4.32Å; V872-Y893 WeakPolarHBondContact CA-O 3.23Å; D873-Y893 HydrophobicContact CB-CD2 4.39Å; D873-Y893 PolarHBondContact N-O 2.89Å; D873-Y893 PolarHBondContact O-N 3Å; A875-Y893 HydrophobicContact CB-CE2 4.11Å; H891-Y893 HydrophobicContact CB-CE2 3.9Å; Y893-T934 HydrophobicContact CD1-CG2 3.73Å; Y893-T934 VanDerWaalsContact CD1-OG1 3.24Å; Y893-T934 WeakPolarHBondContact CD1-OG1 3.35Å; Y893-T934 HydrophobicContact CE1-CG2 3.62Å; Y893-T934 HydrophobicContact CG-CG2 4.37Å
894	F	92.1	Very high	87.3	Confident	1 Å²	1	45.9 Å²	45.9	0%	0.004	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	132.9	176.1	-55.4	-75	0	0	0	109.6	L870 V872 I892 L905 F921 I924 L927 S932 T933 A935 L952	L870-F894 HydrophobicContact CD1-CB 4.47Å; V872-F894 HydrophobicContact CB-CD1 4.29Å; V872-F894 HydrophobicContact CG1-CD1 3.67Å; V872-F894 HydrophobicContact CG1-CE1 3.63Å; V872-F894 HydrophobicContact CG2-CD1 3.71Å; V872-F894 HydrophobicContact CG2-CE1 4.12Å; I892-F894 HydrophobicContact CB-CE2 4.18Å; I892-F894 HydrophobicContact CB-CZ 4.03Å; I892-F894 HydrophobicContact CG2-CD1 4.29Å; I892-F894 HydrophobicContact CG2-CE1 3.61Å; I892-F894 HydrophobicContact CG2-CE2 3.89Å; I892-F894 HydrophobicContact CG2-CZ 3.38Å; F894-L905 HydrophobicContact CB-CD2 4.24Å; F894-L905 HydrophobicContact CD1-CD2 3.57Å; F894-L905 HydrophobicContact CD2-CD2 4.17Å; F894-L905 HydrophobicContact CE1-CD2 3.88Å; F894-L905 HydrophobicContact CE1-CG 4.47Å; F894-L905 HydrophobicContact CE2-CD2 4.42Å; F894-L905 HydrophobicContact CG-CD2 3.73Å; F894-L905 HydrophobicContact CZ-CD2 4.3Å; F894-F921 HydrophobicContact CE1-CZ 4.39Å; F894-F921 HydrophobicContact CE2-CE1 4.44Å; F894-F921 HydrophobicContact CE2-CE2 4.03Å; F894-F921 AromaticContact CE2-CZ 3.97Å; F894-F921 HydrophobicContact CE2-CZ 3.97Å; F894-F921 AromaticContact CZ-CE1 3.84Å; F894-F921 HydrophobicContact CZ-CE1 3.84Å; F894-F921 AromaticContact CZ-CE2 3.97Å; F894-F921 HydrophobicContact CZ-CE2 3.97Å; F894-F921 AromaticContact CZ-CZ 3.44Å; F894-F921 HydrophobicContact CZ-CZ 3.44Å; F894-F921 VanDerWaalsContact CZ-CZ 3.44Å; F894-I924 HydrophobicContact CD2-CD1 3.63Å; F894-I924 HydrophobicContact CE2-CD1 3.81Å; F894-L927 HydrophobicContact CB-CD2 3.97Å; F894-S932 CarbonylContact O-C 3.44Å; F894-S932 WeakPolarHBondContact O-CA 3.07Å; F894-S932 WeakPolarHBondContact O-CB 3.45Å; F894-T933 PolarHBondContact N-O 2.93Å; F894-T933 PolarHBondContact O-N 2.9Å; F894-A935 HydrophobicContact CE2-CB 3.83Å; F894-L952 HydrophobicContact CE1-CD1 4.2Å; F894-L952 HydrophobicContact CE1-CD2 4.22Å; F894-L952 HydrophobicContact CZ-CD2 4.42Å
895	S	90.1	Very high	87.8	Confident	26 Å²	26	44.1 Å²	44.1	18%	0.182	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	130	173.5	64.1	0	0	0	0	110.9	A871 N897 S932	A871-S895 PolarHBondContact N-O 3.47Å; A871-S895 PolarHBondContact O-N 3.31Å; A871-S895 PolarHBondContact O-OG 3.35Å; S895-N897 PolarHBondContact O-ND2 2.99Å; S895-N897 PolarHBondContact OG-ND2 2.95Å; S895-S932 WeakPolarHBondContact CB-OG 3.38Å
896	N	91	Very high	88.1	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.011	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	106.3	178	-177.7	5	0	0	0	110.1	S898 T900 I902 L927 P928 G930 E931	N896-S898 WeakPolarHBondContact OD1-CB 2.94Å; N896-S898 PolarHBondContact OD1-N 3.46Å; N896-S898 PolarHBondContact OD1-OG 2.92Å; N896-T900 PolarHBondContact ND2-O 3.38Å; N896-I902 HydrophobicContact CB-CD1 4.12Å; N896-L927 HydrophobicContact CB-CD2 3.87Å; N896-L927 HydrophobicContact CB-CG 3.84Å; N896-L927 PolarHBondContact ND2-O 3.05Å; N896-P928 WeakPolarHBondContact CB-O 3.42Å; N896-P928 PolarHBondContact ND2-O 3.36Å; N896-G930 WeakPolarHBondContact O-CA 3.32Å; N896-G930 PolarHBondContact O-N 3.42Å; N896-E931 PolarHBondContact N-O 2.9Å; N896-E931 VanDerWaalsContact N-O 3.09Å
897	N	88.1	Confident	88.2	Confident	79 Å²	79	39.3 Å²	39.3	42%	0.422	20%	0.203	S	C	.	.			trans	-101.1	13	177.1	-55.1	-103.5	0	0	0	111.6	R864 G869 S895	R864-N897 PolarHBondContact NH1-OD1 3.34Å; G869-N897 WeakPolarHBondContact O-CA 3.29Å; G869-N897 VanDerWaalsContact O-CB 3.3Å; G869-N897 WeakPolarHBondContact O-CB 3.25Å; G869-N897 PolarHBondContact O-N 3.46Å; G869-N897 PolarHBondContact O-ND2 3.45Å; S895-N897 PolarHBondContact O-ND2 2.99Å; S895-N897 PolarHBondContact OG-ND2 2.95Å
898	S	83.3	Confident	87.8	Confident	25 Å²	25	38.7 Å²	38.7	18%	0.175	20%	0.202	C	C	.	.	S	Bend	trans	-95.1	164.2	175.9	82.8	0	0	0	0	111.9	N896 T900 P929	N896-S898 WeakPolarHBondContact OD1-CB 2.94Å; N896-S898 PolarHBondContact OD1-N 3.46Å; N896-S898 PolarHBondContact OD1-OG 2.92Å; S898-T900 PolarHBondContact O-N 2.91Å; S898-T900 PolarHBondContact OG-N 3.48Å; S898-T900 PolarHBondContact OG-O 3.33Å; S898-P929 WeakPolarHBondContact O-CB 3.32Å
899	E	83	Confident	86.9	Confident	193 Å²	193	44 Å²	44	90%	0.902	23%	0.234	S	C	*	.	S	Bend	trans	-77.5	-1.5	176.7	-60.2	-177.3	170.9	0	0	113.7
900	T	84.6	Confident	85.9	Confident	90 Å²	90	45.6 Å²	45.6	55%	0.552	25%	0.245	S	C	*	.	S	Bend	trans	-126.3	150.3	-174.4	61.4	0	0	0	0	112.5	N896 S898 I902	N896-T900 PolarHBondContact ND2-O 3.38Å; S898-T900 PolarHBondContact O-N 2.91Å; S898-T900 PolarHBondContact OG-N 3.48Å; S898-T900 PolarHBondContact OG-O 3.33Å; T900-I902 PolarHBondContact O-N 3.18Å
901	P	85.9	Confident	84.6	Confident	70 Å²	70	53 Å²	53	46%	0.455	28%	0.277	S	S	.	.			trans	-71.9	120.4	176.7	28.9	-33.5	0	0	0	110.6
902	I	86.3	Confident	83.8	Confident	26 Å²	26	52.5 Å²	52.5	13%	0.133	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	137.5	173.7	-62.7	170.9	0	0	0	107.8	L870 N896 T900 S926 L927 T954	L870-I902 HydrophobicContact CB-CD1 3.83Å; L870-I902 HydrophobicContact CD1-CD1 3.93Å; L870-I902 HydrophobicContact CG-CD1 4.38Å; N896-I902 HydrophobicContact CB-CD1 4.12Å; T900-I902 PolarHBondContact O-N 3.18Å; I902-S926 CarbonylContact O-C 3.51Å; I902-S926 VanDerWaalsContact O-CA 3.29Å; I902-S926 WeakPolarHBondContact O-CA 3.43Å; I902-L927 PolarHBondContact N-O 3.35Å; I902-L927 VanDerWaalsContact N-O 3.14Å; I902-L927 PolarHBondContact O-N 3.04Å; I902-T954 HydrophobicContact CG2-CG2 3.72Å
903	K	88.2	Confident	82.8	Confident	102 Å²	102	54.3 Å²	54.3	44%	0.443	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	151	-174.7	-67.8	-168.9	175.5	-170.9	0	113.7	E925 Q955	K903-E925 WeakPolarHBondContact CA-O 3.18Å; K903-E925 WeakPolarHBondContact CB-O 3.29Å; K903-Q955 HydrophobicContact CB-CG 4.31Å; K903-Q955 WeakPolarHBondContact O-CG 3.31Å; K903-Q955 PolarHBondContact O-N 2.85Å
904	G	83.1	Confident	81.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	55.5	54.5	175.8	0	0	0	0	0	113.7	H906 E923 I924 E925 T954	G904-H906 PolarHBondContact O-ND1 3.08Å; G904-E923 WeakPolarHBondContact CA-OE1 3.29Å; G904-I924 WeakPolarHBondContact CA-O 3.41Å; G904-I924 PolarHBondContact N-O 3.12Å; G904-E925 PolarHBondContact N-O 3.11Å; G904-T954 WeakPolarHBondContact O-CA 3.16Å
905	L	88.3	Confident	80.4	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	113.1	-178.2	172.9	62.5	0	0	0	110.2	L870 F894 E923 I924 L952 C953 T954	L870-L905 HydrophobicContact CD2-CD1 4.42Å; F894-L905 HydrophobicContact CB-CD2 4.24Å; F894-L905 HydrophobicContact CD1-CD2 3.57Å; F894-L905 HydrophobicContact CD2-CD2 4.17Å; F894-L905 HydrophobicContact CE1-CD2 3.88Å; F894-L905 HydrophobicContact CE1-CG 4.47Å; F894-L905 HydrophobicContact CE2-CD2 4.42Å; F894-L905 HydrophobicContact CG-CD2 3.73Å; F894-L905 HydrophobicContact CZ-CD2 4.3Å; L905-E923 WeakPolarHBondContact O-CA 3.39Å; L905-I924 HydrophobicContact CB-CB 4.25Å; L905-I924 HydrophobicContact CD2-CD1 4.34Å; L905-I924 PolarHBondContact N-O 3.17Å; L905-I924 PolarHBondContact O-N 3.19Å; L905-L952 HydrophobicContact CD1-CB 4.47Å; L905-C953 VanDerWaalsContact CA-O 3.31Å; L905-C953 WeakPolarHBondContact CA-O 3.47Å; L905-T954 HydrophobicContact CD1-CG2 4.15Å
906	H	88.3	Confident	80.2	Confident	65 Å²	65	59.2 Å²	59.2	30%	0.301	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	171.5	-175.2	61.9	-81.1	0	0	0	111.7	G904 E923 C953	G904-H906 PolarHBondContact O-ND1 3.08Å; H906-E923 HydrophobicContact CB-CB 4.23Å; H906-E923 HydrophobicContact CB-CG 4.14Å; H906-C953 WeakPolarHBondContact CE1-CB 3.32Å; H906-C953 PolarHBondContact N-O 3.07Å; H906-C953 VanDerWaalsContact NE2-CB 3.28Å; H906-C953 WeakPolarHBondContact NE2-CB 3.35Å; H906-C953 PolarHBondContact O-N 3.17Å
907	V	88	Confident	79.9	Confident	6 Å²	6	61.3 Å²	61.3	4%	0.036	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	130.5	172.1	179.4	0	0	0	0	109.5	E920 F921 M937 F950 Q951	V907-E920 HydrophobicContact CB-CB 4.09Å; V907-E920 HydrophobicContact CB-CG 3.74Å; V907-E920 HydrophobicContact CG1-CG 3.94Å; V907-E920 HydrophobicContact CG2-CB 4.15Å; V907-E920 HydrophobicContact CG2-CG 4.19Å; V907-F921 HydrophobicContact CG2-CD1 3.89Å; V907-F921 HydrophobicContact CG2-CE1 3.44Å; V907-F921 VanDerWaalsContact CG2-CE1 3.44Å; V907-F921 HydrophobicContact CG2-CZ 4.06Å; V907-M937 HydrophobicContact CG2-SD 3.94Å; V907-F950 HydrophobicContact CG1-CB 4.38Å; V907-F950 HydrophobicContact CG1-CD2 4.1Å; V907-Q951 CarbonylContact C-O 3.59Å; V907-Q951 WeakPolarHBondContact CA-O 3.48Å
908	G	77.8	Confident	80	Confident	7 Å²	7	58.8 Å²	58.8	7%	0.072	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	144.7	173.8	0	0	0	0	0	112.2	P910 Q951 C953	G908-P910 VanDerWaalsContact O-N 3.1Å; G908-Q951 PolarHBondContact N-O 3.16Å; G908-C953 VanDerWaalsContact CA-SG 3.51Å
909	T	69.9	Low	80.2	Confident	117 Å²	117	61.4 Å²	61.4	72%	0.718	35%	0.354	S	S	*	.			trans	-28.3	107.2	-175.6	49.6	0	0	0	0	114.1	Q951	T909-Q951 PolarHBondContact O-NE2 2.93Å
910	P	69.2	Low	80.3	Confident	42 Å²	42	56.6 Å²	56.6	27%	0.273	33%	0.331	S	S	.	.			trans	-83.6	131.9	-166	33.2	-37.1	0	0	0	111.5	G908 L912 I918 F950	G908-P910 VanDerWaalsContact O-N 3.1Å; P910-L912 VanDerWaalsContact C-N 3.34Å; P910-L912 HydrophobicContact CB-CD1 4.12Å; P910-L912 HydrophobicContact CB-CD2 4.01Å; P910-L912 HydrophobicContact CB-CG 3.83Å; P910-L912 HydrophobicContact CG-CD1 4Å; P910-L912 HydrophobicContact CG-CG 4.17Å; P910-L912 PolarHBondContact O-N 2.96Å; P910-L912 VanDerWaalsContact O-N 3.15Å; P910-I918 HydrophobicContact CB-CD1 4.3Å; P910-F950 HydrophobicContact CB-CB 3.84Å
911	K	64.6	Low	80.5	Confident	154 Å²	154	52.8 Å²	52.8	67%	0.67	31%	0.307	S	S	*	.			trans	-90.9	70.3	-179	-71.4	179	179.8	168.6	0	110.2	N949	K911-N949 PolarHBondContact N-O 3.37Å
912	L	74	Confident	80.5	Confident	45 Å²	45	55 Å²	55	24%	0.236	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-82.6	143	-170.9	-57.6	176.8	0	0	0	112.8	P910 I916 I918 A948	P910-L912 VanDerWaalsContact C-N 3.34Å; P910-L912 HydrophobicContact CB-CD1 4.12Å; P910-L912 HydrophobicContact CB-CD2 4.01Å; P910-L912 HydrophobicContact CB-CG 3.83Å; P910-L912 HydrophobicContact CG-CD1 4Å; P910-L912 HydrophobicContact CG-CG 4.17Å; P910-L912 PolarHBondContact O-N 2.96Å; P910-L912 VanDerWaalsContact O-N 3.15Å; L912-I916 HydrophobicContact CB-CB 4.32Å; L912-I916 HydrophobicContact CB-CG2 4.47Å; L912-I916 HydrophobicContact CD1-CG2 4.31Å; L912-I916 VanDerWaalsContact CD1-O 3.29Å; L912-I916 WeakPolarHBondContact CD1-O 3.34Å; L912-I916 HydrophobicContact CD2-CG2 4.09Å; L912-I918 HydrophobicContact CD1-CB 4.41Å; L912-I918 HydrophobicContact CD1-CD1 4.31Å; L912-I918 HydrophobicContact CD1-CG1 3.93Å; L912-I918 HydrophobicContact CD2-CD1 3.83Å; L912-I918 HydrophobicContact CD2-CG1 4.21Å; L912-A948 HydrophobicContact CD2-CB 4.46Å
913	P	71.1	Confident	80.5	Confident	39 Å²	39	58.9 Å²	58.9	25%	0.253	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-57.8	150.1	163.4	-22.7	33.9	0	0	0	111.8	G915 I916	P913-G915 PolarHBondContact O-N 3.2Å; P913-G915 VanDerWaalsContact O-N 3.11Å; P913-I916 HydrophobicContact CB-CD1 4.34Å; P913-I916 HydrophobicContact CG-CD1 4.15Å; P913-I916 PolarHBondContact O-N 2.88Å
914	A	63.7	Low	80.5	Confident	114 Å²	114	55.1 Å²	55.1	94%	0.942	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	117	-177.7	0	0	0	0	0	112
915	G	70.6	Confident	80.6	Confident	52 Å²	52	63 Å²	63	54%	0.536	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.5	-22.8	-179	0	0	0	0	0	114.7	P913 C942	P913-G915 PolarHBondContact O-N 3.2Å; P913-G915 VanDerWaalsContact O-N 3.11Å; G915-C942 PolarHBondContact O-SG 3.47Å
916	I	84.4	Confident	80.5	Confident	14 Å²	14	65.8 Å²	65.8	7%	0.072	38%	0.38	C	S	.	.			trans	-79.6	134.2	174.9	-62.2	-177.5	0	0	0	109.1	L912 P913 I939 N940 Q946 A948	L912-I916 HydrophobicContact CB-CB 4.32Å; L912-I916 HydrophobicContact CB-CG2 4.47Å; L912-I916 HydrophobicContact CD1-CG2 4.31Å; L912-I916 VanDerWaalsContact CD1-O 3.29Å; L912-I916 WeakPolarHBondContact CD1-O 3.34Å; L912-I916 HydrophobicContact CD2-CG2 4.09Å; P913-I916 HydrophobicContact CB-CD1 4.34Å; P913-I916 HydrophobicContact CG-CD1 4.15Å; P913-I916 PolarHBondContact O-N 2.88Å; I916-I939 HydrophobicContact CG2-CG2 4.3Å; I916-N940 WeakPolarHBondContact CA-O 3.47Å; I916-N940 WeakPolarHBondContact CG2-O 3.41Å; I916-Q946 HydrophobicContact CD1-CB 4.1Å; I916-A948 HydrophobicContact CG2-CB 4.17Å
917	S	86.3	Confident	80.4	Confident	46 Å²	46	62.8 Å²	62.8	32%	0.322	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	153.8	172	68.6	0	0	0	0	111.3	N940	S917-N940 PolarHBondContact N-O 2.97Å; S917-N940 VanDerWaalsContact N-O 3.17Å; S917-N940 PolarHBondContact O-N 3Å; S917-N940 VanDerWaalsContact OG-CB 3.29Å; S917-N940 WeakPolarHBondContact OG-CB 3.21Å
918	I	89	Confident	80.4	Confident	26 Å²	26	64.8 Å²	64.8	13%	0.133	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	134.6	175.7	-65.1	179.8	0	0	0	107.7	P910 L912 E920 M937 G938 I939 A948 F950	P910-I918 HydrophobicContact CB-CD1 4.3Å; L912-I918 HydrophobicContact CD1-CB 4.41Å; L912-I918 HydrophobicContact CD1-CD1 4.31Å; L912-I918 HydrophobicContact CD1-CG1 3.93Å; L912-I918 HydrophobicContact CD2-CD1 3.83Å; L912-I918 HydrophobicContact CD2-CG1 4.21Å; I918-E920 HydrophobicContact CG2-CG 4.34Å; I918-M937 HydrophobicContact CD1-CE 4.48Å; I918-M937 HydrophobicContact CG2-CE 3.97Å; I918-M937 HydrophobicContact CG2-CG 3.96Å; I918-M937 HydrophobicContact CG2-SD 3.82Å; I918-G938 CarbonylContact C-O 3.55Å; I918-G938 WeakPolarHBondContact CA-O 3.46Å; I918-I939 HydrophobicContact CG1-CD1 4.47Å; I918-I939 HydrophobicContact CG1-CG1 4.18Å; I918-I939 HydrophobicContact CG1-CG2 4.21Å; I918-A948 HydrophobicContact CD1-CB 4.4Å; I918-F950 HydrophobicContact CD1-CB 3.93Å; I918-F950 HydrophobicContact CD1-CD1 3.8Å; I918-F950 HydrophobicContact CD1-CG 4Å
919	Q	87.4	Confident	80.9	Confident	81 Å²	81	67.6 Å²	67.6	38%	0.379	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	110.4	163	-175.1	164.5	1.4	0	0	108.4	F881 M887 M937 G938	F881-Q919 HydrophobicContact CE1-CB 4.35Å; F881-Q919 VanDerWaalsContact CE1-CD 3.48Å; F881-Q919 HydrophobicContact CE1-CG 4.06Å; F881-Q919 VanDerWaalsContact CE1-OE1 3.25Å; F881-Q919 HydrophobicContact CZ-CG 4.32Å; M887-Q919 HydrophobicContact SD-CB 4.17Å; Q919-M937 WeakPolarHBondContact O-CG 3.34Å; Q919-G938 PolarHBondContact N-O 2.77Å; Q919-G938 PolarHBondContact O-N 3.01Å; Q919-G938 VanDerWaalsContact O-N 3.08Å
920	E	86.7	Confident	81.5	Confident	92 Å²	92	65.3 Å²	65.3	43%	0.43	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-69.2	153.6	-172.3	-55.1	-178.9	170.4	0	0	111.9	V907 I918	V907-E920 HydrophobicContact CB-CB 4.09Å; V907-E920 HydrophobicContact CB-CG 3.74Å; V907-E920 HydrophobicContact CG1-CG 3.94Å; V907-E920 HydrophobicContact CG2-CB 4.15Å; V907-E920 HydrophobicContact CG2-CG 4.19Å; I918-E920 HydrophobicContact CG2-CG 4.34Å
921	F	87.9	Confident	82.4	Confident	9 Å²	9	68 Å²	68	4%	0.039	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-85.8	153	174.2	59.5	-93	0	0	0	111.2	I892 F894 V907 I924 A935 M937 L952	I892-F921 HydrophobicContact CD1-CD1 4.35Å; I892-F921 HydrophobicContact CD1-CE1 4.24Å; F894-F921 HydrophobicContact CE1-CZ 4.39Å; F894-F921 HydrophobicContact CE2-CE1 4.44Å; F894-F921 HydrophobicContact CE2-CE2 4.03Å; F894-F921 AromaticContact CE2-CZ 3.97Å; F894-F921 HydrophobicContact CE2-CZ 3.97Å; F894-F921 AromaticContact CZ-CE1 3.84Å; F894-F921 HydrophobicContact CZ-CE1 3.84Å; F894-F921 AromaticContact CZ-CE2 3.97Å; F894-F921 HydrophobicContact CZ-CE2 3.97Å; F894-F921 AromaticContact CZ-CZ 3.44Å; F894-F921 HydrophobicContact CZ-CZ 3.44Å; F894-F921 VanDerWaalsContact CZ-CZ 3.44Å; V907-F921 HydrophobicContact CG2-CD1 3.89Å; V907-F921 HydrophobicContact CG2-CE1 3.44Å; V907-F921 VanDerWaalsContact CG2-CE1 3.44Å; V907-F921 HydrophobicContact CG2-CZ 4.06Å; F921-I924 HydrophobicContact CE2-CD1 4.35Å; F921-A935 HydrophobicContact CB-CB 3.85Å; F921-A935 HydrophobicContact CD1-CB 4.39Å; F921-A935 HydrophobicContact CD2-CB 3.87Å; F921-A935 HydrophobicContact CG-CB 3.78Å; F921-M937 HydrophobicContact CD1-CB 4.33Å; F921-M937 HydrophobicContact CD1-CG 4.24Å; F921-M937 HydrophobicContact CD1-SD 3.98Å; F921-M937 HydrophobicContact CE1-SD 4.26Å; F921-L952 HydrophobicContact CE1-CD2 4.09Å; F921-L952 HydrophobicContact CZ-CD2 3.97Å
922	P	85.3	Confident	83.5	Confident	117 Å²	117	64.6 Å²	64.6	76%	0.76	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-59	139.8	177.4	-23.5	34.1	0	0	0	112.7	I924	P922-I924 PolarHBondContact O-N 3.28Å
923	E	86.4	Confident	84.3	Confident	107 Å²	107	64.5 Å²	64.5	50%	0.5	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-56.3	128	-178.6	-178.7	175.1	-178.9	0	0	111.9	G904 L905 H906 E925	G904-E923 WeakPolarHBondContact CA-OE1 3.29Å; L905-E923 WeakPolarHBondContact O-CA 3.39Å; H906-E923 HydrophobicContact CB-CB 4.23Å; H906-E923 HydrophobicContact CB-CG 4.14Å; E923-E925 PolarHBondContact O-N 3.35Å
924	I	88.3	Confident	85.2	Confident	24 Å²	24	66.2 Å²	66.2	12%	0.123	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	101.8	176.3	-58.8	169.1	0	0	0	107.8	F894 G904 L905 F921 P922 S926 T933	F894-I924 HydrophobicContact CD2-CD1 3.63Å; F894-I924 HydrophobicContact CE2-CD1 3.81Å; G904-I924 WeakPolarHBondContact CA-O 3.41Å; G904-I924 PolarHBondContact N-O 3.12Å; L905-I924 HydrophobicContact CB-CB 4.25Å; L905-I924 HydrophobicContact CD2-CD1 4.34Å; L905-I924 PolarHBondContact N-O 3.17Å; L905-I924 PolarHBondContact O-N 3.19Å; F921-I924 HydrophobicContact CE2-CD1 4.35Å; P922-I924 PolarHBondContact O-N 3.28Å; I924-S926 VanDerWaalsContact C-N 3.33Å; I924-S926 PolarHBondContact O-N 3.49Å; I924-T933 HydrophobicContact CD1-CG2 3.89Å
925	E	84.9	Confident	86.5	Confident	164 Å²	164	61.4 Å²	61.4	77%	0.766	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.2	-46.6	-175.1	-62	-178.1	176.2	0	0	113	K903 G904 E923	K903-E925 WeakPolarHBondContact CA-O 3.18Å; K903-E925 WeakPolarHBondContact CB-O 3.29Å; G904-E925 PolarHBondContact N-O 3.11Å; E923-E925 PolarHBondContact O-N 3.35Å
926	S	86.4	Confident	87.5	Confident	61 Å²	61	61.8 Å²	61.8	43%	0.427	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	145.2	172.1	69.7	0	0	0	0	113.4	I902 I924	I902-S926 CarbonylContact O-C 3.51Å; I902-S926 VanDerWaalsContact O-CA 3.29Å; I902-S926 WeakPolarHBondContact O-CA 3.43Å; I924-S926 VanDerWaalsContact C-N 3.33Å; I924-S926 PolarHBondContact O-N 3.49Å
927	L	87.4	Confident	87.7	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	105.7	174.5	-177.5	63.3	0	0	0	109.2	L870 F894 N896 I902 E931 T933	L870-L927 HydrophobicContact CD1-CD2 4.43Å; F894-L927 HydrophobicContact CB-CD2 3.97Å; N896-L927 HydrophobicContact CB-CD2 3.87Å; N896-L927 HydrophobicContact CB-CG 3.84Å; N896-L927 PolarHBondContact ND2-O 3.05Å; I902-L927 PolarHBondContact N-O 3.35Å; I902-L927 VanDerWaalsContact N-O 3.14Å; I902-L927 PolarHBondContact O-N 3.04Å; L927-E931 HydrophobicContact CD1-CB 4.23Å; L927-E931 HydrophobicContact CD1-CG 4.31Å; L927-T933 WeakPolarHBondContact CD1-OG1 3.44Å
928	P	88.1	Confident	88	Confident	49 Å²	49	58.9 Å²	58.9	32%	0.318	35%	0.345	S	S	.	.			trans	-62	156	-178.3	-27.3	37.3	0	0	0	114.7	N896 G930 E931	N896-P928 WeakPolarHBondContact CB-O 3.42Å; N896-P928 PolarHBondContact ND2-O 3.36Å; P928-G930 PolarHBondContact O-N 3.17Å; P928-E931 HydrophobicContact CB-CB 4.26Å; P928-E931 VanDerWaalsContact CD-OE2 3.29Å; P928-E931 WeakPolarHBondContact CD-OE2 3.29Å; P928-E931 VanDerWaalsContact CG-OE2 3.28Å; P928-E931 WeakPolarHBondContact CG-OE2 3.48Å; P928-E931 PolarHBondContact O-N 3.25Å; P928-E931 VanDerWaalsContact O-N 3.16Å
929	P	86.4	Confident	88	Confident	65 Å²	65	57.7 Å²	57.7	42%	0.422	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	128.4	170.5	-29.3	38	0	0	0	112.7	S898 E931	S898-P929 WeakPolarHBondContact O-CB 3.32Å; P929-E931 VanDerWaalsContact C-N 3.26Å; P929-E931 PolarHBondContact O-N 3.16Å
930	G	83	Confident	88.1	Confident	69 Å²	69	54.6 Å²	54.6	71%	0.711	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	-4.9	179.7	0	0	0	0	0	115.6	N896 P928	N896-G930 WeakPolarHBondContact O-CA 3.32Å; N896-G930 PolarHBondContact O-N 3.42Å; P928-G930 PolarHBondContact O-N 3.17Å
931	E	87.9	Confident	88.1	Confident	100 Å²	100	50.2 Å²	50.2	47%	0.467	30%	0.304	S	S	.	.			trans	-86.8	160.6	177.4	-169.3	156.4	-160.3	0	0	112.2	N896 L927 P928 P929	N896-E931 PolarHBondContact N-O 2.9Å; N896-E931 VanDerWaalsContact N-O 3.09Å; L927-E931 HydrophobicContact CD1-CB 4.23Å; L927-E931 HydrophobicContact CD1-CG 4.31Å; P928-E931 HydrophobicContact CB-CB 4.26Å; P928-E931 VanDerWaalsContact CD-OE2 3.29Å; P928-E931 WeakPolarHBondContact CD-OE2 3.29Å; P928-E931 VanDerWaalsContact CG-OE2 3.28Å; P928-E931 WeakPolarHBondContact CG-OE2 3.48Å; P928-E931 PolarHBondContact O-N 3.25Å; P928-E931 VanDerWaalsContact O-N 3.16Å; P929-E931 VanDerWaalsContact C-N 3.26Å; P929-E931 PolarHBondContact O-N 3.16Å
932	S	89.1	Confident	88	Confident	81 Å²	81	52.5 Å²	52.5	57%	0.566	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.3	128.6	175.5	-59.4	0	0	0	0	111.9	F894 S895	F894-S932 CarbonylContact O-C 3.44Å; F894-S932 WeakPolarHBondContact O-CA 3.07Å; F894-S932 WeakPolarHBondContact O-CB 3.45Å; S895-S932 WeakPolarHBondContact CB-OG 3.38Å
933	T	89.5	Confident	87.9	Confident	44 Å²	44	47.7 Å²	47.7	27%	0.27	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	145.2	-176.7	-68.8	0	0	0	0	110	F894 I924 L927	F894-T933 PolarHBondContact N-O 2.93Å; F894-T933 PolarHBondContact O-N 2.9Å; I924-T933 HydrophobicContact CD1-CG2 3.89Å; L927-T933 WeakPolarHBondContact CD1-OG1 3.44Å
934	T	90.7	Very high	87.8	Confident	75 Å²	75	44.2 Å²	44.2	46%	0.46	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	131.6	174.6	-48.1	0	0	0	0	109.9	H891 I892 Y893	H891-T934 HydrophobicContact CB-CG2 4.2Å; I892-T934 CarbonylContact O-C 3.57Å; I892-T934 WeakPolarHBondContact O-CA 3.47Å; Y893-T934 HydrophobicContact CD1-CG2 3.73Å; Y893-T934 VanDerWaalsContact CD1-OG1 3.24Å; Y893-T934 WeakPolarHBondContact CD1-OG1 3.35Å; Y893-T934 HydrophobicContact CE1-CG2 3.62Å; Y893-T934 HydrophobicContact CG-CG2 4.37Å
935	A	90.7	Very high	87.7	Confident	13 Å²	13	44.6 Å²	44.6	11%	0.107	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	166.6	169.4	0	0	0	0	0	110.7	H891 I892 F894 F921	H891-A935 WeakPolarHBondContact CA-O 3.42Å; I892-A935 PolarHBondContact N-O 2.83Å; I892-A935 PolarHBondContact O-N 2.81Å; F894-A935 HydrophobicContact CE2-CB 3.83Å; F921-A935 HydrophobicContact CB-CB 3.85Å; F921-A935 HydrophobicContact CD1-CB 4.39Å; F921-A935 HydrophobicContact CD2-CB 3.87Å; F921-A935 HydrophobicContact CG-CB 3.78Å
936	V	90.8	Very high	87.8	Confident	59 Å²	59	41.8 Å²	41.8	36%	0.358	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129	174.4	-167.8	0	0	0	0	108.6	F881 S889 I890	F881-V936 HydrophobicContact CD2-CG1 4.25Å; F881-V936 HydrophobicContact CE2-CG1 4.03Å; S889-V936 VanDerWaalsContact OG-CG1 3.29Å; S889-V936 WeakPolarHBondContact OG-CG1 3.35Å; I890-V936 WeakPolarHBondContact O-CA 3.35Å
937	M	90.2	Very high	87.8	Confident	0 Å²	0	40 Å²	40	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	139.8	-178.7	-160	175	77.8	0	0	109.6	I890 I892 V907 I918 Q919 F921 I939 F950	I890-M937 PolarHBondContact N-O 3.43Å; I890-M937 PolarHBondContact O-N 3.41Å; I892-M937 HydrophobicContact CD1-CB 3.91Å; I892-M937 HydrophobicContact CD1-CE 4Å; I892-M937 HydrophobicContact CD1-SD 3.83Å; V907-M937 HydrophobicContact CG2-SD 3.94Å; I918-M937 HydrophobicContact CD1-CE 4.48Å; I918-M937 HydrophobicContact CG2-CE 3.97Å; I918-M937 HydrophobicContact CG2-CG 3.96Å; I918-M937 HydrophobicContact CG2-SD 3.82Å; Q919-M937 WeakPolarHBondContact O-CG 3.34Å; F921-M937 HydrophobicContact CD1-CB 4.33Å; F921-M937 HydrophobicContact CD1-CG 4.24Å; F921-M937 HydrophobicContact CD1-SD 3.98Å; F921-M937 HydrophobicContact CE1-SD 4.26Å; M937-I939 HydrophobicContact CE-CD1 3.6Å; M937-I939 HydrophobicContact CE-CG1 3.81Å; M937-F950 HydrophobicContact CE-CE1 3.96Å; M937-F950 HydrophobicContact CE-CE2 4.11Å; M937-F950 HydrophobicContact CE-CZ 3.7Å; M937-F950 HydrophobicContact SD-CE2 4.35Å; M937-F950 HydrophobicContact SD-CZ 4.5Å
938	G	91.3	Very high	87.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	134.1	174.1	0	0	0	0	0	110.5	I918 Q919	I918-G938 CarbonylContact C-O 3.55Å; I918-G938 WeakPolarHBondContact CA-O 3.46Å; Q919-G938 PolarHBondContact N-O 2.77Å; Q919-G938 PolarHBondContact O-N 3.01Å; Q919-G938 VanDerWaalsContact O-N 3.08Å
939	I	90.4	Very high	87.8	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.2	168.6	-50.4	-171.8	0	0	0	109.9	V888 I890 I916 I918 M937 F941 A948 I963	V888-I939 PolarHBondContact N-O 2.95Å; V888-I939 PolarHBondContact O-N 3.1Å; I890-I939 HydrophobicContact CD1-CB 4.47Å; I890-I939 HydrophobicContact CD1-CD1 3.66Å; I890-I939 HydrophobicContact CD1-CG1 3.95Å; I916-I939 HydrophobicContact CG2-CG2 4.3Å; I918-I939 HydrophobicContact CG1-CD1 4.47Å; I918-I939 HydrophobicContact CG1-CG1 4.18Å; I918-I939 HydrophobicContact CG1-CG2 4.21Å; M937-I939 HydrophobicContact CE-CD1 3.6Å; M937-I939 HydrophobicContact CE-CG1 3.81Å; I939-F941 HydrophobicContact CB-CD2 4.21Å; I939-F941 HydrophobicContact CB-CE1 4.48Å; I939-F941 HydrophobicContact CB-CE2 3.69Å; I939-F941 HydrophobicContact CB-CZ 3.85Å; I939-F941 HydrophobicContact CD1-CZ 3.92Å; I939-F941 HydrophobicContact CG1-CZ 4.45Å; I939-F941 HydrophobicContact CG2-CD1 3.93Å; I939-F941 HydrophobicContact CG2-CD2 3.93Å; I939-F941 HydrophobicContact CG2-CE1 3.66Å; I939-F941 HydrophobicContact CG2-CE2 3.67Å; I939-F941 HydrophobicContact CG2-CG 4.07Å; I939-F941 HydrophobicContact CG2-CZ 3.54Å; I939-A948 HydrophobicContact CD1-CB 4.07Å; I939-A948 HydrophobicContact CG2-CB 4.01Å; I939-I963 HydrophobicContact CD1-CB 4.46Å; I939-I963 HydrophobicContact CD1-CD1 4.34Å; I939-I963 HydrophobicContact CD1-CG2 4.47Å
940	N	89.3	Confident	88	Confident	17 Å²	17	38.1 Å²	38.1	9%	0.091	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	109.6	166.2	-164.8	-31.6	0	0	0	109.3	M887 I916 S917 C942 T1039	M887-N940 HydrophobicContact CE-CB 4.45Å; M887-N940 HydrophobicContact CG-CB 3.91Å; M887-N940 HydrophobicContact SD-CB 4.21Å; I916-N940 WeakPolarHBondContact CA-O 3.47Å; I916-N940 WeakPolarHBondContact CG2-O 3.41Å; S917-N940 PolarHBondContact N-O 2.97Å; S917-N940 VanDerWaalsContact N-O 3.17Å; S917-N940 PolarHBondContact O-N 3Å; S917-N940 VanDerWaalsContact OG-CB 3.29Å; S917-N940 WeakPolarHBondContact OG-CB 3.21Å; N940-C942 PolarHBondContact OD1-N 2.87Å; N940-C942 PolarHBondContact OD1-SG 2.81Å; N940-T1039 VanDerWaalsContact OD1-CG2 3.25Å; N940-T1039 WeakPolarHBondContact OD1-CG2 3.38Å; N940-T1039 PolarHBondContact OD1-OG1 3.49Å
941	F	87.1	Confident	88.2	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.208	C	C	.	.			trans	-90	-1.8	177.4	-65.6	-80.5	0	0	0	113.6	V888 I890 I939 D943 S944 A948 I963 P965 L970	V888-F941 HydrophobicContact CB-CD2 4.32Å; V888-F941 HydrophobicContact CB-CE2 4.19Å; V888-F941 HydrophobicContact CG2-CD2 3.88Å; V888-F941 HydrophobicContact CG2-CE2 4.2Å; I890-F941 HydrophobicContact CD1-CE2 4.43Å; I890-F941 HydrophobicContact CD1-CZ 4.42Å; I939-F941 HydrophobicContact CB-CD2 4.21Å; I939-F941 HydrophobicContact CB-CE1 4.48Å; I939-F941 HydrophobicContact CB-CE2 3.69Å; I939-F941 HydrophobicContact CB-CZ 3.85Å; I939-F941 HydrophobicContact CD1-CZ 3.92Å; I939-F941 HydrophobicContact CG1-CZ 4.45Å; I939-F941 HydrophobicContact CG2-CD1 3.93Å; I939-F941 HydrophobicContact CG2-CD2 3.93Å; I939-F941 HydrophobicContact CG2-CE1 3.66Å; I939-F941 HydrophobicContact CG2-CE2 3.67Å; I939-F941 HydrophobicContact CG2-CG 4.07Å; I939-F941 HydrophobicContact CG2-CZ 3.54Å; F941-D943 VanDerWaalsContact C-N 3.26Å; F941-D943 PolarHBondContact O-N 2.92Å; F941-S944 WeakPolarHBondContact O-CB 3.36Å; F941-S944 PolarHBondContact O-N 3.23Å; F941-A948 HydrophobicContact CE1-CB 3.81Å; F941-I963 HydrophobicContact CZ-CG2 4.2Å; F941-P965 HydrophobicContact CB-CG 4.44Å; F941-P965 HydrophobicContact CD1-CB 4.47Å; F941-P965 HydrophobicContact CD1-CG 3.66Å; F941-P965 HydrophobicContact CD2-CB 4.14Å; F941-P965 HydrophobicContact CD2-CG 4.1Å; F941-P965 HydrophobicContact CE1-CB 4.32Å; F941-P965 HydrophobicContact CE1-CG 3.78Å; F941-P965 HydrophobicContact CE2-CB 3.98Å; F941-P965 HydrophobicContact CE2-CG 4.2Å; F941-P965 HydrophobicContact CG-CB 4.38Å; F941-P965 HydrophobicContact CG-CG 3.83Å; F941-P965 HydrophobicContact CZ-CB 4.06Å; F941-P965 HydrophobicContact CZ-CG 4.05Å; F941-L970 HydrophobicContact CB-CD2 3.74Å; F941-L970 HydrophobicContact CD2-CD2 3.71Å; F941-L970 HydrophobicContact CG-CD2 3.97Å
942	C	85.7	Confident	88.3	Confident	56 Å²	56	30.7 Å²	30.7	38%	0.378	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	43.2	-176.2	-80	0	0	0	0	114.4	G915 N940 S944	G915-C942 PolarHBondContact O-SG 3.47Å; N940-C942 PolarHBondContact OD1-N 2.87Å; N940-C942 PolarHBondContact OD1-SG 2.81Å; C942-S944 PolarHBondContact O-N 2.84Å
943	D	83.1	Confident	88.2	Confident	17 Å²	17	27 Å²	27	9%	0.091	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	26.3	-176	-32.4	-79.9	0	0	0	114.1	F941 T1037 T1039 S1040 K1064 I1067	F941-D943 VanDerWaalsContact C-N 3.26Å; F941-D943 PolarHBondContact O-N 2.92Å; D943-T1037 WeakPolarHBondContact OD1-CB 3.43Å; D943-T1037 PolarHBondContact OD1-OG1 2.9Å; D943-T1039 PolarHBondContact OD1-N 3.49Å; D943-S1040 PolarHBondContact OD1-N 3.19Å; D943-S1040 VanDerWaalsContact OD1-N 3.16Å; D943-S1040 PolarHBondContact OD1-OG 2.74Å; D943-S1040 VanDerWaalsContact OD1-OG 3.1Å; D943-S1040 VanDerWaalsContact OD2-CB 3.24Å; D943-S1040 WeakPolarHBondContact OD2-CB 3.34Å; D943-S1040 PolarHBondContact OD2-N 3.44Å; D943-S1040 PolarHBondContact OD2-OG 2.94Å; D943-K1064 HydrophobicContact CB-CD 3.86Å; D943-K1064 IonicContact OD2-NZ 2.79Å; D943-K1064 PolarHBondContact OD2-NZ 2.88Å; D943-I1067 HydrophobicContact CB-CD1 3.82Å; D943-I1067 WeakPolarHBondContact O-CD1 3.29Å
944	S	84.6	Confident	88.1	Confident	33 Å²	33	25.6 Å²	25.6	23%	0.231	15%	0.151	C	C	.	.			trans	-105.8	141.5	-179.7	-169.6	0	0	0	0	111.6	F941 C942 Q946	F941-S944 WeakPolarHBondContact O-CB 3.36Å; F941-S944 PolarHBondContact O-N 3.23Å; C942-S944 PolarHBondContact O-N 2.84Å; S944-Q946 PolarHBondContact O-N 3.12Å; S944-Q946 WeakPolarHBondContact OG-CG 3.35Å
945	T	84.4	Confident	87.6	Confident	33 Å²	33	28.1 Å²	28.1	20%	0.202	16%	0.158	C	C	.	.			trans	-87.8	17.4	174.6	60.8	0	0	0	0	113	Q964 V967 L970	T945-Q964 PolarHBondContact O-NE2 3.47Å; T945-V967 HydrophobicContact CG2-CG2 4.2Å; T945-L970 HydrophobicContact CG2-CD1 4.43Å
946	Q	86.9	Confident	87	Confident	105 Å²	105	33.2 Å²	33.2	49%	0.491	19%	0.188	S	C	.	.			trans	-75.6	144.6	174.7	-71.6	178.3	29.7	0	0	111	I916 S944	I916-Q946 HydrophobicContact CD1-CB 4.1Å; S944-Q946 PolarHBondContact O-N 3.12Å; S944-Q946 WeakPolarHBondContact OG-CG 3.35Å
947	A	86.9	Confident	86.5	Confident	22 Å²	22	36.5 Å²	36.5	18%	0.182	19%	0.194	C	C	.	.			trans	-77.4	134.1	179	0	0	0	0	0	112.1	N949 S962 I963 Q964	A947-N949 PolarHBondContact O-N 2.93Å; A947-N949 PolarHBondContact O-ND2 3.24Å; A947-S962 VanDerWaalsContact CB-OG 3.31Å; A947-S962 WeakPolarHBondContact CB-OG 3.26Å; A947-I963 CarbonylContact C-O 3.56Å; A947-I963 VanDerWaalsContact CA-O 3.26Å; A947-I963 WeakPolarHBondContact CA-O 3.24Å; A947-Q964 HydrophobicContact CB-CB 3.89Å; A947-Q964 HydrophobicContact CB-CG 4.22Å
948	A	88.1	Confident	86.4	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	113.4	173.2	0	0	0	0	0	109.4	L912 I916 I918 I939 F941 S962 I963	L912-A948 HydrophobicContact CD2-CB 4.46Å; I916-A948 HydrophobicContact CG2-CB 4.17Å; I918-A948 HydrophobicContact CD1-CB 4.4Å; I939-A948 HydrophobicContact CD1-CB 4.07Å; I939-A948 HydrophobicContact CG2-CB 4.01Å; F941-A948 HydrophobicContact CE1-CB 3.81Å; A948-S962 WeakPolarHBondContact O-CA 3.08Å; A948-I963 PolarHBondContact N-O 3.43Å; A948-I963 PolarHBondContact O-N 3.07Å
949	N	88.6	Confident	86.3	Confident	74 Å²	74	43.6 Å²	43.6	40%	0.396	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	120.1	-177.5	-59.5	-65.9	0	0	0	110.6	K911 A947 S962	K911-N949 PolarHBondContact N-O 3.37Å; A947-N949 PolarHBondContact O-N 2.93Å; A947-N949 PolarHBondContact O-ND2 3.24Å; N949-S962 VanDerWaalsContact OD1-CB 3.32Å; N949-S962 WeakPolarHBondContact OD1-CB 3.47Å; N949-S962 PolarHBondContact OD1-OG 3.01Å
950	F	89	Confident	86.2	Confident	3 Å²	3	51.1 Å²	51.1	1%	0.013	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	175.3	-178.2	62.4	-81.5	0	0	0	111.3	L861 V907 P910 I918 M937 L952 V961 I963	L861-F950 HydrophobicContact CD2-CZ 4.22Å; V907-F950 HydrophobicContact CG1-CB 4.38Å; V907-F950 HydrophobicContact CG1-CD2 4.1Å; P910-F950 HydrophobicContact CB-CB 3.84Å; I918-F950 HydrophobicContact CD1-CB 3.93Å; I918-F950 HydrophobicContact CD1-CD1 3.8Å; I918-F950 HydrophobicContact CD1-CG 4Å; M937-F950 HydrophobicContact CE-CE1 3.96Å; M937-F950 HydrophobicContact CE-CE2 4.11Å; M937-F950 HydrophobicContact CE-CZ 3.7Å; M937-F950 HydrophobicContact SD-CE2 4.35Å; M937-F950 HydrophobicContact SD-CZ 4.5Å; F950-L952 HydrophobicContact CE2-CD2 4.03Å; F950-L952 HydrophobicContact CE2-CG 4.16Å; F950-V961 HydrophobicContact CD1-CG2 4.24Å; F950-V961 HydrophobicContact CD2-CG2 3.64Å; F950-V961 HydrophobicContact CE1-CG2 4Å; F950-V961 HydrophobicContact CE2-CG2 3.38Å; F950-V961 HydrophobicContact CG-CG2 4.07Å; F950-V961 HydrophobicContact CZ-CG2 3.57Å; F950-V961 PolarHBondContact N-O 2.7Å; F950-V961 PolarHBondContact O-N 3.33Å; F950-V961 VanDerWaalsContact O-O 3.11Å; F950-I963 HydrophobicContact CE1-CB 4.49Å; F950-I963 HydrophobicContact CE1-CD1 3.82Å; F950-I963 HydrophobicContact CE1-CG1 3.98Å; F950-I963 HydrophobicContact CZ-CD1 3.83Å; F950-I963 HydrophobicContact CZ-CG1 4.31Å
951	Q	88.9	Confident	86.2	Confident	12 Å²	12	50.8 Å²	50.8	6%	0.056	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	138.7	178.1	-68.8	169.4	93.3	0	0	109.4	V907 G908 T909 F959 Y960	V907-Q951 CarbonylContact C-O 3.59Å; V907-Q951 WeakPolarHBondContact CA-O 3.48Å; G908-Q951 PolarHBondContact N-O 3.16Å; T909-Q951 PolarHBondContact O-NE2 2.93Å; Q951-F959 CarbonylContact C-O 3.53Å; Q951-F959 VanDerWaalsContact CA-O 3.31Å; Q951-F959 WeakPolarHBondContact CA-O 3.47Å; Q951-Y960 HydrophobicContact CG-CD1 3.86Å; Q951-Y960 HydrophobicContact CG-CD2 4.36Å; Q951-Y960 HydrophobicContact CG-CE1 3.71Å; Q951-Y960 HydrophobicContact CG-CE2 4.2Å; Q951-Y960 HydrophobicContact CG-CG 4.2Å; Q951-Y960 PolarHBondContact OE1-OH 2.96Å
952	L	89	Confident	86.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	115.3	163.5	-70.3	171.9	0	0	0	107.7	L861 V872 F894 L905 F921 F950 Q958 F959 V961	L861-L952 HydrophobicContact CD2-CD1 4.5Å; V872-L952 HydrophobicContact CG1-CD1 4.32Å; V872-L952 HydrophobicContact CG2-CD1 4.23Å; F894-L952 HydrophobicContact CE1-CD1 4.2Å; F894-L952 HydrophobicContact CE1-CD2 4.22Å; F894-L952 HydrophobicContact CZ-CD2 4.42Å; L905-L952 HydrophobicContact CD1-CB 4.47Å; F921-L952 HydrophobicContact CE1-CD2 4.09Å; F921-L952 HydrophobicContact CZ-CD2 3.97Å; F950-L952 HydrophobicContact CE2-CD2 4.03Å; F950-L952 HydrophobicContact CE2-CG 4.16Å; L952-Q958 WeakPolarHBondContact O-CA 3.41Å; L952-F959 HydrophobicContact CB-CB 4.5Å; L952-F959 PolarHBondContact N-O 3.27Å; L952-F959 PolarHBondContact O-N 2.92Å; L952-V961 HydrophobicContact CD1-CG1 4.11Å; L952-V961 HydrophobicContact CD1-CG2 4.1Å; L952-V961 HydrophobicContact CG-CG2 3.95Å
953	C	87.5	Confident	86.5	Confident	4 Å²	4	50.7 Å²	50.7	3%	0.027	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	139.9	-179.8	-68.2	0	0	0	0	110	L905 H906 G908	L905-C953 VanDerWaalsContact CA-O 3.31Å; L905-C953 WeakPolarHBondContact CA-O 3.47Å; H906-C953 WeakPolarHBondContact CE1-CB 3.32Å; H906-C953 PolarHBondContact N-O 3.07Å; H906-C953 VanDerWaalsContact NE2-CB 3.28Å; H906-C953 WeakPolarHBondContact NE2-CB 3.35Å; H906-C953 PolarHBondContact O-N 3.17Å; G908-C953 VanDerWaalsContact CA-SG 3.51Å
954	T	86	Confident	86.8	Confident	15 Å²	15	55.4 Å²	55.4	9%	0.092	28%	0.276	C	S	.	.			trans	-114.8	175.2	161	69.3	0	0	0	0	108.7	I902 G904 L905 T956 R957 F959	I902-T954 HydrophobicContact CG2-CG2 3.72Å; G904-T954 WeakPolarHBondContact O-CA 3.16Å; L905-T954 HydrophobicContact CD1-CG2 4.15Å; T954-T956 PolarHBondContact O-N 3.07Å; T954-T956 PolarHBondContact OG1-N 3.37Å; T954-T956 PolarHBondContact OG1-OG1 3.05Å; T954-R957 PolarHBondContact N-O 2.95Å; T954-R957 PolarHBondContact OG1-N 3.23Å; T954-F959 HydrophobicContact CG2-CE2 4.29Å
955	Q	81	Confident	86.9	Confident	128 Å²	128	54.1 Å²	54.1	60%	0.598	27%	0.267	S	S	*	.	S	Bend	trans	-59.4	-9.5	172.4	-72.1	174.7	4	0	0	114.6	K903	K903-Q955 HydrophobicContact CB-CG 4.31Å; K903-Q955 WeakPolarHBondContact O-CG 3.31Å; K903-Q955 PolarHBondContact O-N 2.85Å
956	T	77.4	Confident	87.1	Confident	120 Å²	120	54.3 Å²	54.3	74%	0.736	27%	0.268	S	S	*	.	S	Bend	trans	-131.5	-18.7	-175.5	57.2	0	0	0	0	115.4	T954	T954-T956 PolarHBondContact O-N 3.07Å; T954-T956 PolarHBondContact OG1-N 3.37Å; T954-T956 PolarHBondContact OG1-OG1 3.05Å
957	R	82.1	Confident	87.1	Confident	128 Å²	128	49.5 Å²	49.5	48%	0.483	25%	0.246	S	C	.	.			trans	-143.9	163.2	-171.4	-67.5	-60.5	-154.8	-164.2	10.4	112.4	E868 T954 F959	E868-R957 VanDerWaalsContact CD-NH2 3.3Å; E868-R957 IonicContact OE1-CZ 2.71Å; E868-R957 IonicContact OE1-NE 2.94Å; E868-R957 IonicContact OE1-NH2 2.73Å; E868-R957 PolarHBondContact OE1-NH2 3.26Å; E868-R957 IonicContact OE2-CZ 3.15Å; E868-R957 VanDerWaalsContact OE2-CZ 3.29Å; E868-R957 IonicContact OE2-NE 2.92Å; E868-R957 PolarHBondContact OE2-NE 3.29Å; E868-R957 IonicContact OE2-NH2 3.99Å; E868-R957 PolarHBondContact OE2-NH2 3.43Å; T954-R957 PolarHBondContact N-O 2.95Å; T954-R957 PolarHBondContact OG1-N 3.23Å; R957-F959 HydrophobicContact CB-CE1 4.43Å; R957-F959 HydrophobicContact CB-CE2 3.9Å; R957-F959 HydrophobicContact CB-CZ 3.77Å; R957-F959 HydrophobicContact CG-CZ 4.25Å
958	Q	87.4	Confident	87.1	Confident	124 Å²	124	48.4 Å²	48.4	58%	0.579	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.2	128.2	172.2	-61.5	-176.1	-38.8	0	0	109.1	L952	L952-Q958 WeakPolarHBondContact O-CA 3.41Å
959	F	89	Confident	87.1	Confident	25 Å²	25	48.7 Å²	48.7	11%	0.11	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128	-179.9	-54	-76.9	0	0	0	109.8	L862 L870 Q951 L952 T954 R957	L862-F959 HydrophobicContact CD2-CB 3.99Å; L862-F959 HydrophobicContact CD2-CD1 4.1Å; L862-F959 HydrophobicContact CD2-CD2 4.13Å; L862-F959 HydrophobicContact CD2-CG 3.81Å; L870-F959 HydrophobicContact CD2-CD2 4.41Å; L870-F959 HydrophobicContact CD2-CE2 4.18Å; Q951-F959 CarbonylContact C-O 3.53Å; Q951-F959 VanDerWaalsContact CA-O 3.31Å; Q951-F959 WeakPolarHBondContact CA-O 3.47Å; L952-F959 HydrophobicContact CB-CB 4.5Å; L952-F959 PolarHBondContact N-O 3.27Å; L952-F959 PolarHBondContact O-N 2.92Å; T954-F959 HydrophobicContact CG2-CE2 4.29Å; R957-F959 HydrophobicContact CB-CE1 4.43Å; R957-F959 HydrophobicContact CB-CE2 3.9Å; R957-F959 HydrophobicContact CB-CZ 3.77Å; R957-F959 HydrophobicContact CG-CZ 4.25Å
960	Y	87.8	Confident	87.1	Confident	157 Å²	157	45.3 Å²	45.3	62%	0.616	22%	0.221	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	125.4	177.6	-76.2	-101.9	0	0	0	109.8	Q951	Q951-Y960 HydrophobicContact CG-CD1 3.86Å; Q951-Y960 HydrophobicContact CG-CD2 4.36Å; Q951-Y960 HydrophobicContact CG-CE1 3.71Å; Q951-Y960 HydrophobicContact CG-CE2 4.2Å; Q951-Y960 HydrophobicContact CG-CG 4.2Å; Q951-Y960 PolarHBondContact OE1-OH 2.96Å
961	V	89.4	Confident	87	Confident	11 Å²	11	45.3 Å²	45.3	7%	0.067	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	157.7	-176.4	-66.8	0	0	0	0	111.3	L861 F950 L952	L861-V961 HydrophobicContact CD1-CB 3.97Å; L861-V961 HydrophobicContact CD2-CB 4.3Å; L861-V961 HydrophobicContact CD2-CG2 4.36Å; L861-V961 HydrophobicContact CG-CB 3.92Å; L861-V961 HydrophobicContact CG-CG1 4Å; F950-V961 HydrophobicContact CD1-CG2 4.24Å; F950-V961 HydrophobicContact CD2-CG2 3.64Å; F950-V961 HydrophobicContact CE1-CG2 4Å; F950-V961 HydrophobicContact CE2-CG2 3.38Å; F950-V961 HydrophobicContact CG-CG2 4.07Å; F950-V961 HydrophobicContact CZ-CG2 3.57Å; F950-V961 PolarHBondContact N-O 2.7Å; F950-V961 PolarHBondContact O-N 3.33Å; F950-V961 VanDerWaalsContact O-O 3.11Å; L952-V961 HydrophobicContact CD1-CG1 4.11Å; L952-V961 HydrophobicContact CD1-CG2 4.1Å; L952-V961 HydrophobicContact CG-CG2 3.95Å
962	S	89.4	Confident	87	Confident	53 Å²	53	46.4 Å²	46.4	37%	0.371	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	128.9	-174.6	-163.6	0	0	0	0	110.1	L861 A947 A948 N949	L861-S962 WeakPolarHBondContact CD1-O 3.42Å; A947-S962 VanDerWaalsContact CB-OG 3.31Å; A947-S962 WeakPolarHBondContact CB-OG 3.26Å; A948-S962 WeakPolarHBondContact O-CA 3.08Å; N949-S962 VanDerWaalsContact OD1-CB 3.32Å; N949-S962 WeakPolarHBondContact OD1-CB 3.47Å; N949-S962 PolarHBondContact OD1-OG 3.01Å
963	I	90.1	Very high	87	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	123.1	175.3	-68.4	176.6	0	0	0	108.9	L861 Y874 F876 I890 I939 F941 A947 A948 F950	L861-I963 HydrophobicContact CD1-CD1 4.34Å; L861-I963 HydrophobicContact CD1-CG1 3.64Å; L861-I963 HydrophobicContact CD2-CD1 4.19Å; L861-I963 HydrophobicContact CD2-CG1 4.38Å; Y874-I963 HydrophobicContact CD2-CD1 3.98Å; Y874-I963 HydrophobicContact CD2-CG1 4.19Å; Y874-I963 HydrophobicContact CD2-CG2 4.18Å; Y874-I963 HydrophobicContact CE1-CG1 4.48Å; Y874-I963 HydrophobicContact CE2-CB 4.32Å; Y874-I963 HydrophobicContact CE2-CD1 4.28Å; Y874-I963 HydrophobicContact CE2-CG1 4.02Å; Y874-I963 HydrophobicContact CE2-CG2 3.53Å; Y874-I963 HydrophobicContact CG-CD1 4.26Å; Y874-I963 HydrophobicContact CG-CG1 4.49Å; F876-I963 HydrophobicContact CE1-CG2 4.37Å; F876-I963 HydrophobicContact CZ-CG2 3.97Å; I890-I963 HydrophobicContact CD1-CD1 4.37Å; I890-I963 HydrophobicContact CD1-CG2 3.97Å; I890-I963 HydrophobicContact CG2-CD1 4.49Å; I939-I963 HydrophobicContact CD1-CB 4.46Å; I939-I963 HydrophobicContact CD1-CD1 4.34Å; I939-I963 HydrophobicContact CD1-CG2 4.47Å; F941-I963 HydrophobicContact CZ-CG2 4.2Å; A947-I963 CarbonylContact C-O 3.56Å; A947-I963 VanDerWaalsContact CA-O 3.26Å; A947-I963 WeakPolarHBondContact CA-O 3.24Å; A948-I963 PolarHBondContact N-O 3.43Å; A948-I963 PolarHBondContact O-N 3.07Å; F950-I963 HydrophobicContact CE1-CB 4.49Å; F950-I963 HydrophobicContact CE1-CD1 3.82Å; F950-I963 HydrophobicContact CE1-CG1 3.98Å; F950-I963 HydrophobicContact CZ-CD1 3.83Å; F950-I963 HydrophobicContact CZ-CG1 4.31Å
964	Q	88.6	Confident	87	Confident	116 Å²	116	50.2 Å²	50.2	54%	0.542	26%	0.256	S	S	.	.			trans	-109.8	129	174.3	-166.6	174.9	7.8	0	0	110.5	T945 A947	T945-Q964 PolarHBondContact O-NE2 3.47Å; A947-Q964 HydrophobicContact CB-CB 3.89Å; A947-Q964 HydrophobicContact CB-CG 4.22Å
965	P	88.3	Confident	86.8	Confident	7 Å²	7	52.9 Å²	52.9	5%	0.045	27%	0.267	C	S	.	.			trans	-82.8	131.4	-179.7	33.2	-33.8	0	0	0	111.5	F876 F941 L970	F876-P965 HydrophobicContact CE1-CB 4.44Å; F876-P965 HydrophobicContact CZ-CB 4.46Å; F941-P965 HydrophobicContact CB-CG 4.44Å; F941-P965 HydrophobicContact CD1-CB 4.47Å; F941-P965 HydrophobicContact CD1-CG 3.66Å; F941-P965 HydrophobicContact CD2-CB 4.14Å; F941-P965 HydrophobicContact CD2-CG 4.1Å; F941-P965 HydrophobicContact CE1-CB 4.32Å; F941-P965 HydrophobicContact CE1-CG 3.78Å; F941-P965 HydrophobicContact CE2-CB 3.98Å; F941-P965 HydrophobicContact CE2-CG 4.2Å; F941-P965 HydrophobicContact CG-CB 4.38Å; F941-P965 HydrophobicContact CG-CG 3.83Å; F941-P965 HydrophobicContact CZ-CB 4.06Å; F941-P965 HydrophobicContact CZ-CG 4.05Å; P965-L970 HydrophobicContact CB-CD1 4.46Å; P965-L970 HydrophobicContact CB-CD2 3.68Å; P965-L970 HydrophobicContact CB-CG 4.01Å; P965-L970 HydrophobicContact CG-CD1 4.2Å; P965-L970 HydrophobicContact CG-CD2 3.88Å; P965-L970 HydrophobicContact CG-CG 4.25Å
966	P	86.9	Confident	87	Confident	36 Å²	36	48.1 Å²	48.1	23%	0.234	25%	0.245	C	C	.	.			trans	-62.3	151.4	158.1	-14	27.6	0	0	0	110.2	I856 F876 G968 E969	I856-P966 HydrophobicContact CD1-CG 4.36Å; F876-P966 HydrophobicContact CE2-CG 4.33Å; P966-G968 VanDerWaalsContact C-N 3.27Å; P966-G968 PolarHBondContact O-N 3.26Å; P966-E969 HydrophobicContact CB-CG 4.1Å; P966-E969 HydrophobicContact CG-CG 3.84Å; P966-E969 PolarHBondContact O-N 2.94Å
967	V	87.4	Confident	87.5	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.024	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-62	-36.7	-175	-168.4	0	0	0	0	112.1	T945 E969 L970 M971 I1067 M1070 L1071 D1074	T945-V967 HydrophobicContact CG2-CG2 4.2Å; V967-E969 VanDerWaalsContact C-N 3.26Å; V967-E969 PolarHBondContact O-N 3.41Å; V967-L970 WeakPolarHBondContact O-CB 3.31Å; V967-L970 PolarHBondContact O-N 3.37Å; V967-L970 VanDerWaalsContact O-N 3.15Å; V967-M971 HydrophobicContact CG1-CE 4.22Å; V967-I1067 HydrophobicContact CG1-CB 4.23Å; V967-I1067 HydrophobicContact CG1-CG1 4.22Å; V967-I1067 HydrophobicContact CG1-CG2 3.74Å; V967-M1070 HydrophobicContact CG2-CB 3.43Å; V967-M1070 VanDerWaalsContact CG2-CB 3.43Å; V967-L1071 HydrophobicContact CB-CD1 4.29Å; V967-L1071 HydrophobicContact CG1-CB 4.13Å; V967-L1071 HydrophobicContact CG1-CD1 4.28Å; V967-D1074 WeakPolarHBondContact CG2-OD2 3.46Å
968	G	86.1	Confident	87.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-61.5	-28.4	176.5	0	0	0	0	0	114.5	P966 L970 M971 N1019	P966-G968 VanDerWaalsContact C-N 3.27Å; P966-G968 PolarHBondContact O-N 3.26Å; G968-L970 VanDerWaalsContact C-N 3.29Å; G968-L970 PolarHBondContact O-N 2.93Å; G968-M971 PolarHBondContact O-N 2.89Å; G968-N1019 WeakPolarHBondContact O-CB 3.4Å
969	E	88.1	Confident	87.6	Confident	5 Å²	5	39.7 Å²	39.7	2%	0.023	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-81.3	-10.5	179.2	-51	-61.6	160.6	0	0	112.5	F876 R878 P966 V967 M971	F876-E969 HydrophobicContact CB-CB 4.26Å; F876-E969 HydrophobicContact CB-CG 3.89Å; F876-E969 VanDerWaalsContact CB-OE2 3.29Å; F876-E969 WeakPolarHBondContact CB-OE2 3.42Å; F876-E969 HydrophobicContact CD1-CB 3.93Å; F876-E969 HydrophobicContact CD1-CG 4.16Å; F876-E969 HydrophobicContact CD2-CB 4.45Å; F876-E969 HydrophobicContact CD2-CG 3.8Å; F876-E969 HydrophobicContact CE1-CB 4.39Å; F876-E969 HydrophobicContact CE2-CG 4.38Å; F876-E969 HydrophobicContact CG-CB 3.96Å; F876-E969 HydrophobicContact CG-CG 3.68Å; R878-E969 WeakPolarHBondContact CG-OE2 3.26Å; R878-E969 IonicContact CZ-OE1 3.38Å; R878-E969 VanDerWaalsContact CZ-OE1 3.25Å; R878-E969 IonicContact NE-OE1 3.22Å; R878-E969 PolarHBondContact NE-OE1 2.94Å; R878-E969 IonicContact NE-OE2 2.74Å; R878-E969 PolarHBondContact NE-OE2 3.07Å; R878-E969 VanDerWaalsContact NE-OE2 3.08Å; R878-E969 IonicContact NH2-OE1 3.57Å; R878-E969 PolarHBondContact NH2-OE1 3.47Å; P966-E969 HydrophobicContact CB-CG 4.1Å; P966-E969 HydrophobicContact CG-CG 3.84Å; P966-E969 PolarHBondContact O-N 2.94Å; V967-E969 VanDerWaalsContact C-N 3.26Å; V967-E969 PolarHBondContact O-N 3.41Å; E969-M971 VanDerWaalsContact C-N 3.34Å
970	L	89.3	Confident	87.4	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.021	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-88.2	-1.2	172.6	-60.1	-179	0	0	0	113	V888 F941 T945 P965 V967 G968 T1037 L1038	V888-L970 HydrophobicContact CG2-CD2 4.15Å; F941-L970 HydrophobicContact CB-CD2 3.74Å; F941-L970 HydrophobicContact CD2-CD2 3.71Å; F941-L970 HydrophobicContact CG-CD2 3.97Å; T945-L970 HydrophobicContact CG2-CD1 4.43Å; P965-L970 HydrophobicContact CB-CD1 4.46Å; P965-L970 HydrophobicContact CB-CD2 3.68Å; P965-L970 HydrophobicContact CB-CG 4.01Å; P965-L970 HydrophobicContact CG-CD1 4.2Å; P965-L970 HydrophobicContact CG-CD2 3.88Å; P965-L970 HydrophobicContact CG-CG 4.25Å; V967-L970 WeakPolarHBondContact O-CB 3.31Å; V967-L970 PolarHBondContact O-N 3.37Å; V967-L970 VanDerWaalsContact O-N 3.15Å; G968-L970 VanDerWaalsContact C-N 3.29Å; G968-L970 PolarHBondContact O-N 2.93Å; L970-T1037 WeakPolarHBondContact O-CA 3.16Å; L970-L1038 PolarHBondContact O-N 2.89Å
971	M	88.3	Confident	87.5	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	148.6	-171.4	-61.4	-172.6	-66.3	0	0	112.4	V967 G968 E969 A1018 N1019 L1020 R1036 T1037 V1044 I1067 L1071	V967-M971 HydrophobicContact CG1-CE 4.22Å; G968-M971 PolarHBondContact O-N 2.89Å; E969-M971 VanDerWaalsContact C-N 3.34Å; M971-A1018 VanDerWaalsContact CE-O 3.23Å; M971-A1018 WeakPolarHBondContact CE-O 3.4Å; M971-N1019 PolarHBondContact O-ND2 3.38Å; M971-L1020 HydrophobicContact CE-CD2 4.04Å; M971-L1020 HydrophobicContact SD-CD2 4.12Å; M971-R1036 CarbonylContact C-O 3.54Å; M971-R1036 VanDerWaalsContact CA-O 3.28Å; M971-R1036 WeakPolarHBondContact CA-O 3.48Å; M971-T1037 HydrophobicContact CG-CG2 4.47Å; M971-V1044 HydrophobicContact SD-CB 3.92Å; M971-V1044 HydrophobicContact SD-CG1 3.94Å; M971-V1044 HydrophobicContact SD-CG2 3.7Å; M971-I1067 HydrophobicContact SD-CG2 4.34Å; M971-L1071 HydrophobicContact CE-CD1 3.69Å; M971-L1071 HydrophobicContact CE-CD2 3.77Å; M971-L1071 HydrophobicContact CE-CG 4.36Å; M971-L1071 HydrophobicContact SD-CD2 4.34Å
972	A	87.9	Confident	87.4	Confident	36 Å²	36	38.2 Å²	38.2	30%	0.298	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	143.3	168.9	0	0	0	0	0	110.5	G1035 R1036 L1038	A972-G1035 CarbonylContact O-C 3.49Å; A972-G1035 WeakPolarHBondContact O-CA 3.38Å; A972-R1036 PolarHBondContact N-O 3.2Å; A972-R1036 PolarHBondContact O-N 2.94Å; A972-L1038 HydrophobicContact CB-CD2 4.05Å
973	P	89.3	Confident	87.4	Confident	54 Å²	54	42.3 Å²	42.3	35%	0.351	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	139.1	177.7	27.6	-34.5	0	0	0	110.8	F975 N1019	P973-F975 HydrophobicContact CB-CE2 4.44Å; P973-N1019 WeakPolarHBondContact CA-O 3.41Å; P973-N1019 WeakPolarHBondContact CB-O 3.42Å; P973-N1019 WeakPolarHBondContact CD-O 3.28Å
974	V	86.8	Confident	87.3	Confident	30 Å²	30	44.7 Å²	44.7	18%	0.182	23%	0.229	C	C	.	.			trans	-126.4	132.1	175.4	173.3	0	0	0	0	109	M976 A1034 R1036	V974-M976 HydrophobicContact CG1-CE 4.09Å; V974-A1034 PolarHBondContact N-O 2.91Å; V974-A1034 WeakPolarHBondContact O-CB 3.31Å; V974-R1036 HydrophobicContact CG2-CB 4.11Å; V974-R1036 HydrophobicContact CG2-CG 3.82Å
975	F	83.2	Confident	87.2	Confident	71 Å²	71	41 Å²	41	31%	0.311	21%	0.212	S	C	.	.			trans	-99.4	139.9	179.1	-64.9	-116.7	0	0	0	108.4	P847 L850 P973	P847-F975 HydrophobicContact CB-CB 3.89Å; P847-F975 HydrophobicContact CB-CD1 3.69Å; P847-F975 HydrophobicContact CB-CD2 3.55Å; P847-F975 HydrophobicContact CB-CE1 4Å; P847-F975 HydrophobicContact CB-CE2 3.88Å; P847-F975 HydrophobicContact CB-CG 3.45Å; P847-F975 VanDerWaalsContact CB-CG 3.45Å; P847-F975 HydrophobicContact CB-CZ 4.08Å; P847-F975 HydrophobicContact CG-CB 3.91Å; P847-F975 HydrophobicContact CG-CD1 4.4Å; P847-F975 HydrophobicContact CG-CD2 3.36Å; P847-F975 HydrophobicContact CG-CE2 3.88Å; P847-F975 HydrophobicContact CG-CG 3.66Å; L850-F975 HydrophobicContact CD1-CZ 4.07Å; L850-F975 HydrophobicContact CG-CZ 4.3Å; P973-F975 HydrophobicContact CB-CE2 4.44Å
976	M	84.1	Confident	87.1	Confident	27 Å²	27	43 Å²	43	13%	0.133	23%	0.234	C	C	.	.			trans	-159.3	159.4	-177.6	57.6	178.3	60.7	0	0	109.7	V974 E980 F981 V1023 A1034 L1043 L1045	V974-M976 HydrophobicContact CG1-CE 4.09Å; M976-E980 HydrophobicContact CB-CB 4.18Å; M976-F981 HydrophobicContact CG-CB 4.38Å; M976-F981 HydrophobicContact SD-CB 3.87Å; M976-F981 HydrophobicContact SD-CD2 3.9Å; M976-F981 HydrophobicContact SD-CG 4.35Å; M976-V1023 HydrophobicContact CG-CG2 3.74Å; M976-A1034 HydrophobicContact CE-CB 3.77Å; M976-A1034 HydrophobicContact CG-CB 4.18Å; M976-A1034 HydrophobicContact SD-CB 3.85Å; M976-L1043 HydrophobicContact CE-CD1 4.04Å; M976-L1045 HydrophobicContact CE-CD2 4.02Å; M976-L1045 HydrophobicContact SD-CD2 3.94Å
977	S	87.6	Confident	87.1	Confident	36 Å²	36	47.5 Å²	47.5	25%	0.252	25%	0.249	S	C	.	.			trans	-72.6	163	174.5	64.8	0	0	0	0	112.7	N979 E980 F981	S977-N979 PolarHBondContact O-N 3.45Å; S977-E980 WeakPolarHBondContact CB-OE2 3.2Å; S977-E980 PolarHBondContact N-OE2 2.84Å; S977-E980 PolarHBondContact O-N 2.99Å; S977-E980 WeakPolarHBondContact OG-CB 3.38Å; S977-E980 VanDerWaalsContact OG-CD 3.31Å; S977-E980 VanDerWaalsContact OG-CG 3.24Å; S977-E980 WeakPolarHBondContact OG-CG 3.3Å; S977-E980 PolarHBondContact OG-N 3.33Å; S977-E980 PolarHBondContact OG-OE2 3.49Å; S977-F981 PolarHBondContact O-N 2.86Å
978	E	86.5	Confident	86.9	Confident	51 Å²	51	47.8 Å²	47.8	24%	0.238	25%	0.251	C	S	.	.	H	α-helix	trans	-59.5	-34.8	175.1	-155.1	-169.7	131.6	0	0	112.3	K982 C1025 G1026 R1032	E978-K982 WeakPolarHBondContact O-CG 3.03Å; E978-K982 PolarHBondContact O-N 2.82Å; E978-K982 VanDerWaalsContact O-N 3.16Å; E978-K982 WeakPolarHBondContact OE1-CE 3.49Å; E978-K982 IonicContact OE1-NZ 3.44Å; E978-K982 PolarHBondContact OE1-NZ 2.94Å; E978-C1025 WeakPolarHBondContact OE2-CA 3.49Å; E978-G1026 PolarHBondContact OE2-N 3.45Å; E978-G1026 VanDerWaalsContact OE2-N 3.08Å; E978-R1032 IonicContact OE1-CZ 3.96Å; E978-R1032 IonicContact OE1-NH1 2.65Å; E978-R1032 PolarHBondContact OE1-NH1 2.98Å; E978-R1032 IonicContact OE2-NH1 3.87Å
979	N	85.4	Confident	86.7	Confident	109 Å²	109	51.8 Å²	51.8	58%	0.583	28%	0.275	S	S	*	.	H	α-helix	trans	-69.8	-44	178.2	-69.9	-24.7	0	0	0	111.9	S977 K983	S977-N979 PolarHBondContact O-N 3.45Å; N979-K983 WeakPolarHBondContact O-CB 3.16Å; N979-K983 PolarHBondContact O-N 3.28Å
980	E	85.6	Confident	86.5	Confident	66 Å²	66	54 Å²	54	31%	0.308	30%	0.3	S	S	.	.	H	α-helix	trans	-64.3	-43.9	174.8	-72.3	164.9	126	0	0	111.1	M976 S977 K982 K983 E984	M976-E980 HydrophobicContact CB-CB 4.18Å; S977-E980 WeakPolarHBondContact CB-OE2 3.2Å; S977-E980 PolarHBondContact N-OE2 2.84Å; S977-E980 PolarHBondContact O-N 2.99Å; S977-E980 WeakPolarHBondContact OG-CB 3.38Å; S977-E980 VanDerWaalsContact OG-CD 3.31Å; S977-E980 VanDerWaalsContact OG-CG 3.24Å; S977-E980 WeakPolarHBondContact OG-CG 3.3Å; S977-E980 PolarHBondContact OG-N 3.33Å; S977-E980 PolarHBondContact OG-OE2 3.49Å; E980-K982 PolarHBondContact O-N 2.87Å; E980-K983 WeakPolarHBondContact O-CB 3.44Å; E980-K983 PolarHBondContact O-N 2.85Å; E980-K983 VanDerWaalsContact O-N 3.17Å; E980-E984 WeakPolarHBondContact O-CG 3.37Å; E980-E984 PolarHBondContact O-N 2.97Å
981	F	89.8	Confident	86	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-54.9	-52	176.8	-175.5	-83.9	0	0	0	111.6	M976 S977 K983 E984 Q985 V1023 R1032 A1034 L1045 T1047	M976-F981 HydrophobicContact CG-CB 4.38Å; M976-F981 HydrophobicContact SD-CB 3.87Å; M976-F981 HydrophobicContact SD-CD2 3.9Å; M976-F981 HydrophobicContact SD-CG 4.35Å; S977-F981 PolarHBondContact O-N 2.86Å; F981-K983 VanDerWaalsContact C-N 3.33Å; F981-K983 PolarHBondContact O-N 2.84Å; F981-E984 PolarHBondContact O-N 3.24Å; F981-Q985 WeakPolarHBondContact O-CB 3.28Å; F981-Q985 PolarHBondContact O-N 3.04Å; F981-V1023 HydrophobicContact CB-CG1 4.17Å; F981-V1023 HydrophobicContact CD2-CB 4.45Å; F981-V1023 HydrophobicContact CD2-CG1 4.4Å; F981-V1023 HydrophobicContact CD2-CG2 3.96Å; F981-V1023 HydrophobicContact CG-CG1 4.45Å; F981-R1032 HydrophobicContact CD1-CG 4.24Å; F981-R1032 HydrophobicContact CD2-CB 4.37Å; F981-R1032 HydrophobicContact CE1-CB 4.13Å; F981-R1032 HydrophobicContact CE1-CG 3.75Å; F981-R1032 HydrophobicContact CE2-CB 3.97Å; F981-R1032 HydrophobicContact CE2-CG 4.48Å; F981-R1032 HydrophobicContact CZ-CB 3.84Å; F981-R1032 HydrophobicContact CZ-CG 3.87Å; F981-A1034 HydrophobicContact CD2-CB 4.46Å; F981-L1045 HydrophobicContact CD2-CD1 4.49Å; F981-L1045 HydrophobicContact CD2-CD2 3.88Å; F981-L1045 HydrophobicContact CE2-CB 3.81Å; F981-L1045 HydrophobicContact CE2-CD1 4.45Å; F981-L1045 HydrophobicContact CE2-CD2 3.85Å; F981-L1045 HydrophobicContact CE2-CG 4.24Å; F981-L1045 HydrophobicContact CZ-CB 3.99Å; F981-T1047 WeakPolarHBondContact CZ-OG1 3.25Å
982	K	87.4	Confident	85.9	Confident	96 Å²	96	64.3 Å²	64.3	42%	0.417	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-37.6	178.2	-72.2	173.5	-177.5	171.8	0	112.5	E978 E980 G986	E978-K982 WeakPolarHBondContact O-CG 3.03Å; E978-K982 PolarHBondContact O-N 2.82Å; E978-K982 VanDerWaalsContact O-N 3.16Å; E978-K982 WeakPolarHBondContact OE1-CE 3.49Å; E978-K982 IonicContact OE1-NZ 3.44Å; E978-K982 PolarHBondContact OE1-NZ 2.94Å; E980-K982 PolarHBondContact O-N 2.87Å; K982-G986 PolarHBondContact O-N 2.99Å
983	K	89.3	Confident	86	Confident	139 Å²	139	66.3 Å²	66.3	60%	0.604	35%	0.354	S	S	*	.	H	α-helix	trans	-67.8	-41.4	178.8	177.4	-175.2	176.6	-174.1	0	112.6	N979 E980 F981	N979-K983 WeakPolarHBondContact O-CB 3.16Å; N979-K983 PolarHBondContact O-N 3.28Å; E980-K983 WeakPolarHBondContact O-CB 3.44Å; E980-K983 PolarHBondContact O-N 2.85Å; E980-K983 VanDerWaalsContact O-N 3.17Å; F981-K983 VanDerWaalsContact C-N 3.33Å; F981-K983 PolarHBondContact O-N 2.84Å
984	E	87.4	Confident	86	Confident	50 Å²	50	65.4 Å²	65.4	23%	0.234	35%	0.346	C	S	.	.	H	α-helix	trans	-77.6	-38.7	177.1	-61	-52.1	124.6	0	0	111.5	E980 F981 G986 K987 L988 L1043 L1045	E980-E984 WeakPolarHBondContact O-CG 3.37Å; E980-E984 PolarHBondContact O-N 2.97Å; F981-E984 PolarHBondContact O-N 3.24Å; E984-G986 VanDerWaalsContact C-N 3.28Å; E984-G986 PolarHBondContact O-N 3.29Å; E984-K987 WeakPolarHBondContact O-CB 3.22Å; E984-K987 PolarHBondContact O-N 3.17Å; E984-K987 VanDerWaalsContact OE1-CE 3.29Å; E984-K987 WeakPolarHBondContact OE1-CE 3.4Å; E984-K987 IonicContact OE1-NZ 3.09Å; E984-K987 PolarHBondContact OE1-NZ 2.97Å; E984-K987 WeakPolarHBondContact OE2-CE 3.31Å; E984-K987 IonicContact OE2-NZ 2.76Å; E984-K987 PolarHBondContact OE2-NZ 2.91Å; E984-L988 PolarHBondContact O-N 2.87Å; E984-L1043 HydrophobicContact CB-CD2 3.73Å; E984-L1043 HydrophobicContact CG-CD2 4.21Å; E984-L1045 HydrophobicContact CB-CD1 4.14Å
985	Q	87.1	Confident	86.1	Confident	39 Å²	39	66.7 Å²	66.7	18%	0.182	36%	0.355	C	S	.	.	H	α-helix	trans	-56.3	-42.6	170.8	-177.7	169.7	50.7	0	0	111.4	F981 K987 L988 T989 L1045 T1047 N1061	F981-Q985 WeakPolarHBondContact O-CB 3.28Å; F981-Q985 PolarHBondContact O-N 3.04Å; Q985-K987 PolarHBondContact O-N 3.49Å; Q985-K987 VanDerWaalsContact O-N 3.15Å; Q985-L988 CarbonylContact O-C 3.46Å; Q985-L988 WeakPolarHBondContact O-CA 3.29Å; Q985-L988 PolarHBondContact O-N 3.42Å; Q985-T989 PolarHBondContact O-N 2.99Å; Q985-L1045 HydrophobicContact CB-CD1 3.91Å; Q985-T1047 PolarHBondContact NE2-OG1 2.89Å; Q985-N1061 PolarHBondContact NE2-OD1 3.43Å
986	G	86.5	Confident	86.4	Confident	49 Å²	49	67.6 Å²	67.6	51%	0.505	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-15.4	174.9	0	0	0	0	0	115.5	K982 E984	K982-G986 PolarHBondContact O-N 2.99Å; E984-G986 VanDerWaalsContact C-N 3.28Å; E984-G986 PolarHBondContact O-N 3.29Å
987	K	86.4	Confident	86.5	Confident	129 Å²	129	73.4 Å²	73.4	56%	0.561	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-22.6	169.5	-56.1	176.9	-164.1	167	0	112.7	E984 Q985	E984-K987 WeakPolarHBondContact O-CB 3.22Å; E984-K987 PolarHBondContact O-N 3.17Å; E984-K987 VanDerWaalsContact OE1-CE 3.29Å; E984-K987 WeakPolarHBondContact OE1-CE 3.4Å; E984-K987 IonicContact OE1-NZ 3.09Å; E984-K987 PolarHBondContact OE1-NZ 2.97Å; E984-K987 WeakPolarHBondContact OE2-CE 3.31Å; E984-K987 IonicContact OE2-NZ 2.76Å; E984-K987 PolarHBondContact OE2-NZ 2.91Å; Q985-K987 PolarHBondContact O-N 3.49Å; Q985-K987 VanDerWaalsContact O-N 3.15Å
988	L	83.1	Confident	86.3	Confident	11 Å²	11	72 Å²	72	6%	0.058	37%	0.374	C	S	.	.	S	Bend	trans	-107.7	22.6	-171.9	-61.1	176.4	0	0	0	112.8	E984 Q985 N992 L1043 L1045 N1061 E1063	E984-L988 PolarHBondContact O-N 2.87Å; Q985-L988 CarbonylContact O-C 3.46Å; Q985-L988 WeakPolarHBondContact O-CA 3.29Å; Q985-L988 PolarHBondContact O-N 3.42Å; L988-N992 HydrophobicContact CB-CB 4.39Å; L988-N992 HydrophobicContact CD2-CB 4.49Å; L988-N992 CarbonylContact O-C 3.54Å; L988-N992 WeakPolarHBondContact O-CB 3.24Å; L988-L1043 HydrophobicContact CD1-CB 4.34Å; L988-L1043 HydrophobicContact CD1-CD2 4.25Å; L988-L1045 HydrophobicContact CD1-CD1 4.47Å; L988-N1061 HydrophobicContact CB-CB 3.85Å; L988-N1061 PolarHBondContact O-ND2 3.03Å; L988-E1063 HydrophobicContact CD2-CG 3.7Å
989	T	82.3	Confident	85.9	Confident	83 Å²	83	74.7 Å²	74.7	51%	0.509	39%	0.394	S	S	.	.			trans	-75.1	158.5	173.4	52.4	0	0	0	0	112.8	Q985 E993	Q985-T989 PolarHBondContact O-N 2.99Å; T989-E993 WeakPolarHBondContact CA-OE2 3.49Å
990	G	82.6	Confident	85.4	Confident	52 Å²	52	71.2 Å²	71.2	54%	0.536	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	84.4	-113.4	169.9	0	0	0	0	0	113.3	N992 E993	G990-N992 PolarHBondContact O-N 3.39Å; G990-E993 PolarHBondContact N-OE2 3.17Å; G990-E993 WeakPolarHBondContact O-CB 3.32Å; G990-E993 PolarHBondContact O-N 3.19Å
991	M	79.1	Confident	84.8	Confident	172 Å²	172	70.1 Å²	70.1	85%	0.847	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-67.9	-18.6	-177.9	-73.1	-175.9	174.7	0	0	113.8
992	N	86	Confident	83.5	Confident	50 Å²	50	75.9 Å²	75.9	27%	0.267	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-95.9	8.2	177.9	-67.6	1.9	0	0	0	112.4	L988 G990 N1061 S1062	L988-N992 HydrophobicContact CB-CB 4.39Å; L988-N992 HydrophobicContact CD2-CB 4.49Å; L988-N992 CarbonylContact O-C 3.54Å; L988-N992 WeakPolarHBondContact O-CB 3.24Å; G990-N992 PolarHBondContact O-N 3.39Å; N992-N1061 CarbonylContact O-C 3.53Å; N992-N1061 VanDerWaalsContact O-CA 3.29Å; N992-N1061 WeakPolarHBondContact O-CA 3.45Å; N992-S1062 WeakPolarHBondContact CB-O 3.35Å; N992-S1062 PolarHBondContact O-N 2.99Å
993	E	89.7	Confident	82	Confident	78 Å²	78	76.9 Å²	76.9	36%	0.364	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.1	-172.5	-178.6	-179.8	172.2	0	0	110.6	T989 G990 T1059 N1061	T989-E993 WeakPolarHBondContact CA-OE2 3.49Å; G990-E993 PolarHBondContact N-OE2 3.17Å; G990-E993 WeakPolarHBondContact O-CB 3.32Å; G990-E993 PolarHBondContact O-N 3.19Å; E993-T1059 HydrophobicContact CG-CG2 3.91Å; E993-N1061 WeakPolarHBondContact CG-ND2 3.29Å
994	I	89.5	Confident	80.5	Confident	35 Å²	35	70.4 Å²	70.4	18%	0.179	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	122.1	-179.9	-59.6	173.6	0	0	0	107.9	T1059 V1060 T1069 V1072	I994-T1059 CarbonylContact O-C 3.43Å; I994-T1059 WeakPolarHBondContact O-CA 3.37Å; I994-V1060 PolarHBondContact N-O 3.27Å; I994-V1060 PolarHBondContact O-N 2.71Å; I994-T1069 WeakPolarHBondContact CD1-OG1 3.33Å; I994-V1072 HydrophobicContact CB-CG2 4.43Å; I994-V1072 HydrophobicContact CG2-CG2 3.99Å
995	T	89.4	Confident	79.4	Confident	58 Å²	58	75 Å²	75	36%	0.356	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	125.1	-176.8	-68.4	0	0	0	0	110.8	Q1057 L1058 T1059	T995-Q1057 HydrophobicContact CG2-CG 3.51Å; T995-L1058 WeakPolarHBondContact CA-O 3.33Å; T995-T1059 WeakPolarHBondContact OG1-CB 3.44Å; T995-T1059 WeakPolarHBondContact OG1-CG2 3.2Å; T995-T1059 PolarHBondContact OG1-OG1 2.71Å
996	E	88.6	Confident	78.6	Confident	89 Å²	89	77.6 Å²	77.6	42%	0.416	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	166.5	170.2	-76.9	-162.3	-168.2	0	0	111.6	L1058 V1072 I1076	E996-L1058 PolarHBondContact N-O 3.03Å; E996-L1058 PolarHBondContact O-N 3.33Å; E996-V1072 HydrophobicContact CB-CG1 3.95Å; E996-V1072 HydrophobicContact CG-CG1 4.03Å; E996-I1076 HydrophobicContact CB-CD1 3.77Å; E996-I1076 WeakPolarHBondContact OE2-CD1 3.27Å
997	K	86.8	Confident	77.9	Confident	149 Å²	149	78.7 Å²	78.7	65%	0.648	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.5	-177.3	-66.9	-178.1	179.7	-179.7	0	110.1	A1056	K997-A1056 WeakPolarHBondContact CA-O 3.22Å
998	L	83.8	Confident	77.4	Confident	7 Å²	7	78.5 Å²	78.5	4%	0.037	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	152.3	-176	67.5	92.1	0	0	0	111.3	L1000 L1048 P1055 A1056 L1058 I1076 L1079	L998-L1000 HydrophobicContact CD1-CD2 3.49Å; L998-L1000 VanDerWaalsContact CD1-CD2 3.49Å; L998-L1000 HydrophobicContact CD1-CG 3.61Å; L998-L1048 HydrophobicContact CD2-CD1 4.13Å; L998-P1055 CarbonylContact O-C 3.43Å; L998-A1056 HydrophobicContact CD1-CB 3.98Å; L998-A1056 HydrophobicContact CG-CB 4.23Å; L998-A1056 PolarHBondContact N-O 2.82Å; L998-A1056 PolarHBondContact O-N 2.93Å; L998-L1058 HydrophobicContact CD2-CB 3.82Å; L998-L1058 HydrophobicContact CD2-CD2 4.31Å; L998-I1076 HydrophobicContact CB-CG1 4.27Å; L998-I1076 HydrophobicContact CB-CG2 4.5Å; L998-I1076 HydrophobicContact CD2-CG1 3.73Å; L998-L1079 HydrophobicContact CD2-CD1 4.2Å
999	T	78.2	Confident	77.1	Confident	107 Å²	107	81.3 Å²	81.3	66%	0.656	43%	0.43	S	S	*	.			trans	-102.3	105.8	174.1	49.8	0	0	0	0	109.1	P1001	T999-P1001 WeakPolarHBondContact O-CD 3.17Å
1000	L	74.6	Confident	77	Confident	36 Å²	36	77.4 Å²	77.4	19%	0.188	41%	0.407	C	S	.	.			trans	-66.3	126.9	175.4	-70.3	172.5	0	0	0	110	L998 A1050 A1056 L1079	L998-L1000 HydrophobicContact CD1-CD2 3.49Å; L998-L1000 VanDerWaalsContact CD1-CD2 3.49Å; L998-L1000 HydrophobicContact CD1-CG 3.61Å; L1000-A1050 HydrophobicContact CD1-CB 3.97Å; L1000-A1056 HydrophobicContact CD1-CB 3.97Å; L1000-A1056 HydrophobicContact CG-CB 4.08Å; L1000-L1079 HydrophobicContact CD2-CB 4.14Å; L1000-L1079 HydrophobicContact CD2-CD1 4.41Å; L1000-L1079 HydrophobicContact CD2-CD2 4.36Å
1001	P	73.4	Confident	77	Confident	43 Å²	43	76.2 Å²	76.2	28%	0.279	39%	0.389	S	S	.	.			trans	-61.7	150.3	167.8	-21.3	33.6	0	0	0	111	T999 T1003 C1004 L1079	T999-P1001 WeakPolarHBondContact O-CD 3.17Å; P1001-T1003 PolarHBondContact O-N 3.14Å; P1001-T1003 VanDerWaalsContact O-N 3.12Å; P1001-C1004 WeakPolarHBondContact O-CA 3.3Å; P1001-C1004 PolarHBondContact O-N 3.02Å; P1001-L1079 VanDerWaalsContact CD-O 3.26Å; P1001-L1079 WeakPolarHBondContact CD-O 3.26Å
1002	D	62.5	Low	77.2	Confident	121 Å²	121	72.6 Å²	72.6	65%	0.647	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-62.9	-22.8	-178.7	-63.1	-47.8	0	0	0	113.2	C1004 R1005	D1002-C1004 VanDerWaalsContact C-N 3.25Å; D1002-C1004 PolarHBondContact O-N 2.89Å; D1002-R1005 PolarHBondContact O-N 3.04Å; D1002-R1005 IonicContact OD1-CZ 2.68Å; D1002-R1005 IonicContact OD1-NE 3.78Å; D1002-R1005 PolarHBondContact OD1-NE 2.98Å; D1002-R1005 IonicContact OD1-NH2 3.43Å; D1002-R1005 PolarHBondContact OD1-NH2 3.15Å; D1002-R1005 VanDerWaalsContact OD1-NH2 3.09Å
1003	T	56.6	Low	77	Confident	117 Å²	117	72.3 Å²	72.3	72%	0.718	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-66.7	-22.6	170.4	51.4	0	0	0	0	113.8	P1001	P1001-T1003 PolarHBondContact O-N 3.14Å; P1001-T1003 VanDerWaalsContact O-N 3.12Å
1004	C	57.5	Low	76.7	Confident	4 Å²	4	68.6 Å²	68.6	3%	0.027	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-99.6	10.8	-179.3	-64	0	0	0	0	113.2	P1001 D1002 N1006 V1010 K1013	P1001-C1004 WeakPolarHBondContact O-CA 3.3Å; P1001-C1004 PolarHBondContact O-N 3.02Å; D1002-C1004 VanDerWaalsContact C-N 3.25Å; D1002-C1004 PolarHBondContact O-N 2.89Å; C1004-N1006 VanDerWaalsContact C-N 3.26Å; C1004-N1006 PolarHBondContact O-N 3.35Å; C1004-V1010 WeakPolarHBondContact O-CG2 3.2Å; C1004-K1013 PolarHBondContact SG-NZ 3.32Å
1005	R	63	Low	76.5	Confident	146 Å²	146	67.9 Å²	67.9	55%	0.551	35%	0.346	S	S	*	.			trans	-79.6	3.5	176	-71.7	-176.7	-176	-111	5	115.2	D1002	D1002-R1005 PolarHBondContact O-N 3.04Å; D1002-R1005 IonicContact OD1-CZ 2.68Å; D1002-R1005 IonicContact OD1-NE 3.78Å; D1002-R1005 PolarHBondContact OD1-NE 2.98Å; D1002-R1005 IonicContact OD1-NH2 3.43Å; D1002-R1005 PolarHBondContact OD1-NH2 3.15Å; D1002-R1005 VanDerWaalsContact OD1-NH2 3.09Å
1006	N	70.9	Confident	76.2	Confident	93 Å²	93	66.6 Å²	66.6	50%	0.497	34%	0.342	S	S	.	.	S	Bend	trans	-96.3	123.5	176.8	179.1	-22.3	0	0	0	109.5	C1004 H1008 M1009 V1010	C1004-N1006 VanDerWaalsContact C-N 3.26Å; C1004-N1006 PolarHBondContact O-N 3.35Å; N1006-H1008 PolarHBondContact O-N 3.04Å; N1006-H1008 VanDerWaalsContact O-N 3.08Å; N1006-H1008 PolarHBondContact OD1-N 3.1Å; N1006-H1008 VanDerWaalsContact OD1-N 3.09Å; N1006-M1009 HydrophobicContact CB-CB 4.48Å; N1006-M1009 HydrophobicContact CB-CG 4.25Å; N1006-M1009 WeakPolarHBondContact O-CA 3.43Å; N1006-M1009 WeakPolarHBondContact O-CB 3.47Å; N1006-M1009 PolarHBondContact O-N 2.88Å; N1006-V1010 PolarHBondContact O-N 3.41Å; N1006-V1010 VanDerWaalsContact O-N 3.15Å
1007	D	71.6	Confident	76	Confident	73 Å²	73	64 Å²	64	39%	0.39	33%	0.332	S	S	.	.	H	α-helix	trans	-43.2	-44.8	179.7	-58.2	44.2	0	0	0	113.3	M1009 V1010 V1011 Y1031	D1007-M1009 VanDerWaalsContact C-N 3.31Å; D1007-M1009 PolarHBondContact O-N 3.34Å; D1007-V1010 PolarHBondContact O-N 2.96Å; D1007-V1011 WeakPolarHBondContact O-CB 3.24Å; D1007-V1011 WeakPolarHBondContact O-CG2 3.48Å; D1007-V1011 PolarHBondContact O-N 3.42Å; D1007-Y1031 WeakPolarHBondContact CA-OH 3.11Å; D1007-Y1031 HydrophobicContact CB-CE1 4.07Å; D1007-Y1031 PolarHBondContact OD1-OH 3.31Å; D1007-Y1031 PolarHBondContact OD2-OH 3.48Å
1008	H	76.3	Confident	75.8	Confident	124 Å²	124	57 Å²	57	57%	0.574	30%	0.301	S	S	*	.	H	α-helix	trans	-64.5	-36.8	-178.7	-170.7	-69.3	0	0	0	111.6	N1006 Q1012	N1006-H1008 PolarHBondContact O-N 3.04Å; N1006-H1008 VanDerWaalsContact O-N 3.08Å; N1006-H1008 PolarHBondContact OD1-N 3.1Å; N1006-H1008 VanDerWaalsContact OD1-N 3.09Å; H1008-Q1012 PolarHBondContact CE1-OE1 3.33Å; H1008-Q1012 PolarHBondContact ND1-OE1 3.08Å; H1008-Q1012 WeakPolarHBondContact O-CB 3.39Å; H1008-Q1012 PolarHBondContact O-N 3.02Å
1009	M	77.1	Confident	76	Confident	70 Å²	70	57.6 Å²	57.6	35%	0.345	31%	0.305	S	S	.	.	H	α-helix	trans	-73.9	-38.5	179.2	-66.8	-89.9	67.2	0	0	111.8	N1006 D1007 Q1012 K1013	N1006-M1009 HydrophobicContact CB-CB 4.48Å; N1006-M1009 HydrophobicContact CB-CG 4.25Å; N1006-M1009 WeakPolarHBondContact O-CA 3.43Å; N1006-M1009 WeakPolarHBondContact O-CB 3.47Å; N1006-M1009 PolarHBondContact O-N 2.88Å; D1007-M1009 VanDerWaalsContact C-N 3.31Å; D1007-M1009 PolarHBondContact O-N 3.34Å; M1009-Q1012 HydrophobicContact CE-CB 4.48Å; M1009-K1013 VanDerWaalsContact O-CB 3.3Å; M1009-K1013 WeakPolarHBondContact O-CB 3.45Å; M1009-K1013 WeakPolarHBondContact O-CG 3.42Å; M1009-K1013 PolarHBondContact O-N 2.97Å
1010	V	80	Confident	76.4	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-53	173.7	179.8	0	0	0	0	110	C1004 N1006 D1007 K1013 V1014 Y1031 L1048	C1004-V1010 WeakPolarHBondContact O-CG2 3.2Å; N1006-V1010 PolarHBondContact O-N 3.41Å; N1006-V1010 VanDerWaalsContact O-N 3.15Å; D1007-V1010 PolarHBondContact O-N 2.96Å; V1010-K1013 PolarHBondContact O-N 3.31Å; V1010-V1014 HydrophobicContact CG1-CG2 4.44Å; V1010-V1014 WeakPolarHBondContact O-CG2 3.48Å; V1010-V1014 PolarHBondContact O-N 2.99Å; V1010-Y1031 HydrophobicContact CB-CD1 4.41Å; V1010-Y1031 HydrophobicContact CB-CE1 4.16Å; V1010-Y1031 HydrophobicContact CG1-CD1 4.01Å; V1010-Y1031 HydrophobicContact CG1-CD2 4.37Å; V1010-Y1031 HydrophobicContact CG1-CE1 4.21Å; V1010-Y1031 HydrophobicContact CG1-CG 4.11Å; V1010-L1048 HydrophobicContact CG1-CD2 3.66Å
1011	V	82.7	Confident	77	Confident	27 Å²	27	50.9 Å²	50.9	16%	0.164	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-46.4	-179.3	172.4	0	0	0	0	111.3	D1007 K1013 V1014 T1015 Y1031 F1033	D1007-V1011 WeakPolarHBondContact O-CB 3.24Å; D1007-V1011 WeakPolarHBondContact O-CG2 3.48Å; D1007-V1011 PolarHBondContact O-N 3.42Å; V1011-K1013 PolarHBondContact O-N 3.06Å; V1011-V1014 PolarHBondContact O-N 3.03Å; V1011-T1015 WeakPolarHBondContact O-CB 3.45Å; V1011-T1015 PolarHBondContact O-N 2.93Å; V1011-T1015 PolarHBondContact O-OG1 2.86Å; V1011-Y1031 HydrophobicContact CG2-CD1 3.97Å; V1011-Y1031 HydrophobicContact CG2-CE1 4.24Å; V1011-F1033 HydrophobicContact CB-CE1 4.47Å; V1011-F1033 HydrophobicContact CG1-CE1 4.29Å; V1011-F1033 HydrophobicContact CG2-CE1 4.32Å; V1011-F1033 HydrophobicContact CG2-CZ 4.1Å
1012	Q	82.4	Confident	77.7	Confident	95 Å²	95	53.9 Å²	53.9	44%	0.444	27%	0.271	S	S	.	.	H	α-helix	trans	-61.1	-43.8	178.6	-176.1	175.8	-1.6	0	0	111.9	H1008 M1009 A1016	H1008-Q1012 PolarHBondContact CE1-OE1 3.33Å; H1008-Q1012 PolarHBondContact ND1-OE1 3.08Å; H1008-Q1012 WeakPolarHBondContact O-CB 3.39Å; H1008-Q1012 PolarHBondContact O-N 3.02Å; M1009-Q1012 HydrophobicContact CE-CB 4.48Å; Q1012-A1016 WeakPolarHBondContact O-CB 3.39Å; Q1012-A1016 PolarHBondContact O-N 2.94Å
1013	K	81.8	Confident	78.8	Confident	44 Å²	44	48.2 Å²	48.2	19%	0.191	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-47.7	177.4	-78.8	178.2	155.8	-155.1	0	112.4	C1004 M1009 V1010 V1011 A1016 T1017 A1078 L1079 Q1081	C1004-K1013 PolarHBondContact SG-NZ 3.32Å; M1009-K1013 VanDerWaalsContact O-CB 3.3Å; M1009-K1013 WeakPolarHBondContact O-CB 3.45Å; M1009-K1013 WeakPolarHBondContact O-CG 3.42Å; M1009-K1013 PolarHBondContact O-N 2.97Å; V1010-K1013 PolarHBondContact O-N 3.31Å; V1011-K1013 PolarHBondContact O-N 3.06Å; K1013-A1016 PolarHBondContact O-N 2.68Å; K1013-T1017 PolarHBondContact O-N 3.36Å; K1013-T1017 PolarHBondContact O-OG1 3.35Å; K1013-A1078 WeakPolarHBondContact CD-O 3.13Å; K1013-A1078 VanDerWaalsContact CE-O 3.29Å; K1013-A1078 WeakPolarHBondContact CE-O 3.45Å; K1013-A1078 PolarHBondContact NZ-O 2.95Å; K1013-L1079 HydrophobicContact CB-CD2 4.27Å; K1013-L1079 HydrophobicContact CD-CD2 4.34Å; K1013-Q1081 PolarHBondContact NZ-OXT 2.89Å
1014	V	84.9	Confident	79.9	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-64.8	-45.4	-179.3	175.9	0	0	0	0	110.8	V1010 V1011 T1017 A1018 F1033 L1046 V1075 L1079	V1010-V1014 HydrophobicContact CG1-CG2 4.44Å; V1010-V1014 WeakPolarHBondContact O-CG2 3.48Å; V1010-V1014 PolarHBondContact O-N 2.99Å; V1011-V1014 PolarHBondContact O-N 3.03Å; V1014-T1017 PolarHBondContact O-N 3.25Å; V1014-A1018 HydrophobicContact CG1-CB 4.45Å; V1014-A1018 WeakPolarHBondContact O-CA 3.45Å; V1014-A1018 WeakPolarHBondContact O-CB 3.47Å; V1014-A1018 PolarHBondContact O-N 2.88Å; V1014-F1033 HydrophobicContact CB-CD1 4.47Å; V1014-F1033 HydrophobicContact CB-CE1 3.9Å; V1014-F1033 HydrophobicContact CB-CE2 4.07Å; V1014-F1033 HydrophobicContact CB-CZ 3.67Å; V1014-F1033 HydrophobicContact CG1-CD1 3.87Å; V1014-F1033 HydrophobicContact CG1-CD2 3.84Å; V1014-F1033 HydrophobicContact CG1-CE1 3.79Å; V1014-F1033 HydrophobicContact CG1-CE2 3.75Å; V1014-F1033 HydrophobicContact CG1-CG 3.9Å; V1014-F1033 HydrophobicContact CG1-CZ 3.73Å; V1014-F1033 HydrophobicContact CG2-CE2 4.23Å; V1014-F1033 HydrophobicContact CG2-CZ 4.12Å; V1014-L1046 HydrophobicContact CG1-CD1 4.44Å; V1014-L1046 HydrophobicContact CG1-CD2 4.18Å; V1014-V1075 HydrophobicContact CG2-CG1 4.15Å; V1014-L1079 HydrophobicContact CG2-CD1 4.33Å; V1014-L1079 HydrophobicContact CG2-CD2 4.26Å
1015	T	85	Confident	80.7	Confident	19 Å²	19	46.8 Å²	46.8	12%	0.117	23%	0.234	C	C	.	.	H	α-helix	trans	-67.5	-36	176.2	-62	0	0	0	0	112	V853 R878 V1011 N1019 L1020	V853-T1015 HydrophobicContact CG2-CG2 4.05Å; R878-T1015 PolarHBondContact NH1-O 3.09Å; V1011-T1015 WeakPolarHBondContact O-CB 3.45Å; V1011-T1015 PolarHBondContact O-N 2.93Å; V1011-T1015 PolarHBondContact O-OG1 2.86Å; T1015-N1019 WeakPolarHBondContact O-CA 3.25Å; T1015-N1019 PolarHBondContact O-N 3.27Å; T1015-L1020 PolarHBondContact OG1-O 2.95Å
1016	A	82.6	Confident	80.6	Confident	32 Å²	32	43.4 Å²	43.4	26%	0.264	24%	0.244	S	C	.	.	H	α-helix	trans	-63.5	-42.5	174.1	0	0	0	0	0	112.6	V853 R878 Q1012 K1013	V853-A1016 HydrophobicContact CG1-CB 4.01Å; R878-A1016 VanDerWaalsContact CZ-O 3.24Å; R878-A1016 PolarHBondContact NH1-O 3.49Å; R878-A1016 PolarHBondContact NH2-O 3.31Å; Q1012-A1016 WeakPolarHBondContact O-CB 3.39Å; Q1012-A1016 PolarHBondContact O-N 2.94Å; K1013-A1016 PolarHBondContact O-N 2.68Å
1017	T	83.6	Confident	80.4	Confident	35 Å²	35	42.6 Å²	42.6	22%	0.215	24%	0.243	C	C	.	.	H	α-helix	trans	-82.3	-40.1	-178.9	-64	0	0	0	0	113.4	K1013 V1014 D1074 V1075 A1078	K1013-T1017 PolarHBondContact O-N 3.36Å; K1013-T1017 PolarHBondContact O-OG1 3.35Å; V1014-T1017 PolarHBondContact O-N 3.25Å; T1017-D1074 HydrophobicContact CG2-CB 3.9Å; T1017-V1075 HydrophobicContact CG2-CG2 4.33Å; T1017-A1078 HydrophobicContact CG2-CB 4.14Å; T1017-A1078 WeakPolarHBondContact OG1-CB 3.39Å
1018	A	82.9	Confident	79.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-104.6	-10.7	-168	0	0	0	0	0	114.9	M971 V1014 L1020 L1071 V1075	M971-A1018 VanDerWaalsContact CE-O 3.23Å; M971-A1018 WeakPolarHBondContact CE-O 3.4Å; V1014-A1018 HydrophobicContact CG1-CB 4.45Å; V1014-A1018 WeakPolarHBondContact O-CA 3.45Å; V1014-A1018 WeakPolarHBondContact O-CB 3.47Å; V1014-A1018 PolarHBondContact O-N 2.88Å; A1018-L1020 HydrophobicContact CB-CD1 4.01Å; A1018-L1020 HydrophobicContact CB-CG 3.8Å; A1018-L1020 PolarHBondContact O-N 3.02Å; A1018-L1020 VanDerWaalsContact O-N 3.09Å; A1018-L1071 HydrophobicContact CB-CD1 3.78Å; A1018-V1075 HydrophobicContact CB-CG2 4.11Å
1019	N	88.2	Confident	79.8	Confident	21 Å²	21	40.7 Å²	40.7	11%	0.112	24%	0.243	C	C	.	.			trans	52.8	27	-175.4	-154.8	38.4	0	0	0	114.9	G968 M971 P973 T1015	G968-N1019 WeakPolarHBondContact O-CB 3.4Å; M971-N1019 PolarHBondContact O-ND2 3.38Å; P973-N1019 WeakPolarHBondContact CA-O 3.41Å; P973-N1019 WeakPolarHBondContact CB-O 3.42Å; P973-N1019 WeakPolarHBondContact CD-O 3.28Å; T1015-N1019 WeakPolarHBondContact O-CA 3.25Å; T1015-N1019 PolarHBondContact O-N 3.27Å
1020	L	87.9	Confident	80.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-91.1	146	178.4	-55.8	178.6	0	0	0	111.2	M971 T1015 A1018 F1033 L1046 L1071	M971-L1020 HydrophobicContact CE-CD2 4.04Å; M971-L1020 HydrophobicContact SD-CD2 4.12Å; T1015-L1020 PolarHBondContact OG1-O 2.95Å; A1018-L1020 HydrophobicContact CB-CD1 4.01Å; A1018-L1020 HydrophobicContact CB-CG 3.8Å; A1018-L1020 PolarHBondContact O-N 3.02Å; A1018-L1020 VanDerWaalsContact O-N 3.09Å; L1020-F1033 HydrophobicContact CB-CB 3.72Å; L1020-F1033 HydrophobicContact CD1-CB 3.93Å; L1020-L1046 HydrophobicContact CD1-CB 3.72Å; L1020-L1046 HydrophobicContact CD1-CD1 4.07Å; L1020-L1046 HydrophobicContact CD1-CG 4.49Å; L1020-L1071 HydrophobicContact CD1-CD2 4.48Å
1021	G	86.6	Confident	80.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	137.4	172.6	0	0	0	0	0	110.7	F1033 A1034	G1021-F1033 CarbonylContact O-C 3.46Å; G1021-F1033 WeakPolarHBondContact O-CA 3.26Å; G1021-A1034 PolarHBondContact N-O 3.35Å; G1021-A1034 PolarHBondContact O-N 2.97Å
1022	R	87.6	Confident	80.8	Confident	107 Å²	107	39.5 Å²	39.5	40%	0.404	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	132.7	172.4	-174.4	-176.8	-175.1	174.5	5.9	109.3	F1033	R1022-F1033 HydrophobicContact CB-CD1 4.26Å; R1022-F1033 HydrophobicContact CB-CE1 4.32Å
1023	V	86.4	Confident	81.3	Confident	1 Å²	1	35 Å²	35	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	133.2	170.3	171.8	0	0	0	0	108.2	M976 F981 R1032 A1034	M976-V1023 HydrophobicContact CG-CG2 3.74Å; F981-V1023 HydrophobicContact CB-CG1 4.17Å; F981-V1023 HydrophobicContact CD2-CB 4.45Å; F981-V1023 HydrophobicContact CD2-CG1 4.4Å; F981-V1023 HydrophobicContact CD2-CG2 3.96Å; F981-V1023 HydrophobicContact CG-CG1 4.45Å; V1023-R1032 HydrophobicContact CB-CB 4.01Å; V1023-R1032 HydrophobicContact CG1-CB 4.41Å; V1023-R1032 PolarHBondContact N-O 3.29Å; V1023-A1034 HydrophobicContact CG2-CB 3.96Å
1024	P	79.9	Confident	81.8	Confident	61 Å²	61	32.9 Å²	32.9	40%	0.396	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-61.8	140.8	174.7	26.2	-33.8	0	0	0	110.3
1025	C	73	Confident	82.1	Confident	31 Å²	31	32.8 Å²	32.8	21%	0.209	20%	0.204	C	C	.	.			trans	-145	126.5	-172.5	-170.5	0	0	0	0	109.1	E978 T1027 E1030 R1032	E978-C1025 WeakPolarHBondContact OE2-CA 3.49Å; C1025-T1027 PolarHBondContact O-N 3.48Å; C1025-T1027 PolarHBondContact SG-OG1 3.1Å; C1025-T1027 VanDerWaalsContact SG-OG1 3.39Å; C1025-E1030 PolarHBondContact SG-O 3.21Å; C1025-R1032 PolarHBondContact SG-NH1 3.35Å
1026	G	60.4	Low	82.4	Confident	75 Å²	75	38 Å²	38	77%	0.773	22%	0.221	S	C	*	.	S	Bend	trans	-72.4	-0.1	-176.8	0	0	0	0	0	116.2	E978	E978-G1026 PolarHBondContact OE2-N 3.45Å; E978-G1026 VanDerWaalsContact OE2-N 3.08Å
1027	T	68.5	Low	82.8	Confident	76 Å²	76	36.7 Å²	36.7	47%	0.466	21%	0.21	S	C	.	.			trans	-120.8	125.3	-175.5	47.9	0	0	0	0	111.9	C1025 D1029 E1030	C1025-T1027 PolarHBondContact O-N 3.48Å; C1025-T1027 PolarHBondContact SG-OG1 3.1Å; C1025-T1027 VanDerWaalsContact SG-OG1 3.39Å; T1027-D1029 PolarHBondContact O-N 2.94Å; T1027-D1029 VanDerWaalsContact O-N 3.14Å; T1027-E1030 PolarHBondContact O-N 2.81Å
1028	S	60.9	Low	82.8	Confident	86 Å²	86	36.6 Å²	36.6	60%	0.601	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-30.5	-176.7	49.3	0	0	0	0	115
1029	D	73	Confident	82.9	Confident	70 Å²	70	38.1 Å²	38.1	37%	0.374	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-1.3	-167.6	-58.3	12.1	0	0	0	112.5	T1027 A1050 P1052	T1027-D1029 PolarHBondContact O-N 2.94Å; T1027-D1029 VanDerWaalsContact O-N 3.14Å; D1029-A1050 PolarHBondContact O-N 2.91Å; D1029-P1052 WeakPolarHBondContact OD2-CD 3.38Å
1030	E	83.6	Confident	82.7	Confident	50 Å²	50	39.9 Å²	39.9	23%	0.234	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	117.3	-175.6	-164.6	-168.5	154.8	0	0	112.4	C1025 T1027 R1032 T1047	C1025-E1030 PolarHBondContact SG-O 3.21Å; T1027-E1030 PolarHBondContact O-N 2.81Å; E1030-R1032 IonicContact OE1-CZ 3.91Å; E1030-R1032 IonicContact OE1-NE 3.22Å; E1030-R1032 PolarHBondContact OE1-NE 3.46Å; E1030-R1032 IonicContact OE1-NH2 2.66Å; E1030-R1032 PolarHBondContact OE1-NH2 3.31Å; E1030-R1032 IonicContact OE2-CZ 2.67Å; E1030-R1032 IonicContact OE2-NE 2.78Å; E1030-R1032 IonicContact OE2-NH2 3.13Å; E1030-R1032 PolarHBondContact OE2-NH2 3.42Å; E1030-T1047 HydrophobicContact CG-CG2 3.97Å; E1030-T1047 VanDerWaalsContact OE1-CG2 3.23Å; E1030-T1047 WeakPolarHBondContact OE1-CG2 2.9Å
1031	Y	87.2	Confident	82.6	Confident	12 Å²	12	41.7 Å²	41.7	5%	0.047	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	126.1	-178.2	-59.3	-103.8	0	0	0	110.4	D1007 V1010 V1011 T1047 L1048 A1050	D1007-Y1031 WeakPolarHBondContact CA-OH 3.11Å; D1007-Y1031 HydrophobicContact CB-CE1 4.07Å; D1007-Y1031 PolarHBondContact OD1-OH 3.31Å; D1007-Y1031 PolarHBondContact OD2-OH 3.48Å; V1010-Y1031 HydrophobicContact CB-CD1 4.41Å; V1010-Y1031 HydrophobicContact CB-CE1 4.16Å; V1010-Y1031 HydrophobicContact CG1-CD1 4.01Å; V1010-Y1031 HydrophobicContact CG1-CD2 4.37Å; V1010-Y1031 HydrophobicContact CG1-CE1 4.21Å; V1010-Y1031 HydrophobicContact CG1-CG 4.11Å; V1011-Y1031 HydrophobicContact CG2-CD1 3.97Å; V1011-Y1031 HydrophobicContact CG2-CE1 4.24Å; Y1031-T1047 CarbonylContact O-C 3.59Å; Y1031-T1047 WeakPolarHBondContact O-CA 3.42Å; Y1031-L1048 PolarHBondContact N-O 3.16Å; Y1031-L1048 PolarHBondContact O-N 3.01Å; Y1031-A1050 HydrophobicContact CD2-CB 4.35Å; Y1031-A1050 HydrophobicContact CE2-CB 4.12Å
1032	R	90.4	Very high	82.7	Confident	12 Å²	12	42.3 Å²	42.3	5%	0.045	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.7	-179.9	-67.2	173.5	-173.3	141.7	5.8	110.9	E978 F981 V1023 C1025 E1030 L1046 T1047	E978-R1032 IonicContact OE1-CZ 3.96Å; E978-R1032 IonicContact OE1-NH1 2.65Å; E978-R1032 PolarHBondContact OE1-NH1 2.98Å; E978-R1032 IonicContact OE2-NH1 3.87Å; F981-R1032 HydrophobicContact CD1-CG 4.24Å; F981-R1032 HydrophobicContact CD2-CB 4.37Å; F981-R1032 HydrophobicContact CE1-CB 4.13Å; F981-R1032 HydrophobicContact CE1-CG 3.75Å; F981-R1032 HydrophobicContact CE2-CB 3.97Å; F981-R1032 HydrophobicContact CE2-CG 4.48Å; F981-R1032 HydrophobicContact CZ-CB 3.84Å; F981-R1032 HydrophobicContact CZ-CG 3.87Å; V1023-R1032 HydrophobicContact CB-CB 4.01Å; V1023-R1032 HydrophobicContact CG1-CB 4.41Å; V1023-R1032 PolarHBondContact N-O 3.29Å; C1025-R1032 PolarHBondContact SG-NH1 3.35Å; E1030-R1032 IonicContact OE1-CZ 3.91Å; E1030-R1032 IonicContact OE1-NE 3.22Å; E1030-R1032 PolarHBondContact OE1-NE 3.46Å; E1030-R1032 IonicContact OE1-NH2 2.66Å; E1030-R1032 PolarHBondContact OE1-NH2 3.31Å; E1030-R1032 IonicContact OE2-CZ 2.67Å; E1030-R1032 IonicContact OE2-NE 2.78Å; E1030-R1032 IonicContact OE2-NH2 3.13Å; E1030-R1032 PolarHBondContact OE2-NH2 3.42Å; R1032-L1046 CarbonylContact C-O 3.56Å; R1032-L1046 WeakPolarHBondContact CA-O 3.49Å; R1032-T1047 HydrophobicContact CG-CG2 4.23Å
1033	F	92.1	Very high	82.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	144.5	-179.3	-53.8	-103.8	0	0	0	111	V1011 V1014 L1020 G1021 R1022 L1046	V1011-F1033 HydrophobicContact CB-CE1 4.47Å; V1011-F1033 HydrophobicContact CG1-CE1 4.29Å; V1011-F1033 HydrophobicContact CG2-CE1 4.32Å; V1011-F1033 HydrophobicContact CG2-CZ 4.1Å; V1014-F1033 HydrophobicContact CB-CD1 4.47Å; V1014-F1033 HydrophobicContact CB-CE1 3.9Å; V1014-F1033 HydrophobicContact CB-CE2 4.07Å; V1014-F1033 HydrophobicContact CB-CZ 3.67Å; V1014-F1033 HydrophobicContact CG1-CD1 3.87Å; V1014-F1033 HydrophobicContact CG1-CD2 3.84Å; V1014-F1033 HydrophobicContact CG1-CE1 3.79Å; V1014-F1033 HydrophobicContact CG1-CE2 3.75Å; V1014-F1033 HydrophobicContact CG1-CG 3.9Å; V1014-F1033 HydrophobicContact CG1-CZ 3.73Å; V1014-F1033 HydrophobicContact CG2-CE2 4.23Å; V1014-F1033 HydrophobicContact CG2-CZ 4.12Å; L1020-F1033 HydrophobicContact CB-CB 3.72Å; L1020-F1033 HydrophobicContact CD1-CB 3.93Å; G1021-F1033 CarbonylContact O-C 3.46Å; G1021-F1033 WeakPolarHBondContact O-CA 3.26Å; R1022-F1033 HydrophobicContact CB-CD1 4.26Å; R1022-F1033 HydrophobicContact CB-CE1 4.32Å; F1033-L1046 HydrophobicContact CB-CB 4.39Å; F1033-L1046 HydrophobicContact CD2-CD2 3.61Å; F1033-L1046 HydrophobicContact CE2-CD2 4.19Å; F1033-L1046 HydrophobicContact CG-CD2 4.42Å; F1033-L1046 PolarHBondContact N-O 2.8Å; F1033-L1046 PolarHBondContact O-N 3.3Å
1034	A	92.4	Very high	83.1	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	151	-177.5	0	0	0	0	0	113.3	V974 M976 F981 G1021 V1023 L1045	V974-A1034 PolarHBondContact N-O 2.91Å; V974-A1034 WeakPolarHBondContact O-CB 3.31Å; M976-A1034 HydrophobicContact CE-CB 3.77Å; M976-A1034 HydrophobicContact CG-CB 4.18Å; M976-A1034 HydrophobicContact SD-CB 3.85Å; F981-A1034 HydrophobicContact CD2-CB 4.46Å; G1021-A1034 PolarHBondContact N-O 3.35Å; G1021-A1034 PolarHBondContact O-N 2.97Å; V1023-A1034 HydrophobicContact CG2-CB 3.96Å; A1034-L1045 HydrophobicContact CB-CD2 3.61Å
1035	G	91.9	Very high	83.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	175.3	178.4	0	0	0	0	0	112.2	A972 L1043 V1044	A972-G1035 CarbonylContact O-C 3.49Å; A972-G1035 WeakPolarHBondContact O-CA 3.38Å; G1035-L1043 WeakPolarHBondContact O-CD1 3.29Å; G1035-V1044 PolarHBondContact N-O 3.36Å; G1035-V1044 PolarHBondContact O-N 3.4Å
1036	R	91.4	Very high	84.7	Confident	129 Å²	129	33.8 Å²	33.8	49%	0.487	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	149.9	172.9	-74.9	175.1	-167.6	175.6	4.5	110.2	M971 A972 V974 G1041 S1042 L1043	M971-R1036 CarbonylContact C-O 3.54Å; M971-R1036 VanDerWaalsContact CA-O 3.28Å; M971-R1036 WeakPolarHBondContact CA-O 3.48Å; A972-R1036 PolarHBondContact N-O 3.2Å; A972-R1036 PolarHBondContact O-N 2.94Å; V974-R1036 HydrophobicContact CG2-CB 4.11Å; V974-R1036 HydrophobicContact CG2-CG 3.82Å; R1036-G1041 WeakPolarHBondContact CD-O 3.28Å; R1036-G1041 WeakPolarHBondContact CG-O 3.47Å; R1036-S1042 VanDerWaalsContact CA-O 3.3Å; R1036-S1042 WeakPolarHBondContact CA-O 3.36Å; R1036-L1043 HydrophobicContact CG-CD1 3.84Å
1037	T	89.9	Confident	86.1	Confident	4 Å²	4	30.8 Å²	30.8	3%	0.025	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	145.3	171.6	68.8	0	0	0	0	110.9	D943 L970 M971 S1040 G1041 S1042 V1044 I1067	D943-T1037 WeakPolarHBondContact OD1-CB 3.43Å; D943-T1037 PolarHBondContact OD1-OG1 2.9Å; L970-T1037 WeakPolarHBondContact O-CA 3.16Å; M971-T1037 HydrophobicContact CG-CG2 4.47Å; T1037-S1040 PolarHBondContact OG1-OG 2.89Å; T1037-G1041 VanDerWaalsContact O-CA 3.24Å; T1037-G1041 WeakPolarHBondContact O-CA 3.39Å; T1037-G1041 PolarHBondContact O-N 3.46Å; T1037-G1041 PolarHBondContact OG1-N 3.24Å; T1037-S1042 PolarHBondContact N-O 3.45Å; T1037-S1042 PolarHBondContact OG1-N 2.65Å; T1037-V1044 HydrophobicContact CG2-CG2 4.18Å; T1037-I1067 HydrophobicContact CG2-CD1 3.66Å
1038	L	84.8	Confident	87.1	Confident	32 Å²	32	27.1 Å²	27.1	17%	0.168	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-35.7	-174.7	-75.9	165.8	0	0	0	113.4	V888 L970 A972	V888-L1038 HydrophobicContact CG2-CD1 3.91Å; L970-L1038 PolarHBondContact O-N 2.89Å; A972-L1038 HydrophobicContact CB-CD2 4.05Å
1039	T	84.2	Confident	88.3	Confident	33 Å²	33	24.7 Å²	24.7	20%	0.202	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-42.3	-173.2	-43.3	0	0	0	0	113.5	H886 N940 D943	H886-T1039 HydrophobicContact CB-CG2 4.42Å; H886-T1039 PolarHBondContact O-OG1 2.96Å; N940-T1039 VanDerWaalsContact OD1-CG2 3.25Å; N940-T1039 WeakPolarHBondContact OD1-CG2 3.38Å; N940-T1039 PolarHBondContact OD1-OG1 3.49Å; D943-T1039 PolarHBondContact OD1-N 3.49Å
1040	S	84.1	Confident	88.4	Confident	57 Å²	57	22.4 Å²	22.4	40%	0.399	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-12.9	179.2	47.9	0	0	0	0	115.3	D943 T1037 S1042 K1064	D943-S1040 PolarHBondContact OD1-N 3.19Å; D943-S1040 VanDerWaalsContact OD1-N 3.16Å; D943-S1040 PolarHBondContact OD1-OG 2.74Å; D943-S1040 VanDerWaalsContact OD1-OG 3.1Å; D943-S1040 VanDerWaalsContact OD2-CB 3.24Å; D943-S1040 WeakPolarHBondContact OD2-CB 3.34Å; D943-S1040 PolarHBondContact OD2-N 3.44Å; D943-S1040 PolarHBondContact OD2-OG 2.94Å; T1037-S1040 PolarHBondContact OG1-OG 2.89Å; S1040-S1042 PolarHBondContact O-N 2.69Å; S1040-K1064 WeakPolarHBondContact OG-CE 3.3Å; S1040-K1064 PolarHBondContact OG-NZ 2.86Å
1041	G	86	Confident	87.9	Confident	38 Å²	38	26.8 Å²	26.8	39%	0.392	14%	0.141	S	C	.	.			trans	69.2	6.9	-173.8	0	0	0	0	0	114.3	R1036 T1037	R1036-G1041 WeakPolarHBondContact CD-O 3.28Å; R1036-G1041 WeakPolarHBondContact CG-O 3.47Å; T1037-G1041 VanDerWaalsContact O-CA 3.24Å; T1037-G1041 WeakPolarHBondContact O-CA 3.39Å; T1037-G1041 PolarHBondContact O-N 3.46Å; T1037-G1041 PolarHBondContact OG1-N 3.24Å
1042	S	89.3	Confident	86.5	Confident	15 Å²	15	30.5 Å²	30.5	11%	0.105	17%	0.166	C	C	.	.			trans	-57.6	137.4	178.6	-83.6	0	0	0	0	110.7	R1036 T1037 S1040 E1063	R1036-S1042 VanDerWaalsContact CA-O 3.3Å; R1036-S1042 WeakPolarHBondContact CA-O 3.36Å; T1037-S1042 PolarHBondContact N-O 3.45Å; T1037-S1042 PolarHBondContact OG1-N 2.65Å; S1040-S1042 PolarHBondContact O-N 2.69Å; S1042-E1063 WeakPolarHBondContact CA-OE2 3.31Å; S1042-E1063 WeakPolarHBondContact CB-OE2 3.49Å; S1042-E1063 PolarHBondContact OG-OE2 3.36Å
1043	L	90.7	Very high	84.9	Confident	20 Å²	20	35 Å²	35	11%	0.105	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	141.1	-175.4	-163.3	70	0	0	0	111.5	M976 E984 L988 G1035 R1036 L1045 S1062	M976-L1043 HydrophobicContact CE-CD1 4.04Å; E984-L1043 HydrophobicContact CB-CD2 3.73Å; E984-L1043 HydrophobicContact CG-CD2 4.21Å; L988-L1043 HydrophobicContact CD1-CB 4.34Å; L988-L1043 HydrophobicContact CD1-CD2 4.25Å; G1035-L1043 WeakPolarHBondContact O-CD1 3.29Å; R1036-L1043 HydrophobicContact CG-CD1 3.84Å; L1043-L1045 HydrophobicContact CD1-CD2 4.34Å; L1043-L1045 HydrophobicContact CD2-CD1 4.05Å; L1043-L1045 HydrophobicContact CD2-CD2 3.9Å; L1043-L1045 HydrophobicContact CD2-CG 3.98Å; L1043-L1045 HydrophobicContact CG-CD2 3.95Å; L1043-L1045 HydrophobicContact CG-CG 4.12Å; L1043-S1062 PolarHBondContact O-OG 2.83Å
1044	V	92	Very high	83.7	Confident	0 Å²	0	37 Å²	37	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	119.5	172	-174.5	0	0	0	0	108.1	M971 G1035 T1037 V1060 I1067 L1071	M971-V1044 HydrophobicContact SD-CB 3.92Å; M971-V1044 HydrophobicContact SD-CG1 3.94Å; M971-V1044 HydrophobicContact SD-CG2 3.7Å; G1035-V1044 PolarHBondContact N-O 3.36Å; G1035-V1044 PolarHBondContact O-N 3.4Å; T1037-V1044 HydrophobicContact CG2-CG2 4.18Å; V1044-V1060 HydrophobicContact CG1-CG1 4.22Å; V1044-I1067 HydrophobicContact CG2-CG2 4.15Å; V1044-L1071 HydrophobicContact CG1-CD2 3.71Å
1045	L	92.9	Very high	82.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	139.8	176.7	-54.7	178.2	0	0	0	109	M976 F981 E984 Q985 L988 A1034 L1043 V1060 N1061	M976-L1045 HydrophobicContact CE-CD2 4.02Å; M976-L1045 HydrophobicContact SD-CD2 3.94Å; F981-L1045 HydrophobicContact CD2-CD1 4.49Å; F981-L1045 HydrophobicContact CD2-CD2 3.88Å; F981-L1045 HydrophobicContact CE2-CB 3.81Å; F981-L1045 HydrophobicContact CE2-CD1 4.45Å; F981-L1045 HydrophobicContact CE2-CD2 3.85Å; F981-L1045 HydrophobicContact CE2-CG 4.24Å; F981-L1045 HydrophobicContact CZ-CB 3.99Å; E984-L1045 HydrophobicContact CB-CD1 4.14Å; Q985-L1045 HydrophobicContact CB-CD1 3.91Å; L988-L1045 HydrophobicContact CD1-CD1 4.47Å; A1034-L1045 HydrophobicContact CB-CD2 3.61Å; L1043-L1045 HydrophobicContact CD1-CD2 4.34Å; L1043-L1045 HydrophobicContact CD2-CD1 4.05Å; L1043-L1045 HydrophobicContact CD2-CD2 3.9Å; L1043-L1045 HydrophobicContact CD2-CG 3.98Å; L1043-L1045 HydrophobicContact CG-CD2 3.95Å; L1043-L1045 HydrophobicContact CG-CG 4.12Å; L1045-V1060 CarbonylContact O-C 3.57Å; L1045-V1060 WeakPolarHBondContact O-CA 3.41Å; L1045-N1061 HydrophobicContact CB-CB 4.31Å; L1045-N1061 PolarHBondContact N-O 3.41Å; L1045-N1061 PolarHBondContact O-N 3.01Å
1046	L	92.4	Very high	82.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	128.9	-179.7	-177	154.8	0	0	0	109.2	V1014 L1020 R1032 F1033 L1058 V1060 L1071 V1075	V1014-L1046 HydrophobicContact CG1-CD1 4.44Å; V1014-L1046 HydrophobicContact CG1-CD2 4.18Å; L1020-L1046 HydrophobicContact CD1-CB 3.72Å; L1020-L1046 HydrophobicContact CD1-CD1 4.07Å; L1020-L1046 HydrophobicContact CD1-CG 4.49Å; R1032-L1046 CarbonylContact C-O 3.56Å; R1032-L1046 WeakPolarHBondContact CA-O 3.49Å; F1033-L1046 HydrophobicContact CB-CB 4.39Å; F1033-L1046 HydrophobicContact CD2-CD2 3.61Å; F1033-L1046 HydrophobicContact CE2-CD2 4.19Å; F1033-L1046 HydrophobicContact CG-CD2 4.42Å; F1033-L1046 PolarHBondContact N-O 2.8Å; F1033-L1046 PolarHBondContact O-N 3.3Å; L1046-L1058 HydrophobicContact CD1-CD1 4.11Å; L1046-L1058 HydrophobicContact CD2-CD1 3.69Å; L1046-L1058 HydrophobicContact CG-CD1 3.8Å; L1046-V1060 HydrophobicContact CB-CG2 4.19Å; L1046-V1060 HydrophobicContact CD1-CG2 3.86Å; L1046-V1060 HydrophobicContact CG-CG2 3.87Å; L1046-L1071 HydrophobicContact CD1-CD2 4.48Å; L1046-V1075 HydrophobicContact CD1-CG1 4.39Å; L1046-V1075 HydrophobicContact CD1-CG2 4.06Å
1047	T	90.9	Very high	82.3	Confident	12 Å²	12	37.5 Å²	37.5	7%	0.074	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	129.2	177	-48.1	0	0	0	0	108.8	F981 Q985 E1030 Y1031 R1032 T1059	F981-T1047 WeakPolarHBondContact CZ-OG1 3.25Å; Q985-T1047 PolarHBondContact NE2-OG1 2.89Å; E1030-T1047 HydrophobicContact CG-CG2 3.97Å; E1030-T1047 VanDerWaalsContact OE1-CG2 3.23Å; E1030-T1047 WeakPolarHBondContact OE1-CG2 2.9Å; Y1031-T1047 CarbonylContact O-C 3.59Å; Y1031-T1047 WeakPolarHBondContact O-CA 3.42Å; R1032-T1047 HydrophobicContact CG-CG2 4.23Å; T1047-T1059 PolarHBondContact N-O 2.74Å; T1047-T1059 PolarHBondContact O-N 3.05Å
1048	L	88.7	Confident	82.3	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	109	173.7	175.5	67.1	0	0	0	109.2	L998 V1010 Y1031 A1056 Q1057 L1058 L1079	L998-L1048 HydrophobicContact CD2-CD1 4.13Å; V1010-L1048 HydrophobicContact CG1-CD2 3.66Å; Y1031-L1048 PolarHBondContact N-O 3.16Å; Y1031-L1048 PolarHBondContact O-N 3.01Å; L1048-A1056 HydrophobicContact CD1-CB 4.15Å; L1048-Q1057 WeakPolarHBondContact CA-O 3.34Å; L1048-L1058 HydrophobicContact CB-CD1 4.19Å; L1048-L1058 HydrophobicContact CD1-CB 4.24Å; L1048-L1058 HydrophobicContact CD1-CD1 4.27Å; L1048-L1079 HydrophobicContact CD2-CD1 3.87Å
1049	D	86.6	Confident	82.6	Confident	34 Å²	34	36.4 Å²	36.4	18%	0.182	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	101.6	177.1	174.3	4	0	0	0	108.6	R1051 A1056 Q1057	D1049-R1051 PolarHBondContact O-N 3.36Å; D1049-R1051 WeakPolarHBondContact OD1-CG 3.33Å; D1049-R1051 IonicContact OD1-NE 3.1Å; D1049-R1051 PolarHBondContact OD1-NE 2.84Å; D1049-R1051 IonicContact OD2-CZ 2.69Å; D1049-R1051 IonicContact OD2-NE 3.54Å; D1049-R1051 PolarHBondContact OD2-NE 3.4Å; D1049-R1051 IonicContact OD2-NH2 3.24Å; D1049-R1051 PolarHBondContact OD2-NH2 2.86Å; D1049-A1056 CarbonylContact O-C 3.28Å; D1049-A1056 VanDerWaalsContact O-CA 3.25Å; D1049-A1056 WeakPolarHBondContact O-CA 3.31Å; D1049-A1056 WeakPolarHBondContact O-CB 3.43Å; D1049-Q1057 HydrophobicContact CB-CB 4.36Å; D1049-Q1057 PolarHBondContact N-O 3.37Å; D1049-Q1057 PolarHBondContact O-N 3.33Å
1050	A	75.7	Confident	83	Confident	22 Å²	22	34.8 Å²	34.8	18%	0.182	23%	0.226	C	C	.	.			trans	-99.8	46.9	-166.5	0	0	0	0	0	112.5	L1000 D1029 Y1031	L1000-A1050 HydrophobicContact CD1-CB 3.97Å; D1029-A1050 PolarHBondContact O-N 2.91Å; Y1031-A1050 HydrophobicContact CD2-CB 4.35Å; Y1031-A1050 HydrophobicContact CE2-CB 4.12Å
1051	R	71.3	Confident	83.4	Confident	143 Å²	143	32.1 Å²	32.1	54%	0.54	21%	0.208	S	C	.	.			trans	-47.3	129.8	-172.8	-53.9	-171.1	-174	179.5	4.9	113.2	D1049 A1053 G1054	D1049-R1051 PolarHBondContact O-N 3.36Å; D1049-R1051 WeakPolarHBondContact OD1-CG 3.33Å; D1049-R1051 IonicContact OD1-NE 3.1Å; D1049-R1051 PolarHBondContact OD1-NE 2.84Å; D1049-R1051 IonicContact OD2-CZ 2.69Å; D1049-R1051 IonicContact OD2-NE 3.54Å; D1049-R1051 PolarHBondContact OD2-NE 3.4Å; D1049-R1051 IonicContact OD2-NH2 3.24Å; D1049-R1051 PolarHBondContact OD2-NH2 2.86Å; R1051-A1053 PolarHBondContact O-N 3.14Å; R1051-G1054 PolarHBondContact O-N 2.74Å
1052	P	59.5	Low	83.6	Confident	90 Å²	90	30.4 Å²	30.4	58%	0.584	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.3	-171	22.4	-33.9	0	0	0	114.9	D1029	D1029-P1052 WeakPolarHBondContact OD2-CD 3.38Å
1053	A	56.2	Low	83.5	Confident	105 Å²	105	34.7 Å²	34.7	87%	0.868	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-132	41.4	-177.3	0	0	0	0	0	113.4	R1051	R1051-A1053 PolarHBondContact O-N 3.14Å
1054	G	66.3	Low	83.3	Confident	43 Å²	43	37.1 Å²	37.1	44%	0.443	22%	0.217	S	C	.	.	S	Bend	trans	-163	178.7	174.3	0	0	0	0	0	113.6	R1051	R1051-G1054 PolarHBondContact O-N 2.74Å
1055	P	75.3	Confident	82.9	Confident	75 Å²	75	42.5 Å²	42.5	49%	0.487	24%	0.244	S	C	.	.			trans	-65.7	134	163.6	29.8	-32.9	0	0	0	109	L998	L998-P1055 CarbonylContact O-C 3.43Å
1056	A	82.6	Confident	82.5	Confident	4 Å²	4	47 Å²	47	3%	0.033	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	148.7	175.1	0	0	0	0	0	110.2	K997 L998 L1000 L1048 D1049	K997-A1056 WeakPolarHBondContact CA-O 3.22Å; L998-A1056 HydrophobicContact CD1-CB 3.98Å; L998-A1056 HydrophobicContact CG-CB 4.23Å; L998-A1056 PolarHBondContact N-O 2.82Å; L998-A1056 PolarHBondContact O-N 2.93Å; L1000-A1056 HydrophobicContact CD1-CB 3.97Å; L1000-A1056 HydrophobicContact CG-CB 4.08Å; L1048-A1056 HydrophobicContact CD1-CB 4.15Å; D1049-A1056 CarbonylContact O-C 3.28Å; D1049-A1056 VanDerWaalsContact O-CA 3.25Å; D1049-A1056 WeakPolarHBondContact O-CA 3.31Å; D1049-A1056 WeakPolarHBondContact O-CB 3.43Å
1057	Q	88.1	Confident	82.3	Confident	61 Å²	61	47 Å²	47	29%	0.285	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.1	-179.7	-174.5	176.1	-56.6	0	0	109.8	T995 L1048 D1049	T995-Q1057 HydrophobicContact CG2-CG 3.51Å; L1048-Q1057 WeakPolarHBondContact CA-O 3.34Å; D1049-Q1057 HydrophobicContact CB-CB 4.36Å; D1049-Q1057 PolarHBondContact N-O 3.37Å; D1049-Q1057 PolarHBondContact O-N 3.33Å
1058	L	90.6	Very high	82.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	118.7	175.1	-179.5	69	0	0	0	108.8	T995 E996 L998 L1046 L1048 V1072 V1075 I1076	T995-L1058 WeakPolarHBondContact CA-O 3.33Å; E996-L1058 PolarHBondContact N-O 3.03Å; E996-L1058 PolarHBondContact O-N 3.33Å; L998-L1058 HydrophobicContact CD2-CB 3.82Å; L998-L1058 HydrophobicContact CD2-CD2 4.31Å; L1046-L1058 HydrophobicContact CD1-CD1 4.11Å; L1046-L1058 HydrophobicContact CD2-CD1 3.69Å; L1046-L1058 HydrophobicContact CG-CD1 3.8Å; L1048-L1058 HydrophobicContact CB-CD1 4.19Å; L1048-L1058 HydrophobicContact CD1-CB 4.24Å; L1048-L1058 HydrophobicContact CD1-CD1 4.27Å; L1058-V1072 HydrophobicContact CD2-CG1 4.36Å; L1058-V1075 HydrophobicContact CD1-CG1 4.24Å; L1058-V1075 HydrophobicContact CD2-CB 4.06Å; L1058-V1075 HydrophobicContact CD2-CG1 3.82Å; L1058-I1076 HydrophobicContact CD2-CD1 4.37Å; L1058-I1076 HydrophobicContact CD2-CG1 3.84Å
1059	T	91.1	Very high	82.1	Confident	12 Å²	12	49.1 Å²	49.1	7%	0.074	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.7	177.7	-63.6	0	0	0	0	109.3	E993 I994 T995 T1047	E993-T1059 HydrophobicContact CG-CG2 3.91Å; I994-T1059 CarbonylContact O-C 3.43Å; I994-T1059 WeakPolarHBondContact O-CA 3.37Å; T995-T1059 WeakPolarHBondContact OG1-CB 3.44Å; T995-T1059 WeakPolarHBondContact OG1-CG2 3.2Å; T995-T1059 PolarHBondContact OG1-OG1 2.71Å; T1047-T1059 PolarHBondContact N-O 2.74Å; T1047-T1059 PolarHBondContact O-N 3.05Å
1060	V	93	Very high	82.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.3	174.5	174.2	0	0	0	0	109.3	I994 V1044 L1045 L1046 L1071 V1072	I994-V1060 PolarHBondContact N-O 3.27Å; I994-V1060 PolarHBondContact O-N 2.71Å; V1044-V1060 HydrophobicContact CG1-CG1 4.22Å; L1045-V1060 CarbonylContact O-C 3.57Å; L1045-V1060 WeakPolarHBondContact O-CA 3.41Å; L1046-V1060 HydrophobicContact CB-CG2 4.19Å; L1046-V1060 HydrophobicContact CD1-CG2 3.86Å; L1046-V1060 HydrophobicContact CG-CG2 3.87Å; V1060-L1071 HydrophobicContact CG1-CD2 4.27Å; V1060-V1072 HydrophobicContact CB-CG2 3.74Å; V1060-V1072 HydrophobicContact CG2-CG2 3.51Å
1061	N	92.9	Very high	82.9	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121.6	175.4	-60.5	94.7	0	0	0	109.3	Q985 L988 N992 E993 L1045	Q985-N1061 PolarHBondContact NE2-OD1 3.43Å; L988-N1061 HydrophobicContact CB-CB 3.85Å; L988-N1061 PolarHBondContact O-ND2 3.03Å; N992-N1061 CarbonylContact O-C 3.53Å; N992-N1061 VanDerWaalsContact O-CA 3.29Å; N992-N1061 WeakPolarHBondContact O-CA 3.45Å; E993-N1061 WeakPolarHBondContact CG-ND2 3.29Å; L1045-N1061 HydrophobicContact CB-CB 4.31Å; L1045-N1061 PolarHBondContact N-O 3.41Å; L1045-N1061 PolarHBondContact O-N 3.01Å
1062	S	89.8	Confident	83.8	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.014	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	145.1	174.6	-174.5	0	0	0	0	112.7	N992 L1043 K1064	N992-S1062 WeakPolarHBondContact CB-O 3.35Å; N992-S1062 PolarHBondContact O-N 2.99Å; L1043-S1062 PolarHBondContact O-OG 2.83Å; S1062-K1064 PolarHBondContact O-N 2.93Å; S1062-K1064 PolarHBondContact OG-N 3.03Å
1063	E	87	Confident	85.2	Confident	105 Å²	105	43.4 Å²	43.4	49%	0.491	25%	0.25	S	S	.	.	S	Bend	trans	-61.5	-24.9	171	-56.2	175.5	138.1	0	0	112.8	L988 S1042	L988-E1063 HydrophobicContact CD2-CG 3.7Å; S1042-E1063 WeakPolarHBondContact CA-OE2 3.31Å; S1042-E1063 WeakPolarHBondContact CB-OE2 3.49Å; S1042-E1063 PolarHBondContact OG-OE2 3.36Å
1064	K	86.4	Confident	86.6	Confident	70 Å²	70	40.8 Å²	40.8	30%	0.304	22%	0.222	S	C	.	.			trans	-105.8	87.7	-177.8	-62.6	-155.6	176	-166.3	0	110.5	D943 S1040 S1062 V1066 I1067 G1068	D943-K1064 HydrophobicContact CB-CD 3.86Å; D943-K1064 IonicContact OD2-NZ 2.79Å; D943-K1064 PolarHBondContact OD2-NZ 2.88Å; S1040-K1064 WeakPolarHBondContact OG-CE 3.3Å; S1040-K1064 PolarHBondContact OG-NZ 2.86Å; S1062-K1064 PolarHBondContact O-N 2.93Å; S1062-K1064 PolarHBondContact OG-N 3.03Å; K1064-V1066 PolarHBondContact O-N 3.35Å; K1064-I1067 HydrophobicContact CB-CB 4.27Å; K1064-I1067 HydrophobicContact CB-CD1 4.37Å; K1064-I1067 WeakPolarHBondContact O-CB 3.28Å; K1064-I1067 PolarHBondContact O-N 3.45Å; K1064-G1068 PolarHBondContact O-N 3Å; K1064-G1068 VanDerWaalsContact O-N 3.11Å
1065	M	84.3	Confident	87.6	Confident	114 Å²	114	38.7 Å²	38.7	56%	0.562	20%	0.2	S	C	*	.	H	α-helix	trans	-48	-35.6	-177.2	-65.9	-171.2	-65.7	0	0	114.4	G1068 T1069	M1065-G1068 PolarHBondContact O-N 2.88Å; M1065-T1069 WeakPolarHBondContact O-CB 3.29Å; M1065-T1069 PolarHBondContact O-N 3.49Å; M1065-T1069 PolarHBondContact O-OG1 2.92Å
1066	V	85.1	Confident	88.2	Confident	94 Å²	94	36.6 Å²	36.6	57%	0.57	19%	0.185	S	C	*	.	H	α-helix	trans	-64.1	-46.4	178.1	-179	0	0	0	0	111.3	K1064 T1069 M1070	K1064-V1066 PolarHBondContact O-N 3.35Å; V1066-T1069 PolarHBondContact O-N 3.41Å; V1066-M1070 WeakPolarHBondContact O-CG 3.45Å; V1066-M1070 PolarHBondContact O-N 3.46Å
1067	I	87.6	Confident	88.3	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-61.2	-48.9	175.4	-79.1	176.8	0	0	0	109.9	D943 V967 M971 T1037 V1044 K1064 T1069 M1070 L1071	D943-I1067 HydrophobicContact CB-CD1 3.82Å; D943-I1067 WeakPolarHBondContact O-CD1 3.29Å; V967-I1067 HydrophobicContact CG1-CB 4.23Å; V967-I1067 HydrophobicContact CG1-CG1 4.22Å; V967-I1067 HydrophobicContact CG1-CG2 3.74Å; M971-I1067 HydrophobicContact SD-CG2 4.34Å; T1037-I1067 HydrophobicContact CG2-CD1 3.66Å; V1044-I1067 HydrophobicContact CG2-CG2 4.15Å; K1064-I1067 HydrophobicContact CB-CB 4.27Å; K1064-I1067 HydrophobicContact CB-CD1 4.37Å; K1064-I1067 WeakPolarHBondContact O-CB 3.28Å; K1064-I1067 PolarHBondContact O-N 3.45Å; I1067-T1069 PolarHBondContact O-N 3.01Å; I1067-M1070 PolarHBondContact O-N 3.48Å; I1067-L1071 WeakPolarHBondContact O-CB 3.46Å; I1067-L1071 PolarHBondContact O-N 3.18Å
1068	G	87.4	Confident	88.1	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-58.3	-44.2	176.9	0	0	0	0	0	113.2	K1064 M1065 L1071 V1072	K1064-G1068 PolarHBondContact O-N 3Å; K1064-G1068 VanDerWaalsContact O-N 3.11Å; M1065-G1068 PolarHBondContact O-N 2.88Å; G1068-L1071 PolarHBondContact O-N 3.07Å; G1068-V1072 WeakPolarHBondContact O-CG2 3.46Å; G1068-V1072 PolarHBondContact O-N 3.14Å; G1068-V1072 VanDerWaalsContact O-N 3.09Å
1069	T	88.6	Confident	87.7	Confident	54 Å²	54	39.6 Å²	39.6	33%	0.331	20%	0.201	S	C	.	.	H	α-helix	trans	-67.3	-38.6	-178	-51.4	0	0	0	0	112.3	I994 M1065 V1066 I1067 K1073	I994-T1069 WeakPolarHBondContact CD1-OG1 3.33Å; M1065-T1069 WeakPolarHBondContact O-CB 3.29Å; M1065-T1069 PolarHBondContact O-N 3.49Å; M1065-T1069 PolarHBondContact O-OG1 2.92Å; V1066-T1069 PolarHBondContact O-N 3.41Å; I1067-T1069 PolarHBondContact O-N 3.01Å; T1069-K1073 WeakPolarHBondContact O-CG 3.43Å
1070	M	88.3	Confident	87	Confident	60 Å²	60	42 Å²	42	30%	0.296	22%	0.216	S	C	.	.	H	α-helix	trans	-76.2	-42	177.9	-64.8	-58.8	95.1	0	0	110.8	V967 V1066 I1067 V1072 K1073 D1074	V967-M1070 HydrophobicContact CG2-CB 3.43Å; V967-M1070 VanDerWaalsContact CG2-CB 3.43Å; V1066-M1070 WeakPolarHBondContact O-CG 3.45Å; V1066-M1070 PolarHBondContact O-N 3.46Å; I1067-M1070 PolarHBondContact O-N 3.48Å; M1070-V1072 VanDerWaalsContact C-N 3.33Å; M1070-V1072 PolarHBondContact O-N 3.21Å; M1070-K1073 HydrophobicContact CE-CD 4.17Å; M1070-K1073 WeakPolarHBondContact O-CB 3.32Å; M1070-K1073 PolarHBondContact O-N 2.91Å; M1070-D1074 PolarHBondContact O-N 2.7Å
1071	L	89.8	Confident	85.7	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.6	-39.6	179.5	-171.1	63.9	0	0	0	113	V967 M971 A1018 L1020 V1044 L1046 V1060 I1067 G1068 K1073 D1074 V1075	V967-L1071 HydrophobicContact CB-CD1 4.29Å; V967-L1071 HydrophobicContact CG1-CB 4.13Å; V967-L1071 HydrophobicContact CG1-CD1 4.28Å; M971-L1071 HydrophobicContact CE-CD1 3.69Å; M971-L1071 HydrophobicContact CE-CD2 3.77Å; M971-L1071 HydrophobicContact CE-CG 4.36Å; M971-L1071 HydrophobicContact SD-CD2 4.34Å; A1018-L1071 HydrophobicContact CB-CD1 3.78Å; L1020-L1071 HydrophobicContact CD1-CD2 4.48Å; V1044-L1071 HydrophobicContact CG1-CD2 3.71Å; L1046-L1071 HydrophobicContact CD1-CD2 4.48Å; V1060-L1071 HydrophobicContact CG1-CD2 4.27Å; I1067-L1071 WeakPolarHBondContact O-CB 3.46Å; I1067-L1071 PolarHBondContact O-N 3.18Å; G1068-L1071 PolarHBondContact O-N 3.07Å; L1071-K1073 VanDerWaalsContact C-N 3.28Å; L1071-K1073 PolarHBondContact O-N 3.31Å; L1071-D1074 PolarHBondContact O-N 3.48Å; L1071-V1075 HydrophobicContact CD1-CG2 4.21Å; L1071-V1075 HydrophobicContact CG-CG2 4.39Å; L1071-V1075 WeakPolarHBondContact O-CB 3.35Å; L1071-V1075 WeakPolarHBondContact O-CG2 3.36Å; L1071-V1075 PolarHBondContact O-N 3.34Å
1072	V	89.7	Confident	85.3	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-57.2	-42.5	173.4	164.8	0	0	0	0	111	I994 E996 L1058 V1060 G1068 M1070 I1076	I994-V1072 HydrophobicContact CB-CG2 4.43Å; I994-V1072 HydrophobicContact CG2-CG2 3.99Å; E996-V1072 HydrophobicContact CB-CG1 3.95Å; E996-V1072 HydrophobicContact CG-CG1 4.03Å; L1058-V1072 HydrophobicContact CD2-CG1 4.36Å; V1060-V1072 HydrophobicContact CB-CG2 3.74Å; V1060-V1072 HydrophobicContact CG2-CG2 3.51Å; G1068-V1072 WeakPolarHBondContact O-CG2 3.46Å; G1068-V1072 PolarHBondContact O-N 3.14Å; G1068-V1072 VanDerWaalsContact O-N 3.09Å; M1070-V1072 VanDerWaalsContact C-N 3.33Å; M1070-V1072 PolarHBondContact O-N 3.21Å; V1072-I1076 HydrophobicContact CG1-CD1 3.67Å; V1072-I1076 WeakPolarHBondContact O-CB 3.36Å; V1072-I1076 WeakPolarHBondContact O-CD1 3.37Å; V1072-I1076 WeakPolarHBondContact O-CG1 3.42Å; V1072-I1076 PolarHBondContact O-N 3.27Å
1073	K	88.4	Confident	85.1	Confident	108 Å²	108	55.2 Å²	55.2	47%	0.47	28%	0.279	S	S	.	.	H	α-helix	trans	-70.5	-46.6	179.4	-65.2	178.2	-177.3	-172.6	0	112.2	T1069 M1070 L1071 V1075 I1076 Q1077	T1069-K1073 WeakPolarHBondContact O-CG 3.43Å; M1070-K1073 HydrophobicContact CE-CD 4.17Å; M1070-K1073 WeakPolarHBondContact O-CB 3.32Å; M1070-K1073 PolarHBondContact O-N 2.91Å; L1071-K1073 VanDerWaalsContact C-N 3.28Å; L1071-K1073 PolarHBondContact O-N 3.31Å; K1073-V1075 VanDerWaalsContact C-N 3.29Å; K1073-V1075 PolarHBondContact O-N 3.35Å; K1073-I1076 PolarHBondContact O-N 3Å; K1073-Q1077 WeakPolarHBondContact O-CB 3.37Å; K1073-Q1077 PolarHBondContact O-N 2.58Å
1074	D	87.1	Confident	85	Confident	50 Å²	50	52.4 Å²	52.4	27%	0.267	27%	0.267	S	S	.	.	H	α-helix	trans	-58.4	-43.6	178.9	-65.5	-9.6	0	0	0	110.8	V967 T1017 M1070 L1071 A1078	V967-D1074 WeakPolarHBondContact CG2-OD2 3.46Å; T1017-D1074 HydrophobicContact CG2-CB 3.9Å; M1070-D1074 PolarHBondContact O-N 2.7Å; L1071-D1074 PolarHBondContact O-N 3.48Å; D1074-A1078 WeakPolarHBondContact O-CB 3.43Å; D1074-A1078 PolarHBondContact O-N 2.97Å
1075	V	87.8	Confident	84.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-73	-39.9	178.9	173.2	0	0	0	0	112.2	V1014 T1017 A1018 L1046 L1058 L1071 K1073 Q1077 A1078 L1079	V1014-V1075 HydrophobicContact CG2-CG1 4.15Å; T1017-V1075 HydrophobicContact CG2-CG2 4.33Å; A1018-V1075 HydrophobicContact CB-CG2 4.11Å; L1046-V1075 HydrophobicContact CD1-CG1 4.39Å; L1046-V1075 HydrophobicContact CD1-CG2 4.06Å; L1058-V1075 HydrophobicContact CD1-CG1 4.24Å; L1058-V1075 HydrophobicContact CD2-CB 4.06Å; L1058-V1075 HydrophobicContact CD2-CG1 3.82Å; L1071-V1075 HydrophobicContact CD1-CG2 4.21Å; L1071-V1075 HydrophobicContact CG-CG2 4.39Å; L1071-V1075 WeakPolarHBondContact O-CB 3.35Å; L1071-V1075 WeakPolarHBondContact O-CG2 3.36Å; L1071-V1075 PolarHBondContact O-N 3.34Å; K1073-V1075 VanDerWaalsContact C-N 3.29Å; K1073-V1075 PolarHBondContact O-N 3.35Å; V1075-Q1077 VanDerWaalsContact C-N 3.33Å; V1075-Q1077 PolarHBondContact O-N 2.83Å; V1075-A1078 PolarHBondContact O-N 2.68Å; V1075-L1079 HydrophobicContact CG1-CD1 3.72Å; V1075-L1079 HydrophobicContact CG1-CG 4.26Å; V1075-L1079 WeakPolarHBondContact O-CB 3.33Å; V1075-L1079 VanDerWaalsContact O-CG 3.31Å; V1075-L1079 WeakPolarHBondContact O-CG 3.29Å; V1075-L1079 PolarHBondContact O-N 3.2Å
1076	I	87.1	Confident	85	Confident	31 Å²	31	47.4 Å²	47.4	16%	0.159	25%	0.247	C	C	.	.	H	α-helix	trans	-59.7	-45.4	172.5	-75.1	167.6	0	0	0	110.4	E996 L998 L1058 V1072 K1073 L1079 T1080	E996-I1076 HydrophobicContact CB-CD1 3.77Å; E996-I1076 WeakPolarHBondContact OE2-CD1 3.27Å; L998-I1076 HydrophobicContact CB-CG1 4.27Å; L998-I1076 HydrophobicContact CB-CG2 4.5Å; L998-I1076 HydrophobicContact CD2-CG1 3.73Å; L1058-I1076 HydrophobicContact CD2-CD1 4.37Å; L1058-I1076 HydrophobicContact CD2-CG1 3.84Å; V1072-I1076 HydrophobicContact CG1-CD1 3.67Å; V1072-I1076 WeakPolarHBondContact O-CB 3.36Å; V1072-I1076 WeakPolarHBondContact O-CD1 3.37Å; V1072-I1076 WeakPolarHBondContact O-CG1 3.42Å; V1072-I1076 PolarHBondContact O-N 3.27Å; K1073-I1076 PolarHBondContact O-N 3Å; I1076-L1079 PolarHBondContact O-N 2.99Å; I1076-T1080 HydrophobicContact CG2-CG2 4.44Å; I1076-T1080 WeakPolarHBondContact O-CB 2.84Å; I1076-T1080 WeakPolarHBondContact O-CG2 3.25Å; I1076-T1080 PolarHBondContact O-N 2.74Å; I1076-T1080 PolarHBondContact O-OG1 3.09Å
1077	Q	85.5	Confident	85	Confident	108 Å²	108	44.3 Å²	44.3	51%	0.505	23%	0.225	S	C	.	.	H	α-helix	trans	-60.8	-47.1	177.5	-176	174.4	-32.5	0	0	111.1	K1073 V1075 L1079 T1080 Q1081	K1073-Q1077 WeakPolarHBondContact O-CB 3.37Å; K1073-Q1077 PolarHBondContact O-N 2.58Å; V1075-Q1077 VanDerWaalsContact C-N 3.33Å; V1075-Q1077 PolarHBondContact O-N 2.83Å; Q1077-L1079 VanDerWaalsContact C-N 3.31Å; Q1077-L1079 PolarHBondContact O-N 3.06Å; Q1077-T1080 PolarHBondContact O-N 3.02Å; Q1077-T1080 PolarHBondContact O-OG1 3.23Å; Q1077-Q1081 HydrophobicContact CG-CG 4.34Å; Q1077-Q1081 WeakPolarHBondContact O-CB 3.28Å; Q1077-Q1081 WeakPolarHBondContact O-CG 3.48Å; Q1077-Q1081 PolarHBondContact O-N 2.99Å
1078	A	83.4	Confident	84.8	Confident	18 Å²	18	47.4 Å²	47.4	15%	0.149	24%	0.241	C	C	.	.	H	α-helix	trans	-65.6	-29.2	178.2	0	0	0	0	0	114.1	K1013 T1017 D1074 V1075	K1013-A1078 WeakPolarHBondContact CD-O 3.13Å; K1013-A1078 VanDerWaalsContact CE-O 3.29Å; K1013-A1078 WeakPolarHBondContact CE-O 3.45Å; K1013-A1078 PolarHBondContact NZ-O 2.95Å; T1017-A1078 HydrophobicContact CG2-CB 4.14Å; T1017-A1078 WeakPolarHBondContact OG1-CB 3.39Å; D1074-A1078 WeakPolarHBondContact O-CB 3.43Å; D1074-A1078 PolarHBondContact O-N 2.97Å; V1075-A1078 PolarHBondContact O-N 2.68Å
1079	L	81.4	Confident	84.6	Confident	1 Å²	1	51 Å²	51	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-85.1	-15.3	176.9	-70.7	174.1	0	0	0	113.8	L998 L1000 P1001 K1013 V1014 L1048 V1075 I1076 Q1077	L998-L1079 HydrophobicContact CD2-CD1 4.2Å; L1000-L1079 HydrophobicContact CD2-CB 4.14Å; L1000-L1079 HydrophobicContact CD2-CD1 4.41Å; L1000-L1079 HydrophobicContact CD2-CD2 4.36Å; P1001-L1079 VanDerWaalsContact CD-O 3.26Å; P1001-L1079 WeakPolarHBondContact CD-O 3.26Å; K1013-L1079 HydrophobicContact CB-CD2 4.27Å; K1013-L1079 HydrophobicContact CD-CD2 4.34Å; V1014-L1079 HydrophobicContact CG2-CD1 4.33Å; V1014-L1079 HydrophobicContact CG2-CD2 4.26Å; L1048-L1079 HydrophobicContact CD2-CD1 3.87Å; V1075-L1079 HydrophobicContact CG1-CD1 3.72Å; V1075-L1079 HydrophobicContact CG1-CG 4.26Å; V1075-L1079 WeakPolarHBondContact O-CB 3.33Å; V1075-L1079 VanDerWaalsContact O-CG 3.31Å; V1075-L1079 WeakPolarHBondContact O-CG 3.29Å; V1075-L1079 PolarHBondContact O-N 3.2Å; I1076-L1079 PolarHBondContact O-N 2.99Å; Q1077-L1079 VanDerWaalsContact C-N 3.31Å; Q1077-L1079 PolarHBondContact O-N 3.06Å
1080	T	77	Confident	84.2	Confident	63 Å²	63	50.8 Å²	50.8	39%	0.387	25%	0.253	S	S	.	.	H	α-helix	trans	-105	-18.5	-179.7	50.9	0	0	0	0	114.5	I1076 Q1077	I1076-T1080 HydrophobicContact CG2-CG2 4.44Å; I1076-T1080 WeakPolarHBondContact O-CB 2.84Å; I1076-T1080 WeakPolarHBondContact O-CG2 3.25Å; I1076-T1080 PolarHBondContact O-N 2.74Å; I1076-T1080 PolarHBondContact O-OG1 3.09Å; Q1077-T1080 PolarHBondContact O-N 3.02Å; Q1077-T1080 PolarHBondContact O-OG1 3.23Å
1081	Q	65.4	Low	83.9	Confident	169 Å²	169	49.9 Å²	49.9	79%	0.79	25%	0.249	S	C	*	.			trans	-81.5	0	167.8	-69.1	-176.5	-11.8	0	0	112.2	K1013 Q1077	K1013-Q1081 PolarHBondContact NZ-OXT 2.89Å; Q1077-Q1081 HydrophobicContact CG-CG 4.34Å; Q1077-Q1081 WeakPolarHBondContact O-CB 3.28Å; Q1077-Q1081 WeakPolarHBondContact O-CG 3.48Å; Q1077-Q1081 PolarHBondContact O-N 2.99Å

Retrieved 1,081 of 1,081 residues in 181.1 ms (Link to these results)

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